A0A087XYL5_POEFO Loading...

S1 RNA-binding domain-containing protein 1

AlphaFold DB , UniProt , Accession A0A087XYL5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,002 aa.

						>A0A087XYL5_POEFO|A0A087XYL5
MMRRPRATTAKAVIYNENENTDSEQSFAQMASSDEEVDEWKPSESTKATGKVARAPTGGGMKAAPKRTAKPKQPKVPKQPKVPKPRAPRKRAAEQKGAAMSVSVGKKRKKSNGDDLGENEMKTQTGCPEEQKTEKRGNSVRMKEERISFIVSDAHRTDEGTSHSALQVKKEEAPEEDFTFDEPSLKKQKTSETSQRQRPTFPESGAHSLRNELNMNWDLTEVLSTLTCVERWVCGNIIKLLREENTVPFMVRYRKEMINHMDADAVRDIQMVYEELCSLAKKTQSVIQTLKKDGVLTPELEESLRSCRSADDLDHVYTPYKKGSKLTKARRAKALGLEDAATALLNAPQTLVLSAWVKPGTEGLSCVEEVATGMEHILADMIAKDPETLTYIKTLCEKSFVTIQSSVSKTALKEKEQEKVAQEHKKPGAEHQKKKDFDKFQLYFDFTCNVQRIQPHQTLAINRGESLKILTVKVNIPDRVKSDFTRWCINNRWRPKTFAREELHAILRNAVEDSYKRLILPFLTRSYRTKLTSAAEKESIAMFVRNLRQRLLVCPVRGSVIMGVDPGFRHGCKLAILSPTSQILHTDVVFLHNSGQQKEAVKLRHLMATYSCTKVVIGNGTACRETESFFADLISRRYFHPLDVSYCITNEAGASIYSVSPEAVKEMPDLDPNLRSAVSIGRRVQDPLAELVKIDPKHIGIGTYQHDVSAGALKAALDGVVEECVSFVGVDINICSETLMRHVAGLNAGRARSIAEWREKNGPFINREQLKLVKGMGPKSYQQCAGFIRINPQTLNSAKPLPPCAPENPAPKKSKGKAGCSVPTSLNPLDQTCIHPESYHVAQRFLSLVGGSVDQIGSAGLKHCVESKVNTSCIEELAKKVDTTPETLKLIIDGLTQPPGFDIRQNFGQADFKRGIVSMSDLRVGAVLTGRVDNTTLFGAFVDIGVGRSGLIHKSHITLDKLPASQRRRSLALGPGERVEVRVLDVDAQRGRIGLDLIRVLQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.2	Very low	26.6	Very low	251 Å²	251	179.6 Å²	179.6	100%	1.236	91%	0.905	S	S	*	*				0	123.5	0	-80.8	176.2	163.8	0	0	108.8
2	M	25.1	Very low	26.3	Very low	190 Å²	190	171.9 Å²	171.9	94%	0.936	89%	0.89	S	S	*	*			trans	-76.2	145.8	166.2	-70.9	-176.5	173.2	0	0	110.1
3	R	27.1	Very low	26.3	Very low	251 Å²	251	169.9 Å²	169.9	95%	0.947	89%	0.889	S	S	*	*			trans	-149.5	141.4	147.5	-110.6	172.2	-169	-166.2	2.4	110.7
4	R	26	Very low	26.1	Very low	234 Å²	234	167.4 Å²	167.4	88%	0.883	88%	0.875	S	S	*	*	P	Polyproline II helix	trans	-81.7	152.8	-167.3	-58.6	168.5	176.5	168.3	-4.2	112
5	P	28.4	Very low	26	Very low	129 Å²	129	170.3 Å²	170.3	84%	0.838	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-73.1	147.8	159.2	31.4	-31.3	0	0	0	110.8
6	R	26.3	Very low	25.9	Very low	249 Å²	249	168.3 Å²	168.3	94%	0.94	86%	0.863	S	S	*	*	P	Polyproline II helix	trans	-88.9	148.7	174.7	-80.9	178.5	166.9	169.8	-6	110.8
7	A	25.5	Very low	25.9	Very low	93 Å²	93	168.8 Å²	168.8	77%	0.769	86%	0.861	S	S	*	*			trans	-116.5	142.9	168.4	0	0	0	0	0	110.1
8	T	26.7	Very low	25.8	Very low	128 Å²	128	168.6 Å²	168.6	79%	0.785	86%	0.862	S	S	*	*			trans	-152	98.8	163.7	19.6	0	0	0	0	110.4
9	T	25	Very low	25.8	Very low	136 Å²	136	169.1 Å²	169.1	83%	0.834	86%	0.861	S	S	*	*				50.4	113.2	123.3	58.4	0	0	0	0	120.5
10	A	25.4	Very low	25.7	Very low	107 Å²	107	169 Å²	169	88%	0.884	86%	0.863	S	S	*	*			trans	-116.8	143.3	148.5	0	0	0	0	0	109
11	K	25.2	Very low	25.6	Very low	208 Å²	208	166.7 Å²	166.7	90%	0.904	86%	0.856	S	S	*	*			trans	-81.2	146.8	-172	-71.5	178	174.6	179.4	0	112.4
12	A	22.6	Very low	25.2	Very low	87 Å²	87	161.9 Å²	161.9	72%	0.719	84%	0.836	S	S	*	*			trans	-80.6	149.5	166.4	0	0	0	0	0	111.6
13	V	26	Very low	25.1	Very low	146 Å²	146	158.6 Å²	158.6	89%	0.885	83%	0.832	S	S	*	*			trans	-133.8	128.5	157.4	179	0	0	0	0	106.6
14	I	23.9	Very low	25	Very low	134 Å²	134	155.8 Å²	155.8	69%	0.687	83%	0.829	S	S	*	*			trans	-107.9	168.7	176.9	-67.1	171.7	0	0	0	107.7
15	Y	24.5	Very low	24.9	Very low	212 Å²	212	154 Å²	154	83%	0.831	83%	0.831	S	S	*	*			trans	111.6	131.8	172.5	-67.4	-67.1	0	0	0	112.9
16	N	24.4	Very low	24.8	Very low	137 Å²	137	153.2 Å²	153.2	73%	0.733	83%	0.829	S	S	*	*			cis	-156.7	164.8	-18.6	-138.3	27.3	0	0	0	109.2
17	E	25.4	Very low	24.6	Very low	178 Å²	178	150.3 Å²	150.3	83%	0.832	82%	0.823	S	S	*	*			trans	-71.1	150.3	171.1	-64.3	171.5	138.9	0	0	111.8
18	N	24.6	Very low	24.6	Very low	164 Å²	164	150.7 Å²	150.7	88%	0.877	83%	0.826	S	S	*	*			trans	-161.8	151.3	142.1	-111.4	-7.2	0	0	0	111.9
19	E	26.1	Very low	24.5	Very low	179 Å²	179	152.9 Å²	152.9	84%	0.836	83%	0.827	S	S	*	*			trans	-79.1	155.5	-166.1	-55.7	169.6	127	0	0	113.9
20	N	24.5	Very low	24.6	Very low	167 Å²	167	154.6 Å²	154.6	89%	0.893	83%	0.828	S	S	*	*			trans	-157.5	148.1	142.6	-116.2	-26.3	0	0	0	111.6
21	T	23.1	Very low	24.6	Very low	120 Å²	120	153.4 Å²	153.4	74%	0.736	82%	0.818	S	S	*	*			trans	-95.9	162.8	-163.9	36.7	0	0	0	0	115
22	D	22.6	Very low	24.6	Very low	151 Å²	151	147.6 Å²	147.6	81%	0.807	80%	0.804	S	S	*	*			trans	48.7	116.5	158.4	-66.1	-22.7	0	0	0	120.8
23	S	23.5	Very low	24.9	Very low	121 Å²	121	147.8 Å²	147.8	85%	0.846	80%	0.8	S	S	*	*				-177.3	138.6	100.3	36	0	0	0	0	112.8
24	E	25.1	Very low	24.9	Very low	191 Å²	191	147.3 Å²	147.3	89%	0.893	79%	0.792	S	S	*	*			trans	-70.1	129.8	171.2	-61	-178.4	126.5	0	0	111.1
25	Q	23.6	Very low	25.2	Very low	198 Å²	198	147.8 Å²	147.8	93%	0.925	79%	0.792	S	S	*	*			trans	-152.6	117.7	150	-120.3	163.7	62.3	0	0	112.1
26	S	26.4	Very low	25.4	Very low	112 Å²	112	145.4 Å²	145.4	78%	0.783	79%	0.788	S	S	*	*			trans	-76.2	128.5	-178.2	48.3	0	0	0	0	111.7
27	F	22.8	Very low	25.8	Very low	188 Å²	188	144.3 Å²	144.3	83%	0.825	79%	0.786	S	S	*	*			trans	-143.5	100.6	163.3	-124.9	-88.8	0	0	0	111	Q29	F27-Q29 HydrophobicContact CD1-CG 4.46Å
28	A	24.2	Very low	25.9	Very low	100 Å²	100	142 Å²	142	83%	0.826	78%	0.779	S	S	*	*			trans	-79.9	123	172.7	0	0	0	0	0	109.7
29	Q	25.5	Very low	25.9	Very low	174 Å²	174	141 Å²	141	81%	0.813	77%	0.77	S	S	*	*			trans	-123.7	117.9	167.1	-80.8	-172.1	-24.7	0	0	110.3	F27	F27-Q29 HydrophobicContact CD1-CG 4.46Å
30	M	28.1	Very low	25.9	Very low	172 Å²	172	143.2 Å²	143.2	85%	0.847	77%	0.77	S	S	*	*			trans	-73.7	130.8	-179.5	-72.9	-84.8	-174.3	0	0	110.7
31	A	24.6	Very low	25.9	Very low	82 Å²	82	142 Å²	142	68%	0.678	76%	0.757	S	S	*	*			trans	-97.2	93.6	156	0	0	0	0	0	108.8
32	S	26	Very low	26	Very low	87 Å²	87	141 Å²	141	61%	0.608	75%	0.753	S	S	*	*			trans	-125.4	130.2	160.5	-171.9	0	0	0	0	106.8	D34	S32-D34 PolarHBondContact O-N 3.45Å
33	S	27.9	Very low	26.1	Very low	91 Å²	91	139.4 Å²	139.4	64%	0.636	75%	0.754	S	S	*	*			trans	-84	98.3	-177.1	50.9	0	0	0	0	110.3	E35	S33-E35 PolarHBondContact O-N 2.93Å; S33-E35 VanDerWaalsContact O-N 3.16Å
34	D	25.5	Very low	26.1	Very low	135 Å²	135	142.6 Å²	142.6	72%	0.722	76%	0.755	S	S	*	*			trans	-63	111.4	164.8	-66	-37.4	0	0	0	108.8	S32 E36	S32-D34 PolarHBondContact O-N 3.45Å; D34-E36 PolarHBondContact O-N 3.33Å
35	E	31.8	Very low	26.1	Very low	144 Å²	144	138.5 Å²	138.5	67%	0.673	75%	0.747	S	S	*	*			trans	-84.3	86.8	161.6	-68.3	-158.2	145.2	0	0	107.6	S33 V37	S33-E35 PolarHBondContact O-N 2.93Å; S33-E35 VanDerWaalsContact O-N 3.16Å; E35-V37 PolarHBondContact O-N 3.04Å
36	E	28.7	Very low	26.2	Very low	163 Å²	163	136 Å²	136	76%	0.762	75%	0.746	S	S	*	*			trans	-61.5	123.6	172.9	-71.2	-169.9	145.9	0	0	110.3	D34 D38	D34-E36 PolarHBondContact O-N 3.33Å; E36-D38 PolarHBondContact O-N 2.61Å
37	V	31	Very low	26.1	Very low	113 Å²	113	139.7 Å²	139.7	69%	0.685	75%	0.748	S	S	*	*			trans	-70.9	113.7	174.7	-179.6	0	0	0	0	108.6	E35 E39	E35-V37 PolarHBondContact O-N 3.04Å; V37-E39 PolarHBondContact O-N 2.85Å; V37-E39 VanDerWaalsContact O-N 3.11Å
38	D	28.2	Very low	26.3	Very low	130 Å²	130	135.5 Å²	135.5	70%	0.695	75%	0.748	S	S	*	*			trans	-59	116.2	175.8	-91.7	-37.5	0	0	0	110.4	E36 W40 K433	E36-D38 PolarHBondContact O-N 2.61Å; D38-W40 PolarHBondContact O-N 3.29Å; D38-K433 IonicContact OD1-NZ 3.27Å; D38-K433 PolarHBondContact OD1-NZ 2.96Å
39	E	25.9	Very low	26.3	Very low	144 Å²	144	137.9 Å²	137.9	67%	0.673	75%	0.753	S	S	*	*			trans	-66.8	101.7	176.2	-170.6	-163.4	171.5	0	0	109.9	V37 K41	V37-E39 PolarHBondContact O-N 2.85Å; V37-E39 VanDerWaalsContact O-N 3.11Å; E39-K41 PolarHBondContact O-N 3.09Å; E39-K41 VanDerWaalsContact O-N 3.13Å; E39-K41 WeakPolarHBondContact OE1-CE 3.44Å; E39-K41 IonicContact OE1-NZ 2.69Å; E39-K41 PolarHBondContact OE1-NZ 3.5Å; E39-K41 IonicContact OE2-NZ 2.7Å; E39-K41 PolarHBondContact OE2-NZ 2.76Å
40	W	25.3	Very low	26.3	Very low	225 Å²	225	133.2 Å²	133.2	85%	0.852	75%	0.751	S	S	*	*			trans	-69.2	109.9	-179.9	-178.3	66	0	0	0	111.7	D38	D38-W40 PolarHBondContact O-N 3.29Å
41	K	24.8	Very low	26.3	Very low	140 Å²	140	134.6 Å²	134.6	61%	0.609	75%	0.752	S	S	*	*			trans	-107	131.6	166.7	-73.9	175.6	174.3	134.4	0	109.8	E39	E39-K41 PolarHBondContact O-N 3.09Å; E39-K41 VanDerWaalsContact O-N 3.13Å; E39-K41 WeakPolarHBondContact OE1-CE 3.44Å; E39-K41 IonicContact OE1-NZ 2.69Å; E39-K41 PolarHBondContact OE1-NZ 3.5Å; E39-K41 IonicContact OE2-NZ 2.7Å; E39-K41 PolarHBondContact OE2-NZ 2.76Å
42	P	23.7	Very low	26.4	Very low	100 Å²	100	137.5 Å²	137.5	65%	0.649	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-69.5	133.8	178.6	29.1	-34	0	0	0	110.3	E44	P42-E44 PolarHBondContact O-N 2.81Å
43	S	25.7	Very low	26.4	Very low	118 Å²	118	138.2 Å²	138.2	83%	0.825	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-80.4	118	177.7	42.7	0	0	0	0	111.6	S45	S43-S45 PolarHBondContact O-N 2.97Å
44	E	24	Very low	26.3	Very low	188 Å²	188	145.9 Å²	145.9	88%	0.879	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-67	126.7	164.6	-69.1	-171.2	142.5	0	0	109.8	P42 T46	P42-E44 PolarHBondContact O-N 2.81Å; E44-T46 PolarHBondContact O-N 3.31Å; E44-T46 VanDerWaalsContact O-N 3.16Å
45	S	25.4	Very low	26.3	Very low	104 Å²	104	144 Å²	144	73%	0.727	79%	0.791	S	S	*	*			trans	-78.6	100.1	-178.1	63.9	0	0	0	0	111.7	S43 K47	S43-S45 PolarHBondContact O-N 2.97Å; S45-K47 PolarHBondContact O-N 3.23Å
46	T	24.2	Very low	26.6	Very low	145 Å²	145	143.5 Å²	143.5	89%	0.89	80%	0.8	S	S	*	*			trans	-68.2	98.2	166.8	24.2	0	0	0	0	110.7	E44 A48	E44-T46 PolarHBondContact O-N 3.31Å; E44-T46 VanDerWaalsContact O-N 3.16Å; T46-A48 PolarHBondContact O-N 3.26Å
47	K	25.2	Very low	26.6	Very low	190 Å²	190	142.7 Å²	142.7	83%	0.826	81%	0.807	S	S	*	*			trans	-74.3	113.5	171	-80.2	-176.4	174.7	178.1	0	110.5	S45	S45-K47 PolarHBondContact O-N 3.23Å
48	A	26.1	Very low	26.4	Very low	101 Å²	101	141.3 Å²	141.3	84%	0.835	82%	0.815	S	S	*	*			trans	-68.2	147.1	168.3	0	0	0	0	0	111.5	T46	T46-A48 PolarHBondContact O-N 3.26Å
49	T	25.8	Very low	26.3	Very low	150 Å²	150	139.4 Å²	139.4	92%	0.92	83%	0.826	S	S	*	*			trans	-83.8	139.3	-175.5	42	0	0	0	0	112.7
50	G	25.2	Very low	26.3	Very low	76 Å²	76	136.2 Å²	136.2	78%	0.784	83%	0.832	S	S	*	*			trans	-161.8	85.6	-177.5	0	0	0	0	0	115.3
51	K	26.5	Very low	26.5	Very low	200 Å²	200	132.9 Å²	132.9	87%	0.87	83%	0.828	S	S	*	*			trans	21.2	114.7	159.9	-66.8	-177.9	176.5	179.9	0	122
52	V	27.6	Very low	26.7	Very low	144 Å²	144	135.1 Å²	135.1	87%	0.873	84%	0.837	S	S	*	*				43.3	115.4	122.7	-172.8	0	0	0	0	120.6
53	A	26.6	Very low	26.8	Very low	102 Å²	102	135 Å²	135	84%	0.843	85%	0.845	S	S	*	*			trans	-152.3	149.3	138.8	0	0	0	0	0	110.6
54	R	24.8	Very low	26.9	Very low	251 Å²	251	134 Å²	134	95%	0.947	84%	0.844	S	S	*	*			trans	-85.4	148.6	-175.5	-88.7	173.4	159.8	171.4	-7.5	113.2
55	A	26.6	Very low	27.4	Very low	96 Å²	96	131.4 Å²	131.4	79%	0.793	84%	0.843	S	S	*	*			trans	-146.1	155.2	152.1	0	0	0	0	0	109.8
56	P	37	Very low	27.5	Very low	133 Å²	133	136.3 Å²	136.3	86%	0.864	85%	0.852	S	S	*	*			trans	-94.3	-173.4	-161	37.7	-37.4	0	0	0	116.5
57	T	28.4	Very low	27.7	Very low	147 Å²	147	141.3 Å²	141.3	90%	0.902	85%	0.854	S	S	*	*			trans	-79.4	152.4	-160.4	45.4	0	0	0	0	118.3
58	G	27	Very low	27.8	Very low	84 Å²	84	139.2 Å²	139.2	87%	0.866	86%	0.858	S	S	*	*			trans	140.3	132.5	161.8	0	0	0	0	0	111.2
59	G	26.7	Very low	27.9	Very low	89 Å²	89	139.2 Å²	139.2	92%	0.918	86%	0.857	S	S	*	*			cis	149.2	100.9	0.5	0	0	0	0	0	109.6
60	G	25.8	Very low	27.9	Very low	78 Å²	78	141.6 Å²	141.6	80%	0.804	86%	0.855	S	S	*	*			trans	167.8	144.3	-177.2	0	0	0	0	0	112.9
61	M	28.8	Very low	28.2	Very low	155 Å²	155	144.3 Å²	144.3	76%	0.764	86%	0.858	S	S	*	*			trans	-122.9	150.2	-156	-67.5	171.1	67.9	0	0	115.8
62	K	28.5	Very low	28.1	Very low	186 Å²	186	144.5 Å²	144.5	81%	0.809	86%	0.859	S	S	*	*			trans	66.8	149.1	151	-73.2	169.4	178.6	175.9	0	117.6
63	A	27.2	Very low	28.2	Very low	99 Å²	99	146.3 Å²	146.3	82%	0.818	86%	0.858	S	S	*	*			cis	-158.2	164.8	-11.7	0	0	0	0	0	110
64	A	26.9	Very low	28.6	Very low	96 Å²	96	147 Å²	147	79%	0.793	86%	0.855	S	S	*	*			trans	-138.9	144.3	176.8	0	0	0	0	0	112.5
65	P	35.1	Very low	28.6	Very low	133 Å²	133	144.3 Å²	144.3	86%	0.864	85%	0.85	S	S	*	*			trans	-90.8	166.1	177.1	35.1	-33.4	0	0	0	114.2
66	K	26.7	Very low	28.9	Very low	208 Å²	208	145.4 Å²	145.4	90%	0.904	85%	0.846	S	S	*	*			trans	-81.1	158.8	-162.5	-61.5	167.4	177.9	173.3	0	114.7
67	R	29.2	Very low	28.6	Very low	250 Å²	250	145.4 Å²	145.4	94%	0.943	85%	0.846	S	S	*	*			trans	-120.8	146.3	159.2	-115.2	179.3	170.7	-176.8	-3.6	110.3
68	T	27.5	Very low	28.6	Very low	146 Å²	146	147.3 Å²	147.3	90%	0.896	84%	0.842	S	S	*	*			trans	-91.7	165.1	-168.6	36.6	0	0	0	0	114.4
69	A	27.3	Very low	29	Very low	100 Å²	100	151 Å²	151	83%	0.826	84%	0.836	S	S	*	*			trans	-91.1	163.7	-167.8	0	0	0	0	0	115.2
70	K	27.1	Very low	29.2	Very low	201 Å²	201	153.2 Å²	153.2	87%	0.874	83%	0.834	S	S	*	*			trans	-105.3	147.2	167.5	-77.2	-174.5	173.6	-175.8	0	111.3
71	P	29.8	Very low	29.2	Very low	132 Å²	132	158 Å²	158	86%	0.857	83%	0.833	S	S	*	*			trans	-84.7	166.1	178.6	34.3	-35.1	0	0	0	114.2
72	K	25.8	Very low	29.3	Very low	204 Å²	204	156.8 Å²	156.8	89%	0.887	84%	0.835	S	S	*	*			trans	-117.2	156.6	175.8	-70.4	176.3	173.9	175.2	0	110.9
73	Q	29.9	Very low	29.4	Very low	182 Å²	182	153.7 Å²	153.7	85%	0.85	83%	0.833	S	S	*	*			trans	161.5	169.3	136.2	-94	-168.6	44.1	0	0	111
74	P	33.3	Very low	29.7	Very low	118 Å²	118	158.5 Å²	158.5	77%	0.766	84%	0.836	S	S	*	*			cis	-127.2	-151.7	-36.2	35.4	-16.2	0	0	0	111.9
75	K	25.5	Very low	29.9	Very low	194 Å²	194	160.3 Å²	160.3	84%	0.843	84%	0.839	S	S	*	*			trans	-146.5	141.4	-162.7	-128.3	-172.1	-175.5	-178.1	0	116.1
76	V	32.8	Very low	29.4	Very low	119 Å²	119	165.9 Å²	165.9	72%	0.721	84%	0.843	S	S	*	*			trans	63.6	153.7	160	-114.1	0	0	0	0	119.9
77	P	31.6	Very low	29.6	Very low	132 Å²	132	160.4 Å²	160.4	86%	0.857	84%	0.837	S	S	*	*				-136.8	-167.5	61.9	32.5	-9.2	0	0	0	117.3
78	K	28.6	Very low	29.7	Very low	188 Å²	188	154.7 Å²	154.7	82%	0.817	83%	0.832	S	S	*	*			trans	-123.2	144.3	-168.1	-78.1	-179.7	173.4	178	0	115.8
79	Q	33.8	Very low	29.5	Very low	161 Å²	161	158.9 Å²	158.9	75%	0.752	83%	0.832	S	S	*	*			trans	54.3	146.4	147.6	-66.4	-161.4	7.3	0	0	122.2
80	P	31	Very low	29.5	Very low	135 Å²	135	163.3 Å²	163.3	88%	0.877	83%	0.832	S	S	*	*				-140.8	-164.4	92.3	36.5	-18.2	0	0	0	115.5
81	K	27.8	Very low	29.3	Very low	178 Å²	178	165.3 Å²	165.3	77%	0.774	83%	0.834	S	S	*	*			trans	-140.5	149.5	-160.1	-121.1	-174.1	-178.7	179.5	0	113.9
82	V	29.5	Very low	29	Very low	131 Å²	131	163 Å²	163	79%	0.794	83%	0.826	S	S	*	*			trans	73.9	148	152	172.2	0	0	0	0	115.4
83	P	32	Very low	29.1	Very low	120 Å²	120	157.8 Å²	157.8	78%	0.779	82%	0.821	S	S	*	*			cis	-134.5	178.6	30.9	27.3	-1.4	0	0	0	120.1
84	K	32.3	Very low	28.9	Very low	200 Å²	200	156.3 Å²	156.3	87%	0.87	81%	0.814	S	S	*	*			trans	-78.4	163.3	169	-63.2	176.2	174.8	178.2	0	112.9
85	P	30.6	Very low	28.5	Very low	134 Å²	134	156.8 Å²	156.8	87%	0.87	81%	0.806	S	S	*	*			trans	-120.2	-179.2	142.2	30.1	-15.5	0	0	0	114.1
86	R	24.7	Very low	28.6	Very low	250 Å²	250	156.6 Å²	156.6	94%	0.943	81%	0.805	S	S	*	*			trans	-126.7	156.8	-159.1	-160.6	-178.8	-170.4	-174.3	3.6	110.6
87	A	31.6	Very low	28.3	Very low	93 Å²	93	154 Å²	154	77%	0.769	80%	0.802	S	S	*	*			trans	-75.8	160.2	-176.5	0	0	0	0	0	115.3
88	P	30.6	Very low	28	Very low	131 Å²	131	152.8 Å²	152.8	85%	0.851	80%	0.803	S	S	*	*			trans	-112	179.7	153.8	35.7	-25	0	0	0	113.7
89	R	24.6	Very low	27.8	Very low	234 Å²	234	147.7 Å²	147.7	88%	0.883	80%	0.796	S	S	*	*			trans	-117.6	149.9	-160.4	-69.5	167.1	154.8	175.6	-6.9	114.8
90	K	26.2	Very low	27.3	Very low	193 Å²	193	148.5 Å²	148.5	84%	0.839	80%	0.803	S	S	*	*			trans	52.7	153.4	135.6	-77.9	-168.7	169.1	-174.7	0	123.3
91	R	22.9	Very low	26.9	Very low	243 Å²	243	146.2 Å²	146.2	92%	0.917	79%	0.789	S	S	*	*			trans	83.4	146.3	161.6	-70.1	-175.8	176.4	179.5	-1.6	116
92	A	24.7	Very low	26.7	Very low	82 Å²	82	143.7 Å²	143.7	68%	0.678	79%	0.789	S	S	*	*			cis	-168.4	154.5	-18.1	0	0	0	0	0	111
93	A	26.7	Very low	26.4	Very low	95 Å²	95	141.9 Å²	141.9	79%	0.785	78%	0.782	S	S	*	*			trans	61.7	165.8	156	0	0	0	0	0	116.9
94	E	26.4	Very low	26.1	Very low	151 Å²	151	143.1 Å²	143.1	71%	0.706	79%	0.787	S	S	*	*			cis	-143	155.4	12.8	-79.4	-169	116	0	0	112
95	Q	25.7	Very low	25.7	Very low	129 Å²	129	137.4 Å²	137.4	60%	0.603	79%	0.785	S	S	*	*			trans	45.7	155	130.4	-60.4	174.6	32.6	0	0	121
96	K	26.6	Very low	25.4	Very low	189 Å²	189	140.6 Å²	140.6	82%	0.822	79%	0.785	S	S	*	*			cis	-163.1	163	2.3	-107.4	153.2	-179.8	158.5	0	103.9
97	G	25.8	Very low	25.4	Very low	64 Å²	64	137.8 Å²	137.8	66%	0.66	78%	0.78	S	S	*	*			cis	-144.6	171.8	-6.5	0	0	0	0	0	108.1
98	A	25.2	Very low	25	Very low	107 Å²	107	143.8 Å²	143.8	88%	0.884	78%	0.783	S	S	*	*				58.1	135.3	74.5	0	0	0	0	0	114
99	A	24.3	Very low	24.8	Very low	81 Å²	81	145.3 Å²	145.3	67%	0.669	78%	0.776	S	S	*	*			cis	-172.5	165.3	-15.3	0	0	0	0	0	108.2
100	M	24.5	Very low	24.8	Very low	179 Å²	179	142.6 Å²	142.6	88%	0.882	77%	0.77	S	S	*	*			trans	66.1	158	152.9	-73.8	173.2	73.7	0	0	117.6
101	S	22.9	Very low	24.7	Very low	86 Å²	86	138 Å²	138	60%	0.601	76%	0.762	S	S	*	*			cis	-174	162.6	-16.3	52	0	0	0	0	111.5
102	V	23.8	Very low	24.8	Very low	125 Å²	125	133 Å²	133	76%	0.758	75%	0.754	S	S	*	*			trans	73.2	98.8	139.9	167.8	0	0	0	0	120
103	S	23	Very low	24.9	Very low	94 Å²	94	132.1 Å²	132.1	66%	0.657	75%	0.753	S	S	*	*				67.2	133	117.1	95.8	0	0	0	0	124.6
104	V	24.6	Very low	24.9	Very low	146 Å²	146	134.3 Å²	134.3	89%	0.885	75%	0.751	S	S	*	*			trans	66.1	124.5	130.7	175.9	0	0	0	0	120.5
105	G	23.7	Very low	24.9	Very low	80 Å²	80	134 Å²	134	83%	0.825	76%	0.755	S	S	*	*			trans	179.6	105.4	161.8	0	0	0	0	0	116.7
106	K	25.6	Very low	25	Very low	200 Å²	200	135.9 Å²	135.9	87%	0.87	77%	0.768	S	S	*	*			trans	-78.8	149.6	175.5	-78.6	168	168.4	166.3	0	114
107	K	23.5	Very low	25	Very low	191 Å²	191	130 Å²	130	83%	0.83	76%	0.76	S	S	*	*				177.1	128.2	125.2	-95.9	159.9	-177.1	176.8	0	109.9
108	R	24.5	Very low	25.1	Very low	220 Å²	220	136.1 Å²	136.1	83%	0.83	77%	0.772	S	S	*	*				62.4	138.4	86.5	-78.5	-176.4	164.1	-179.3	-4.1	112.9
109	K	24.9	Very low	25.1	Very low	163 Å²	163	138.4 Å²	138.4	71%	0.709	77%	0.77	S	S	*	*			cis	-170.6	160.8	25.6	-143.6	-178.5	179.5	179.7	0	113.1
110	K	25.4	Very low	25.2	Very low	177 Å²	177	142.2 Å²	142.2	77%	0.77	77%	0.773	S	S	*	*			trans	69.2	152.9	153.7	-91.2	-173.7	171.2	-162.1	0	118.6
111	S	24.7	Very low	25.3	Very low	96 Å²	96	140.2 Å²	140.2	67%	0.671	76%	0.764	S	S	*	*			cis	-153.1	154.5	9.9	40.4	0	0	0	0	114.2
112	N	25.5	Very low	25.4	Very low	138 Å²	138	143.9 Å²	143.9	74%	0.738	77%	0.769	S	S	*	*			trans	27.6	147.1	148.4	-55.5	36.9	0	0	0	120.4
113	G	26	Very low	25.4	Very low	64 Å²	64	143.1 Å²	143.1	66%	0.66	76%	0.764	S	S	*	*			cis	152.5	176.1	13	0	0	0	0	0	109.7
114	D	27.3	Very low	25.5	Very low	140 Å²	140	146.7 Å²	146.7	75%	0.749	77%	0.771	S	S	*	*			cis	-159.7	-157.7	-12.2	-72.2	-48.6	0	0	0	107.8
115	D	25.4	Very low	25.5	Very low	146 Å²	146	146.5 Å²	146.5	78%	0.781	77%	0.77	S	S	*	*			trans	63.8	124.8	179.9	-73.5	-12.8	0	0	0	119.9
116	L	28.8	Very low	25.5	Very low	168 Å²	168	146.2 Å²	146.2	88%	0.88	77%	0.767	S	S	*	*			cis	85.2	131.9	36.3	-61.6	175.4	0	0	0	114.2
117	G	25.7	Very low	25.3	Very low	64 Å²	64	142.8 Å²	142.8	66%	0.66	77%	0.767	S	S	*	*			cis	-178.5	175.8	-5.2	0	0	0	0	0	113.3
118	E	27.5	Very low	25.6	Very low	193 Å²	193	139.2 Å²	139.2	90%	0.902	76%	0.763	S	S	*	*			trans	57.9	140.7	160.1	-58.4	-178.3	169.6	0	0	119.7
119	N	25.4	Very low	25.5	Very low	156 Å²	156	137 Å²	137	83%	0.834	76%	0.762	S	S	*	*				-167.1	176.6	58.2	-149.2	-23.6	0	0	0	113.4
120	E	26.8	Very low	25.5	Very low	160 Å²	160	136 Å²	136	75%	0.748	76%	0.76	S	S	*	*			trans	-94.3	174.1	-170.2	-59.1	-168.7	122	0	0	117.7
121	M	26.3	Very low	25.4	Very low	138 Å²	138	133.6 Å²	133.6	68%	0.68	75%	0.751	S	S	*	*			trans	97.8	127.9	138.3	-88.2	-159.2	-179.1	0	0	123.7
122	K	25.8	Very low	25.3	Very low	163 Å²	163	137.5 Å²	137.5	71%	0.709	76%	0.756	S	S	*	*				95	108.3	127.9	-87.9	176.7	179.8	157.6	0	124.8
123	T	23.3	Very low	25.2	Very low	108 Å²	108	138 Å²	138	66%	0.663	77%	0.765	S	S	*	*				60.9	132	125.4	43.4	0	0	0	0	125.5
124	Q	24.9	Very low	25.1	Very low	170 Å²	170	143.8 Å²	143.8	79%	0.794	78%	0.775	S	S	*	*			trans	51.8	127.7	135.5	-61.7	177.2	-9.6	0	0	120
125	T	24.1	Very low	24.9	Very low	142 Å²	142	147.1 Å²	147.1	87%	0.871	78%	0.782	S	S	*	*				179.4	169.8	80.5	29.9	0	0	0	0	107.4
126	G	23.2	Very low	24.8	Very low	73 Å²	73	152.4 Å²	152.4	75%	0.753	79%	0.791	S	S	*	*			cis	170	155.5	-0.6	0	0	0	0	0	109.2
127	C	21.4	Very low	24.5	Very low	129 Å²	129	148 Å²	148	87%	0.872	79%	0.787	S	S	*	*			trans	-98.7	164.1	172.1	-72	0	0	0	0	111.9
128	P	30.8	Very low	24.3	Very low	115 Å²	115	153.3 Å²	153.3	75%	0.747	80%	0.8	S	S	*	*				-132.9	150.5	116.3	22.9	-4	0	0	0	111.6
129	E	23.4	Very low	24.1	Very low	175 Å²	175	149.4 Å²	149.4	82%	0.818	79%	0.794	S	S	*	*				61.8	134.1	63.2	-70.6	-168.6	161.6	0	0	113.3
130	E	23.8	Very low	24.1	Very low	141 Å²	141	148.3 Å²	148.3	66%	0.659	79%	0.792	S	S	*	*			cis	-161.3	168.3	12.1	-129.5	-159	142.8	0	0	114.6
131	Q	22.3	Very low	23.9	Very low	127 Å²	127	151.8 Å²	151.8	59%	0.593	80%	0.799	S	S	*	*			trans	65.6	110.3	150.2	-66	-173.4	34.2	0	0	126.4
132	K	23.6	Very low	23.9	Very low	177 Å²	177	153.7 Å²	153.7	77%	0.77	81%	0.808	S	S	*	*				52.5	125.8	120.4	-64	173.8	-178.2	165.5	0	122.4
133	T	22.9	Very low	23.7	Very low	150 Å²	150	153.6 Å²	153.6	92%	0.92	81%	0.808	S	S	*	*				-157.4	144.1	119.4	4.7	0	0	0	0	112
134	E	23.9	Very low	23.8	Very low	185 Å²	185	157.3 Å²	157.3	86%	0.864	82%	0.817	S	S	*	*			trans	-85.8	153	177.7	-58.8	-176.6	128.1	0	0	112.4
135	K	23.9	Very low	23.7	Very low	210 Å²	210	156 Å²	156	91%	0.913	81%	0.811	S	S	*	*			trans	-157.8	122.8	138	-112.4	162.8	-169.5	175.7	0	112.3
136	R	22.4	Very low	23.6	Very low	257 Å²	257	160.4 Å²	160.4	97%	0.97	81%	0.812	S	S	*	*			trans	-72.5	148.3	169.3	-81	176.3	163.4	-169.9	-2	111
137	G	23	Very low	23.5	Very low	76 Å²	76	163.2 Å²	163.2	78%	0.784	81%	0.809	S	S	*	*			trans	-161.2	96.8	165.3	0	0	0	0	0	112
138	N	22.6	Very low	23.5	Very low	174 Å²	174	161.7 Å²	161.7	93%	0.93	80%	0.799	S	S	*	*			trans	-73.5	137.8	167.5	-87.9	-2.4	0	0	0	109.7
139	S	22.8	Very low	23	Very low	111 Å²	111	165.8 Å²	165.8	78%	0.776	81%	0.806	S	S	*	*			trans	-157.8	126	137.7	-154	0	0	0	0	113.1
140	V	25.5	Very low	22.9	Very low	133 Å²	133	164.6 Å²	164.6	81%	0.806	80%	0.803	S	S	*	*			trans	-79.6	138.8	159.8	169.6	0	0	0	0	107.7
141	R	22.3	Very low	22.8	Very low	234 Å²	234	163.7 Å²	163.7	88%	0.883	81%	0.807	S	S	*	*			trans	-160.2	121.6	147.9	-114	161.6	-170.7	-173.1	1.6	113.3
142	M	26.2	Very low	22.8	Very low	178 Å²	178	163 Å²	163	88%	0.877	82%	0.816	S	S	*	*			trans	-66.1	154.2	149.6	-65.3	169.3	117.5	0	0	108.9
143	K	22.2	Very low	22.7	Very low	160 Å²	160	161.7 Å²	161.7	70%	0.696	82%	0.818	S	S	*	*			trans	-149.9	113.3	148.2	-118.2	-168.9	172.2	-156.2	0	111	E145	K143-E145 WeakPolarHBondContact CE-OE1 3.13Å; K143-E145 WeakPolarHBondContact CE-OE2 3.37Å; K143-E145 IonicContact NZ-OE1 2.72Å; K143-E145 PolarHBondContact NZ-OE1 3.03Å; K143-E145 IonicContact NZ-OE2 3.78Å; K143-E145 PolarHBondContact NZ-OE2 3.31Å
144	E	25.4	Very low	22.7	Very low	186 Å²	186	159.3 Å²	159.3	87%	0.869	81%	0.813	S	S	*	*			trans	-68.6	151.2	144.4	-61.6	171.2	114.2	0	0	107.9
145	E	22	Very low	22.6	Very low	142 Å²	142	159 Å²	159	66%	0.664	81%	0.812	S	S	*	*			trans	-158.6	123	147.2	-117.2	150.7	-155.1	0	0	111.4	K143	K143-E145 WeakPolarHBondContact CE-OE1 3.13Å; K143-E145 WeakPolarHBondContact CE-OE2 3.37Å; K143-E145 IonicContact NZ-OE1 2.72Å; K143-E145 PolarHBondContact NZ-OE1 3.03Å; K143-E145 IonicContact NZ-OE2 3.78Å; K143-E145 PolarHBondContact NZ-OE2 3.31Å
146	R	22.1	Very low	22.5	Very low	235 Å²	235	160 Å²	160	89%	0.887	81%	0.809	S	S	*	*			trans	-80.5	155.5	157.2	-65.1	170.5	171.9	167	-4.8	108.3
147	I	21.1	Very low	22.4	Very low	133 Å²	133	153.8 Å²	153.8	68%	0.682	80%	0.801	S	S	*	*			trans	-175.5	100.7	147.7	-93.3	142.2	0	0	0	104.3
148	S	21.6	Very low	22.4	Very low	97 Å²	97	158 Å²	158	68%	0.678	81%	0.805	S	S	*	*				53.9	114.9	83.3	71.4	0	0	0	0	114.2
149	F	20.6	Very low	22.4	Very low	201 Å²	201	159.1 Å²	159.1	88%	0.882	81%	0.805	S	S	*	*			trans	-132.7	154.3	159.7	-105.7	-85.3	0	0	0	111.4
150	I	21.1	Very low	22.4	Very low	149 Å²	149	157 Å²	157	76%	0.764	80%	0.8	S	S	*	*			trans	-96	147	-152.6	-74.9	162.6	0	0	0	111.9
151	V	21.8	Very low	22.2	Very low	122 Å²	122	157.1 Å²	157.1	74%	0.739	80%	0.802	S	S	*	*			trans	-72.4	136.1	169.3	174.9	0	0	0	0	109.6
152	S	21.9	Very low	22.3	Very low	113 Å²	113	150.6 Å²	150.6	79%	0.79	79%	0.792	S	S	*	*			trans	-125.5	108.3	166.7	-63.4	0	0	0	0	109.3
153	D	21	Very low	22.2	Very low	149 Å²	149	151.1 Å²	151.1	80%	0.797	79%	0.792	S	S	*	*			trans	-69.6	146.6	171.5	-94.8	-50.4	0	0	0	111.7
154	A	22.5	Very low	22.2	Very low	100 Å²	100	149.6 Å²	149.6	83%	0.826	80%	0.801	S	S	*	*			trans	-143.3	95.8	165.1	0	0	0	0	0	110.1
155	H	21.8	Very low	22	Very low	179 Å²	179	144.7 Å²	144.7	83%	0.829	79%	0.793	S	S	*	*			trans	-62.6	136.1	168.8	-82.3	-83.8	0	0	0	111.9
156	R	22.7	Very low	22	Very low	230 Å²	230	145.8 Å²	145.8	87%	0.868	80%	0.802	S	S	*	*			trans	-160.2	101	140.9	-81.7	-137.9	175.7	175.8	-1	108.9
157	T	21.1	Very low	22	Very low	128 Å²	128	142.7 Å²	142.7	79%	0.785	80%	0.798	S	S	*	*				87.5	127.6	96.6	50.5	0	0	0	0	113.8
158	D	22.2	Very low	22.1	Very low	163 Å²	163	142.9 Å²	142.9	87%	0.872	81%	0.805	S	S	*	*			trans	-58.9	153.1	174.8	-64.6	-68.6	0	0	0	113.7
159	E	22.9	Very low	22.1	Very low	199 Å²	199	147.3 Å²	147.3	93%	0.93	81%	0.812	S	S	*	*				-157.8	141.1	124.9	-113.2	175	-157.4	0	0	109.4
160	G	21.9	Very low	22.3	Very low	66 Å²	66	147.4 Å²	147.4	68%	0.68	81%	0.812	S	S	*	*			trans	-102.9	-175.3	-178.3	0	0	0	0	0	113.2
161	T	22.3	Very low	22.4	Very low	136 Å²	136	149 Å²	149	83%	0.834	82%	0.816	S	S	*	*				165.6	149	118.1	-62.8	0	0	0	0	112.5
162	S	23.8	Very low	22.6	Very low	97 Å²	97	152.3 Å²	152.3	68%	0.678	82%	0.823	S	S	*	*			trans	62.4	101.2	157.2	54.1	0	0	0	0	122.2
163	H	23.5	Very low	22.7	Very low	189 Å²	189	151.5 Å²	151.5	88%	0.875	82%	0.824	S	S	*	*				13	129.9	117.8	-63.3	-84.7	0	0	0	120.5
164	S	22.6	Very low	23	Very low	127 Å²	127	150.1 Å²	150.1	89%	0.888	82%	0.823	S	S	*	*				-145.7	160.2	122.1	64	0	0	0	0	109.8
165	A	21.1	Very low	23.4	Very low	84 Å²	84	154.5 Å²	154.5	69%	0.694	83%	0.826	S	S	*	*			trans	-124.9	167.9	-168.1	0	0	0	0	0	112.6
166	L	22.5	Very low	24	Very low	165 Å²	165	153.7 Å²	153.7	86%	0.864	82%	0.823	S	S	*	*			trans	74.4	148.4	174.4	-52.1	159.1	0	0	0	113.1
167	Q	21.6	Very low	24.6	Very low	170 Å²	170	148.6 Å²	148.6	79%	0.794	81%	0.813	S	S	*	*			cis	-151.5	148.6	18.3	-149.7	169.3	37.4	0	0	111	K169	Q167-K169 PolarHBondContact O-N 3.24Å
168	V	23.9	Very low	25.8	Very low	137 Å²	137	145.8 Å²	145.8	83%	0.83	79%	0.79	S	S	*	*			trans	-75.6	121.4	174.6	174.6	0	0	0	0	109.9
169	K	21	Very low	27	Very low	189 Å²	189	141.8 Å²	141.8	82%	0.822	77%	0.771	S	S	*	*			trans	-113.3	137.6	157.5	-94.1	-174.5	174.5	-177.9	0	109.9	Q167	Q167-K169 PolarHBondContact O-N 3.24Å
170	K	25.5	Very low	28.2	Very low	204 Å²	204	135.5 Å²	135.5	89%	0.887	74%	0.741	S	S	*	*			trans	-100	110.9	-179.3	-171.9	-174.8	-173.7	-173.7	0	106.5
171	E	23.9	Very low	28.8	Very low	183 Å²	183	139.3 Å²	139.3	86%	0.855	75%	0.746	S	S	*	*			trans	-112.1	148.3	178.3	-117.2	165.1	-160.6	0	0	110.6
172	E	24.8	Very low	29.4	Very low	190 Å²	190	138.7 Å²	138.7	89%	0.888	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-78.8	155.7	-171.3	-65.3	176.2	124.3	0	0	111.7
173	A	24.1	Very low	29.8	Very low	97 Å²	97	138.7 Å²	138.7	80%	0.802	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-69.9	132.1	179.8	0	0	0	0	0	110.8
174	P	28.4	Very low	29.9	Very low	119 Å²	119	134.2 Å²	134.2	77%	0.773	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-72.1	150.5	177	30.4	-34.5	0	0	0	111.5
175	E	31	Very low	30.3	Very low	192 Å²	192	136.3 Å²	136.3	90%	0.897	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-66.7	140.4	172.4	-59.5	-170.6	136.2	0	0	110.5	D177	E175-D177 PolarHBondContact O-N 3.26Å
176	E	33.8	Very low	30.5	Very low	163 Å²	163	141.2 Å²	141.2	76%	0.762	73%	0.727	S	S	*	*			trans	-69.8	101.1	179.6	-69.2	-176.1	179.3	0	0	111.1
177	D	35.8	Very low	30.9	Very low	122 Å²	122	143.2 Å²	143.2	65%	0.652	73%	0.729	S	S	*	*			trans	-73.5	149.4	172.4	-154.2	-13.5	0	0	0	111.3	E175 T179	E175-D177 PolarHBondContact O-N 3.26Å; D177-T179 VanDerWaalsContact C-N 3.26Å; D177-T179 PolarHBondContact O-N 2.94Å
178	F	46.6	Very low	31.2	Very low	69 Å²	69	144.4 Å²	144.4	30%	0.303	73%	0.734	S	S	.	*			trans	-91.5	19	-178.5	-89	-98.2	0	0	0	112.8	K771 P778	F178-K771 HydrophobicContact CB-CD 4.36Å; F178-K771 HydrophobicContact CD1-CD 3.67Å; F178-K771 HydrophobicContact CD1-CG 3.96Å; F178-K771 HydrophobicContact CE1-CB 4.29Å; F178-K771 HydrophobicContact CE1-CD 4.26Å; F178-K771 HydrophobicContact CE1-CG 4.04Å; F178-K771 HydrophobicContact CG-CD 4.26Å; F178-P778 HydrophobicContact CD1-CB 4.11Å; F178-P778 HydrophobicContact CD1-CG 3.99Å; F178-P778 HydrophobicContact CD2-CG 4.16Å; F178-P778 HydrophobicContact CE1-CB 4.07Å; F178-P778 HydrophobicContact CE1-CG 3.71Å; F178-P778 HydrophobicContact CE2-CG 3.87Å; F178-P778 HydrophobicContact CG-CG 4.24Å; F178-P778 HydrophobicContact CZ-CG 3.66Å
179	T	46.3	Very low	31.3	Very low	79 Å²	79	147.9 Å²	147.9	49%	0.485	74%	0.738	S	S	.	*			trans	-79.3	136.8	176.2	47.4	0	0	0	0	111.2	D177 D181	D177-T179 VanDerWaalsContact C-N 3.26Å; D177-T179 PolarHBondContact O-N 2.94Å; T179-D181 PolarHBondContact O-N 3.47Å
180	F	47.4	Very low	31.7	Very low	67 Å²	67	145.5 Å²	145.5	29%	0.294	74%	0.74	S	S	.	*			trans	-89.2	83.6	173.9	-68.5	-74.8	0	0	0	109.6	E182 Y781 Q782 H835 P836 E837	F180-E182 PolarHBondContact O-N 2.62Å; F180-Y781 HydrophobicContact CE2-CD1 4.24Å; F180-Y781 AromaticContact CE2-CE1 3.87Å; F180-Y781 HydrophobicContact CE2-CE1 3.87Å; F180-Y781 AromaticContact CZ-CD1 3.74Å; F180-Y781 HydrophobicContact CZ-CD1 3.74Å; F180-Y781 AromaticContact CZ-CE1 3.78Å; F180-Y781 HydrophobicContact CZ-CE1 3.78Å; F180-Q782 HydrophobicContact CE1-CB 3.85Å; F180-Q782 HydrophobicContact CE1-CG 3.88Å; F180-H835 AromaticContact CZ-CE1 3.99Å; F180-P836 HydrophobicContact CE2-CB 4.37Å; F180-E837 HydrophobicContact CB-CB 4.09Å; F180-E837 HydrophobicContact CD1-CB 4.3Å; F180-E837 HydrophobicContact CD2-CB 4.33Å; F180-E837 HydrophobicContact CG-CB 4.01Å
181	D	34.8	Very low	31.6	Very low	147 Å²	147	141.2 Å²	141.2	79%	0.786	74%	0.736	S	S	*	*			trans	-72.8	113.8	172.7	-74.4	-23.7	0	0	0	110.6	T179	T179-D181 PolarHBondContact O-N 3.47Å
182	E	35.8	Very low	32	Very low	123 Å²	123	141.7 Å²	141.7	58%	0.575	74%	0.738	S	S	*	*			trans	-75.7	140.4	171.2	-165.9	170.2	-150.9	0	0	109.6	F180 S184	F180-E182 PolarHBondContact O-N 2.62Å; E182-S184 PolarHBondContact O-N 2.95Å
183	P	31.4	Very low	32	Very low	97 Å²	97	139.1 Å²	139.1	63%	0.63	74%	0.735	S	S	*	*			trans	-63.6	103.5	177.9	25	-34.3	0	0	0	110.9	L185	P183-L185 PolarHBondContact O-N 3.39Å; P183-L185 VanDerWaalsContact O-N 3.12Å
184	S	26	Very low	32.3	Very low	95 Å²	95	140.6 Å²	140.6	66%	0.664	74%	0.74	S	S	*	*			trans	-59.3	112.5	-170.5	66.7	0	0	0	0	113.4	E182 K186	E182-S184 PolarHBondContact O-N 2.95Å; S184-K186 PolarHBondContact O-N 3.5Å; S184-K186 VanDerWaalsContact O-N 3.1Å
185	L	30.4	Very low	32.5	Very low	171 Å²	171	143.4 Å²	143.4	90%	0.895	74%	0.743	S	S	*	*			trans	-76.1	92.1	167.4	-71.3	172.8	0	0	0	109.8	P183 K187	P183-L185 PolarHBondContact O-N 3.39Å; P183-L185 VanDerWaalsContact O-N 3.12Å; L185-K187 PolarHBondContact O-N 3.01Å
186	K	26.4	Very low	32.9	Very low	186 Å²	186	145.8 Å²	145.8	81%	0.809	74%	0.743	S	S	*	*			trans	-65.6	126	174.5	-75.7	-175.6	177.5	177.1	0	110.5	S184 Q188	S184-K186 PolarHBondContact O-N 3.5Å; S184-K186 VanDerWaalsContact O-N 3.1Å; K186-Q188 PolarHBondContact O-N 2.87Å
187	K	30.9	Very low	33.6	Very low	208 Å²	208	147.4 Å²	147.4	90%	0.904	75%	0.751	S	S	*	*			trans	-51.8	130.1	179.4	-66.3	175.2	177.4	175.1	0	112.2	L185	L185-K187 PolarHBondContact O-N 3.01Å
188	Q	27.3	Very low	34.7	Very low	194 Å²	194	149.3 Å²	149.3	91%	0.907	75%	0.749	S	S	*	*			trans	-117.2	149.5	160.2	-87.1	-172.1	-35.8	0	0	111.1	K186	K186-Q188 PolarHBondContact O-N 2.87Å
189	K	25.2	Very low	35.4	Very low	210 Å²	210	148.6 Å²	148.6	91%	0.913	75%	0.751	S	S	*	*			trans	-68.3	150.6	-178.9	-94.2	177.1	170	178.8	0	111.7
190	T	29.6	Very low	35.5	Very low	139 Å²	139	148.8 Å²	148.8	85%	0.853	75%	0.752	S	S	*	*			trans	-71.2	134.3	-178.4	46.1	0	0	0	0	114.1
191	S	24.6	Very low	35.7	Very low	115 Å²	115	148.1 Å²	148.1	80%	0.804	75%	0.749	S	S	*	*			trans	-142.6	133.3	145.8	57	0	0	0	0	108.1
192	E	30.9	Very low	36.2	Very low	193 Å²	193	146.2 Å²	146.2	90%	0.902	75%	0.745	S	S	*	*			trans	-77.9	125.8	-165.7	-61.8	176.1	129	0	0	113.4
193	T	24.7	Very low	36.4	Very low	136 Å²	136	148 Å²	148	83%	0.834	75%	0.754	S	S	*	*			trans	-159.3	131.3	144.4	-9.1	0	0	0	0	109.9	Q195	T193-Q195 PolarHBondContact O-N 3.29Å
194	S	30.9	Very low	36.9	Very low	128 Å²	128	149 Å²	149	90%	0.895	76%	0.763	S	S	*	*			trans	-81.3	83.6	-169.5	41.1	0	0	0	0	113.2
195	Q	32.8	Very low	37.7	Very low	178 Å²	178	146.7 Å²	146.7	83%	0.832	75%	0.754	S	S	*	*			trans	-118.1	137.2	159.2	-70	-173.1	-5.8	0	0	110.1	T193 Q197	T193-Q195 PolarHBondContact O-N 3.29Å; Q195-Q197 PolarHBondContact O-N 3.29Å
196	R	39.9	Very low	38.1	Very low	242 Å²	242	141.3 Å²	141.3	91%	0.913	73%	0.734	S	S	*	*			trans	-61.3	108.2	173	-77.6	-177.9	173.6	-175	-3.7	109	R198	R196-R198 PolarHBondContact O-N 3.49Å
197	Q	46.9	Very low	38.7	Very low	196 Å²	196	140 Å²	140	92%	0.916	73%	0.73	S	S	*	*			trans	-59	120.9	166.3	-76	-179.2	-26.3	0	0	108.3	Q195	Q195-Q197 PolarHBondContact O-N 3.29Å
198	R	59.6	Low	39.5	Very low	162 Å²	162	134.6 Å²	134.6	61%	0.611	72%	0.719	S	S	*	*			trans	-76.8	143.3	178.2	-63.3	176.1	-179.1	161.1	-2.4	108.7	R196 T200	R196-R198 PolarHBondContact O-N 3.49Å; R198-T200 HydrophobicContact CB-CG2 4.2Å; R198-T200 PolarHBondContact O-N 2.57Å; R198-T200 PolarHBondContact O-OG1 2.93Å
199	P	61.1	Low	40.5	Very low	54 Å²	54	127.6 Å²	127.6	35%	0.351	69%	0.688	S	S	.	*			trans	-74.7	71.9	173.1	31.1	-33.4	0	0	0	110.3	W232 N236 M257	P199-W232 HydrophobicContact CG-CH2 4.17Å; P199-W232 HydrophobicContact CG-CZ3 3.95Å; P199-N236 PolarHBondContact O-ND2 3.24Å; P199-M257 HydrophobicContact CB-CG 4.43Å
200	T	49.5	Very low	41.6	Very low	83 Å²	83	125.8 Å²	125.8	51%	0.509	68%	0.675	S	S	.	*	P	Polyproline II helix	trans	-92.7	126.2	170.7	46.8	0	0	0	0	109.2	R198 W232	R198-T200 HydrophobicContact CB-CG2 4.2Å; R198-T200 PolarHBondContact O-N 2.57Å; R198-T200 PolarHBondContact O-OG1 2.93Å; T200-W232 HydrophobicContact CG2-CB 4.26Å
201	F	51.7	Low	42.9	Very low	53 Å²	53	125.7 Å²	125.7	23%	0.232	67%	0.669	C	S	.	*	P	Polyproline II helix	trans	-58.4	149.7	164.8	-74.2	-73.3	0	0	0	110.6	E203 N236 K239 M257	F201-E203 PolarHBondContact O-N 2.94Å; F201-N236 WeakPolarHBondContact CD2-OD1 3.49Å; F201-K239 HydrophobicContact CD2-CD 3.7Å; F201-K239 HydrophobicContact CE2-CD 3.76Å; F201-K239 HydrophobicContact CG-CD 4.16Å; F201-K239 HydrophobicContact CZ-CD 4.27Å; F201-M257 HydrophobicContact CD2-SD 4.45Å; F201-M257 HydrophobicContact CE1-SD 4.27Å; F201-M257 HydrophobicContact CE2-CE 4.4Å; F201-M257 HydrophobicContact CE2-SD 3.48Å; F201-M257 WeakPolarHBondContact CE2-SD 3.36Å; F201-M257 HydrophobicContact CZ-CE 4.08Å; F201-M257 HydrophobicContact CZ-SD 3.38Å; F201-M257 WeakPolarHBondContact CZ-SD 3.39Å
202	P	44	Very low	45.1	Very low	108 Å²	108	125.9 Å²	125.9	70%	0.701	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-56.2	134.4	-179.6	20.7	-32.4	0	0	0	112.2	S204 G205	P202-S204 PolarHBondContact O-N 3.48Å; P202-G205 PolarHBondContact O-N 3.09Å
203	E	41.1	Very low	47.4	Very low	160 Å²	160	118.3 Å²	118.3	75%	0.748	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-62.3	-13.3	-168.7	-64.2	-174.5	137.7	0	0	114.7	F201 G205 A206	F201-E203 PolarHBondContact O-N 2.94Å; E203-G205 PolarHBondContact O-N 3.33Å; E203-A206 WeakPolarHBondContact O-CB 3.22Å; E203-A206 PolarHBondContact O-N 3.1Å
204	S	41.9	Very low	50.4	Low	119 Å²	119	115.4 Å²	115.4	83%	0.832	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-55.4	-20.6	175.5	-169.9	0	0	0	0	114.2	P202	P202-S204 PolarHBondContact O-N 3.48Å
205	G	41.6	Very low	53.2	Low	46 Å²	46	110.1 Å²	110.1	47%	0.474	56%	0.564	S	S	.	*	G	3₁₀ helix	trans	-90.9	-22.3	171.9	0	0	0	0	0	114.9	P202 E203 H207 S208	P202-G205 PolarHBondContact O-N 3.09Å; E203-G205 PolarHBondContact O-N 3.33Å; G205-H207 PolarHBondContact O-N 3.27Å; G205-S208 PolarHBondContact O-N 3.22Å
206	A	39.1	Very low	55.9	Low	58 Å²	58	105.6 Å²	105.6	48%	0.479	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-70.6	-35.9	-171.3	0	0	0	0	0	112.6	E203 S208 L209	E203-A206 WeakPolarHBondContact O-CB 3.22Å; E203-A206 PolarHBondContact O-N 3.1Å; A206-S208 PolarHBondContact O-N 3.24Å; A206-L209 PolarHBondContact O-N 3.44Å
207	H	39.8	Very low	58.3	Low	157 Å²	157	95 Å²	95	73%	0.727	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-66.4	-21.9	176.7	-81.2	-82.7	0	0	0	113.8	G205 L209	G205-H207 PolarHBondContact O-N 3.27Å; H207-L209 VanDerWaalsContact C-N 3.33Å; H207-L209 PolarHBondContact O-N 3.32Å
208	S	46.4	Very low	60.3	Low	95 Å²	95	87.2 Å²	87.2	66%	0.664	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-74.9	-20.4	177.8	-165.8	0	0	0	0	113.5	G205 A206 R210	G205-S208 PolarHBondContact O-N 3.22Å; A206-S208 PolarHBondContact O-N 3.24Å; S208-R210 VanDerWaalsContact C-N 3.29Å; S208-R210 PolarHBondContact O-N 3.35Å
209	L	48.9	Very low	61.7	Low	47 Å²	47	80.1 Å²	80.1	25%	0.246	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-72.4	-20.5	-177.4	-74.2	164.9	0	0	0	113.4	A206 H207 N211 I238 R242	A206-L209 PolarHBondContact O-N 3.44Å; H207-L209 VanDerWaalsContact C-N 3.33Å; H207-L209 PolarHBondContact O-N 3.32Å; L209-N211 VanDerWaalsContact C-N 3.3Å; L209-N211 PolarHBondContact O-N 3.4Å; L209-I238 HydrophobicContact CD2-CG2 4.35Å; L209-R242 VanDerWaalsContact CD2-CZ 3.46Å
210	R	49.1	Very low	63.2	Low	173 Å²	173	78.1 Å²	78.1	65%	0.653	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-70	-20.3	-166	-137.6	179.2	-165.3	-168	3.8	114.9	S208	S208-R210 VanDerWaalsContact C-N 3.29Å; S208-R210 PolarHBondContact O-N 3.35Å
211	N	57.2	Low	65.2	Low	137 Å²	137	78.6 Å²	78.6	73%	0.733	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-118.8	-6.6	-168.4	-73.9	-10.3	0	0	0	115.5	L209 L213 N214	L209-N211 VanDerWaalsContact C-N 3.3Å; L209-N211 PolarHBondContact O-N 3.4Å; N211-L213 PolarHBondContact O-N 3.16Å; N211-N214 PolarHBondContact O-N 3.49Å
212	E	68.9	Low	67.1	Low	119 Å²	119	76.5 Å²	76.5	56%	0.556	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-32.5	-165.1	-155.5	177.7	-154.8	0	0	114.1	R242	E212-R242 IonicContact OE1-NH1 3.17Å; E212-R242 IonicContact OE2-CZ 2.89Å; E212-R242 IonicContact OE2-NH1 3.7Å; E212-R242 PolarHBondContact OE2-NH1 3.3Å; E212-R242 IonicContact OE2-NH2 2.68Å; E212-R242 PolarHBondContact OE2-NH2 3.4Å
213	L	80.9	Confident	69.4	Low	33 Å²	33	71.3 Å²	71.3	17%	0.173	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-8.7	176.6	-66.6	-176.7	0	0	0	113.7	N211 M215 W217 L219 A280 Q284	N211-L213 PolarHBondContact O-N 3.16Å; L213-M215 VanDerWaalsContact C-N 3.26Å; L213-M215 HydrophobicContact CB-CG 4.18Å; L213-M215 PolarHBondContact O-N 3.09Å; L213-W217 HydrophobicContact CD1-CH2 4.16Å; L213-W217 HydrophobicContact CD1-CZ3 4.18Å; L213-L219 HydrophobicContact CD1-CB 4.4Å; L213-L219 HydrophobicContact CD1-CD1 3.99Å; L213-L219 HydrophobicContact CD1-CD2 3.78Å; L213-L219 HydrophobicContact CD1-CG 4.28Å; L213-A280 HydrophobicContact CB-CB 4.03Å; L213-A280 HydrophobicContact CD1-CB 4.14Å; L213-A280 HydrophobicContact CD2-CB 4.09Å; L213-A280 HydrophobicContact CG-CB 4.32Å; L213-Q284 PolarHBondContact O-NE2 2.84Å
214	N	86.6	Confident	72	Confident	75 Å²	75	64.9 Å²	64.9	40%	0.401	36%	0.358	S	S	.	.			trans	52.1	41	-177.4	-169.6	47	0	0	0	113.6	N211 R305	N211-N214 PolarHBondContact O-N 3.49Å; N214-R305 PolarHBondContact ND2-NH2 3.35Å; N214-R305 VanDerWaalsContact ND2-NH2 3.15Å; N214-R305 PolarHBondContact OD1-NH1 2.7Å; N214-R305 PolarHBondContact OD1-NH2 2.77Å
215	M	90.1	Very high	74.4	Confident	17 Å²	17	63.9 Å²	63.9	8%	0.084	35%	0.347	C	S	.	.			trans	-112.4	158.8	176.7	-62.7	-63.2	-73.7	0	0	110.2	L213 W217 A280 T283 R305	L213-M215 VanDerWaalsContact C-N 3.26Å; L213-M215 HydrophobicContact CB-CG 4.18Å; L213-M215 PolarHBondContact O-N 3.09Å; M215-W217 HydrophobicContact CB-CD2 3.98Å; M215-W217 HydrophobicContact CB-CE3 4.44Å; M215-W217 HydrophobicContact CB-CG 4.39Å; M215-W217 HydrophobicContact CB-CH2 4.41Å; M215-W217 HydrophobicContact CB-CZ2 3.98Å; M215-W217 HydrophobicContact CE-CZ2 3.73Å; M215-W217 HydrophobicContact CG-CH2 4.17Å; M215-W217 HydrophobicContact CG-CZ2 3.75Å; M215-W217 PolarHBondContact O-N 2.82Å; M215-A280 HydrophobicContact CG-CB 3.82Å; M215-A280 HydrophobicContact SD-CB 4.2Å; M215-T283 HydrophobicContact CE-CG2 4.02Å; M215-T283 HydrophobicContact SD-CG2 3.78Å; M215-R305 VanDerWaalsContact CE-O 3.32Å; M215-R305 WeakPolarHBondContact CE-O 3.32Å
216	N	89.3	Confident	76.7	Confident	84 Å²	84	66.6 Å²	66.6	45%	0.449	35%	0.35	S	S	.	.	S	Bend	trans	-85.1	19.4	-177.7	-67.9	10.1	0	0	0	113.2	E302 R305	N216-E302 WeakPolarHBondContact ND2-CG 3.44Å; N216-R305 HydrophobicContact CB-CB 4.37Å; N216-R305 PolarHBondContact N-O 3.42Å; N216-R305 VanDerWaalsContact OD1-CB 3.3Å; N216-R305 WeakPolarHBondContact OD1-CB 3.48Å
217	W	89.9	Confident	79.1	Confident	20 Å²	20	65.4 Å²	65.4	8%	0.076	34%	0.337	C	S	.	.	S	Bend	trans	-136.9	147.4	-178.9	45.6	-107.5	0	0	0	111.1	L213 M215 L219 V222 L276 L279 C307 R308	L213-W217 HydrophobicContact CD1-CH2 4.16Å; L213-W217 HydrophobicContact CD1-CZ3 4.18Å; M215-W217 HydrophobicContact CB-CD2 3.98Å; M215-W217 HydrophobicContact CB-CE3 4.44Å; M215-W217 HydrophobicContact CB-CG 4.39Å; M215-W217 HydrophobicContact CB-CH2 4.41Å; M215-W217 HydrophobicContact CB-CZ2 3.98Å; M215-W217 HydrophobicContact CE-CZ2 3.73Å; M215-W217 HydrophobicContact CG-CH2 4.17Å; M215-W217 HydrophobicContact CG-CZ2 3.75Å; M215-W217 PolarHBondContact O-N 2.82Å; W217-L219 HydrophobicContact CH2-CD1 4.4Å; W217-L219 HydrophobicContact CZ3-CB 4.06Å; W217-L219 HydrophobicContact CZ3-CD1 3.82Å; W217-L219 PolarHBondContact O-N 3.02Å; W217-V222 HydrophobicContact CB-CG2 3.84Å; W217-V222 HydrophobicContact CD2-CG2 4.17Å; W217-V222 HydrophobicContact CE3-CB 4.47Å; W217-V222 HydrophobicContact CE3-CG2 4.08Å; W217-V222 HydrophobicContact CG-CG2 4.11Å; W217-L276 HydrophobicContact CH2-CB 4.17Å; W217-L276 HydrophobicContact CH2-CD2 4.2Å; W217-L276 HydrophobicContact CZ2-CD2 4.45Å; W217-L279 HydrophobicContact CZ2-CD2 4.48Å; W217-C307 PolarHBondContact NE1-O 2.86Å; W217-R308 HydrophobicContact CG-CG 4.48Å
218	D	89.3	Confident	81.6	Confident	32 Å²	32	63.8 Å²	63.8	17%	0.171	34%	0.342	C	S	.	.			trans	-78.3	120	172.7	179.6	-7.5	0	0	0	109.8	T220 E221 V222 R231	D218-T220 VanDerWaalsContact C-N 3.26Å; D218-T220 PolarHBondContact O-N 3.45Å; D218-T220 PolarHBondContact OD1-N 3.03Å; D218-T220 PolarHBondContact OD1-OG1 3.38Å; D218-E221 HydrophobicContact CB-CB 3.93Å; D218-E221 PolarHBondContact O-N 3.19Å; D218-V222 WeakPolarHBondContact O-CG2 3.41Å; D218-V222 PolarHBondContact O-N 2.89Å; D218-R231 IonicContact OD2-CZ 3.59Å; D218-R231 IonicContact OD2-NH2 2.73Å; D218-R231 PolarHBondContact OD2-NH2 2.69Å
219	L	90.2	Very high	83.9	Confident	13 Å²	13	60.6 Å²	60.6	7%	0.068	32%	0.318	C	S	.	.	H	α-helix	trans	-53.6	-41	178	179.7	62.6	0	0	0	112.7	L213 W217 L223 I238 Y273 L276	L213-L219 HydrophobicContact CD1-CB 4.4Å; L213-L219 HydrophobicContact CD1-CD1 3.99Å; L213-L219 HydrophobicContact CD1-CD2 3.78Å; L213-L219 HydrophobicContact CD1-CG 4.28Å; W217-L219 HydrophobicContact CH2-CD1 4.4Å; W217-L219 HydrophobicContact CZ3-CB 4.06Å; W217-L219 HydrophobicContact CZ3-CD1 3.82Å; W217-L219 PolarHBondContact O-N 3.02Å; L219-L223 WeakPolarHBondContact O-CB 3.26Å; L219-L223 PolarHBondContact O-N 2.95Å; L219-I238 HydrophobicContact CD2-CD1 4.39Å; L219-I238 HydrophobicContact CG-CD1 4.23Å; L219-Y273 HydrophobicContact CD1-CD2 4.35Å; L219-Y273 HydrophobicContact CD2-CD2 4.06Å; L219-Y273 HydrophobicContact CD2-CE2 3.64Å; L219-Y273 HydrophobicContact CG-CD2 4.41Å; L219-Y273 HydrophobicContact CG-CE2 4.46Å; L219-L276 HydrophobicContact CD1-CB 3.78Å; L219-L276 HydrophobicContact CD1-CD1 3.89Å; L219-L276 HydrophobicContact CD1-CG 4.47Å
220	T	92.1	Very high	86	Confident	12 Å²	12	62.9 Å²	62.9	7%	0.074	33%	0.327	C	S	.	.	H	α-helix	trans	-71.8	-35.6	-177.3	-44.9	0	0	0	0	111.2	D218 S224 R231 C234 I238	D218-T220 VanDerWaalsContact C-N 3.26Å; D218-T220 PolarHBondContact O-N 3.45Å; D218-T220 PolarHBondContact OD1-N 3.03Å; D218-T220 PolarHBondContact OD1-OG1 3.38Å; T220-S224 WeakPolarHBondContact O-CB 3.49Å; T220-S224 PolarHBondContact O-N 3.44Å; T220-R231 HydrophobicContact CG2-CG 3.81Å; T220-R231 VanDerWaalsContact CG2-O 3.22Å; T220-R231 WeakPolarHBondContact CG2-O 3.47Å; T220-C234 HydrophobicContact CG2-CB 3.88Å; T220-I238 HydrophobicContact CG2-CD1 4.38Å
221	E	91.7	Very high	88.1	Confident	92 Å²	92	60 Å²	60	43%	0.43	32%	0.317	S	S	.	.	H	α-helix	trans	-73.4	-42.9	178.6	-165.2	173	125.7	0	0	112	D218 T225 R231	D218-E221 HydrophobicContact CB-CB 3.93Å; D218-E221 PolarHBondContact O-N 3.19Å; E221-T225 WeakPolarHBondContact O-CB 3.37Å; E221-T225 PolarHBondContact O-N 3.4Å; E221-T225 PolarHBondContact O-OG1 3.48Å; E221-R231 IonicContact OE2-CZ 2.82Å; E221-R231 IonicContact OE2-NH1 3.42Å; E221-R231 PolarHBondContact OE2-NH1 3.49Å; E221-R231 IonicContact OE2-NH2 3.27Å; E221-R231 PolarHBondContact OE2-NH2 2.84Å
222	V	91.4	Very high	89.9	Confident	9 Å²	9	55.5 Å²	55.5	6%	0.055	29%	0.289	C	S	.	.	H	α-helix	trans	-65.3	-45	174.9	175.4	0	0	0	0	110.5	W217 D218 S224 T225 L226 L276	W217-V222 HydrophobicContact CB-CG2 3.84Å; W217-V222 HydrophobicContact CD2-CG2 4.17Å; W217-V222 HydrophobicContact CE3-CB 4.47Å; W217-V222 HydrophobicContact CE3-CG2 4.08Å; W217-V222 HydrophobicContact CG-CG2 4.11Å; D218-V222 WeakPolarHBondContact O-CG2 3.41Å; D218-V222 PolarHBondContact O-N 2.89Å; V222-S224 PolarHBondContact O-N 3.33Å; V222-T225 PolarHBondContact O-N 2.74Å; V222-L226 HydrophobicContact CG1-CD1 3.76Å; V222-L226 HydrophobicContact CG1-CG 4.23Å; V222-L226 WeakPolarHBondContact O-CB 3.36Å; V222-L226 WeakPolarHBondContact O-CG 3.1Å; V222-L226 PolarHBondContact O-N 3.3Å; V222-L276 HydrophobicContact CB-CD1 4.45Å; V222-L276 HydrophobicContact CG1-CD1 3.9Å; V222-L276 HydrophobicContact CG1-CD2 3.83Å
223	L	92.9	Very high	91.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.8	-45.9	177.1	-174.7	61	0	0	0	111.7	L219 T225 L226 T227 C234 I238 I269 V272 Y273 L276	L219-L223 WeakPolarHBondContact O-CB 3.26Å; L219-L223 PolarHBondContact O-N 2.95Å; L223-T225 VanDerWaalsContact C-N 3.34Å; L223-T225 PolarHBondContact O-N 3.15Å; L223-L226 PolarHBondContact O-N 2.94Å; L223-T227 HydrophobicContact CD1-CG2 3.9Å; L223-T227 WeakPolarHBondContact O-CB 3.43Å; L223-T227 WeakPolarHBondContact O-CG2 3.45Å; L223-T227 PolarHBondContact O-N 2.95Å; L223-T227 PolarHBondContact O-OG1 2.96Å; L223-C234 HydrophobicContact CD2-CB 4.21Å; L223-C234 HydrophobicContact CG-CB 4.44Å; L223-I238 HydrophobicContact CD2-CD1 3.77Å; L223-I238 HydrophobicContact CD2-CG1 3.86Å; L223-I269 HydrophobicContact CD1-CG2 4.13Å; L223-I269 HydrophobicContact CD2-CG2 3.78Å; L223-I269 HydrophobicContact CG-CG2 4.13Å; L223-V272 HydrophobicContact CD1-CB 3.74Å; L223-V272 HydrophobicContact CD1-CG1 3.59Å; L223-Y273 HydrophobicContact CD2-CD2 4.45Å; L223-L276 HydrophobicContact CB-CD1 4.36Å; L223-L276 HydrophobicContact CD1-CD1 4.47Å
224	S	94.5	Very high	91.8	Very high	25 Å²	25	48.2 Å²	48.2	18%	0.175	26%	0.255	C	S	.	.	H	α-helix	trans	-58.3	-43.3	174.7	177.4	0	0	0	0	112.2	T220 V222 C228 V229 R231	T220-S224 WeakPolarHBondContact O-CB 3.49Å; T220-S224 PolarHBondContact O-N 3.44Å; V222-S224 PolarHBondContact O-N 3.33Å; S224-C228 WeakPolarHBondContact O-CA 3.28Å; S224-C228 PolarHBondContact O-N 3.25Å; S224-V229 WeakPolarHBondContact CA-O 3.43Å; S224-V229 VanDerWaalsContact CB-O 3.3Å; S224-V229 WeakPolarHBondContact CB-O 3.37Å; S224-V229 PolarHBondContact O-N 3.21Å; S224-V229 PolarHBondContact OG-O 3.5Å; S224-R231 PolarHBondContact OG-N 2.94Å
225	T	92.1	Very high	92.2	Very high	97 Å²	97	45.5 Å²	45.5	60%	0.595	24%	0.244	S	C	*	.	H	α-helix	trans	-67.7	-40.1	178.8	-55.7	0	0	0	0	112.6	E221 V222 L223	E221-T225 WeakPolarHBondContact O-CB 3.37Å; E221-T225 PolarHBondContact O-N 3.4Å; E221-T225 PolarHBondContact O-OG1 3.48Å; V222-T225 PolarHBondContact O-N 2.74Å; L223-T225 VanDerWaalsContact C-N 3.34Å; L223-T225 PolarHBondContact O-N 3.15Å
226	L	89.6	Confident	92.5	Very high	104 Å²	104	45.2 Å²	45.2	55%	0.545	24%	0.243	S	C	.	.	H	α-helix	trans	-77.3	-29.9	-178.1	-70.3	176.8	0	0	0	113.4	V222 L223 V272 L276	V222-L226 HydrophobicContact CG1-CD1 3.76Å; V222-L226 HydrophobicContact CG1-CG 4.23Å; V222-L226 WeakPolarHBondContact O-CB 3.36Å; V222-L226 WeakPolarHBondContact O-CG 3.1Å; V222-L226 PolarHBondContact O-N 3.3Å; L223-L226 PolarHBondContact O-N 2.94Å; L226-V272 HydrophobicContact CB-CG1 3.99Å; L226-V272 HydrophobicContact CD1-CG1 3.81Å; L226-L276 HydrophobicContact CD1-CD1 4.35Å; L226-L276 HydrophobicContact CD1-CD2 4.31Å
227	T	90.2	Very high	92.8	Very high	33 Å²	33	41.2 Å²	41.2	20%	0.202	22%	0.221	C	C	.	.	H	α-helix	trans	-97.8	-11.9	-178.4	59.8	0	0	0	0	113.5	L223 V229 I269 V272	L223-T227 HydrophobicContact CD1-CG2 3.9Å; L223-T227 WeakPolarHBondContact O-CB 3.43Å; L223-T227 WeakPolarHBondContact O-CG2 3.45Å; L223-T227 PolarHBondContact O-N 2.95Å; L223-T227 PolarHBondContact O-OG1 2.96Å; T227-V229 PolarHBondContact O-N 3.26Å; T227-V229 PolarHBondContact OG1-N 3.41Å; T227-I269 HydrophobicContact CG2-CG1 4.09Å; T227-V272 HydrophobicContact CG2-CB 4.19Å; T227-V272 HydrophobicContact CG2-CG1 4.39Å; T227-V272 HydrophobicContact CG2-CG2 4.17Å
228	C	93.1	Very high	93	Very high	123 Å²	123	40.3 Å²	40.3	83%	0.831	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	26.9	-170.2	-60.5	0	0	0	0	113.9	S224	S224-C228 WeakPolarHBondContact O-CA 3.28Å; S224-C228 PolarHBondContact O-N 3.25Å
229	V	93.3	Very high	93.3	Very high	27 Å²	27	42.2 Å²	42.2	16%	0.164	23%	0.225	C	C	.	.			trans	-103.4	146.7	179.7	174.7	0	0	0	0	110.2	S224 T227 V233 M261 I269	S224-V229 WeakPolarHBondContact CA-O 3.43Å; S224-V229 VanDerWaalsContact CB-O 3.3Å; S224-V229 WeakPolarHBondContact CB-O 3.37Å; S224-V229 PolarHBondContact O-N 3.21Å; S224-V229 PolarHBondContact OG-O 3.5Å; T227-V229 PolarHBondContact O-N 3.26Å; T227-V229 PolarHBondContact OG1-N 3.41Å; V229-V233 HydrophobicContact CG1-CB 3.85Å; V229-V233 HydrophobicContact CG1-CG1 3.91Å; V229-M261 HydrophobicContact CG1-SD 4.08Å; V229-M261 HydrophobicContact CG2-CE 4.06Å; V229-I269 HydrophobicContact CB-CD1 4.3Å; V229-I269 HydrophobicContact CG1-CD1 4.01Å; V229-I269 HydrophobicContact CG2-CD1 4.07Å; V229-I269 HydrophobicContact CG2-CG1 4.41Å
230	E	93.8	Very high	93.6	Very high	95 Å²	95	41.6 Å²	41.6	44%	0.444	22%	0.222	S	C	.	.			trans	-60.2	138.7	-176.7	-58.9	-172.8	131.7	0	0	112.5	W232 V233 C234	E230-W232 VanDerWaalsContact C-N 3.27Å; E230-W232 PolarHBondContact O-N 3.25Å; E230-W232 VanDerWaalsContact O-N 3.15Å; E230-W232 PolarHBondContact OE2-NE1 3.47Å; E230-V233 HydrophobicContact CB-CG2 4.1Å; E230-V233 WeakPolarHBondContact O-CB 3.38Å; E230-V233 PolarHBondContact O-N 3.15Å; E230-C234 PolarHBondContact O-N 3.08Å; E230-C234 VanDerWaalsContact O-N 3.1Å
231	R	93.8	Very high	93.7	Very high	113 Å²	113	42.5 Å²	42.5	43%	0.426	23%	0.226	S	C	.	.	H	α-helix	trans	-52.7	-39.6	-174.7	-167.7	-172.8	-168	129	2.3	113.6	D218 T220 E221 S224 C234 G235	D218-R231 IonicContact OD2-CZ 3.59Å; D218-R231 IonicContact OD2-NH2 2.73Å; D218-R231 PolarHBondContact OD2-NH2 2.69Å; T220-R231 HydrophobicContact CG2-CG 3.81Å; T220-R231 VanDerWaalsContact CG2-O 3.22Å; T220-R231 WeakPolarHBondContact CG2-O 3.47Å; E221-R231 IonicContact OE2-CZ 2.82Å; E221-R231 IonicContact OE2-NH1 3.42Å; E221-R231 PolarHBondContact OE2-NH1 3.49Å; E221-R231 IonicContact OE2-NH2 3.27Å; E221-R231 PolarHBondContact OE2-NH2 2.84Å; S224-R231 PolarHBondContact OG-N 2.94Å; R231-C234 PolarHBondContact O-N 3.23Å; R231-G235 PolarHBondContact O-N 3.27Å
232	W	93.9	Very high	93.7	Very high	42 Å²	42	42.6 Å²	42.6	16%	0.159	22%	0.222	C	C	.	.	H	α-helix	trans	-68.1	-37.3	-179.5	73.2	-89.6	0	0	0	112.4	P199 T200 E230 G235 N236 N259	P199-W232 HydrophobicContact CG-CH2 4.17Å; P199-W232 HydrophobicContact CG-CZ3 3.95Å; T200-W232 HydrophobicContact CG2-CB 4.26Å; E230-W232 VanDerWaalsContact C-N 3.27Å; E230-W232 PolarHBondContact O-N 3.25Å; E230-W232 VanDerWaalsContact O-N 3.15Å; E230-W232 PolarHBondContact OE2-NE1 3.47Å; W232-G235 PolarHBondContact O-N 3.37Å; W232-N236 PolarHBondContact O-N 2.9Å; W232-N259 HydrophobicContact CH2-CB 3.86Å; W232-N259 HydrophobicContact CZ2-CB 3.91Å
233	V	94.8	Very high	93.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-66.8	-43.7	175.7	-174.1	0	0	0	0	110.1	V229 E230 G235 N236 I237 N259 M261	V229-V233 HydrophobicContact CG1-CB 3.85Å; V229-V233 HydrophobicContact CG1-CG1 3.91Å; E230-V233 HydrophobicContact CB-CG2 4.1Å; E230-V233 WeakPolarHBondContact O-CB 3.38Å; E230-V233 PolarHBondContact O-N 3.15Å; V233-G235 VanDerWaalsContact C-N 3.32Å; V233-G235 PolarHBondContact O-N 2.81Å; V233-N236 PolarHBondContact O-N 3.37Å; V233-I237 HydrophobicContact CG1-CD1 3.86Å; V233-I237 HydrophobicContact CG1-CG1 4.49Å; V233-I237 WeakPolarHBondContact O-CG1 3.28Å; V233-I237 PolarHBondContact O-N 3.48Å; V233-N259 HydrophobicContact CG1-CB 4.18Å; V233-N259 HydrophobicContact CG2-CB 3.59Å; V233-M261 HydrophobicContact CG1-SD 3.95Å
234	C	95.6	Very high	93.9	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.2	-44.8	173.8	-64.7	0	0	0	0	111.3	T220 L223 E230 R231 I237 I238	T220-C234 HydrophobicContact CG2-CB 3.88Å; L223-C234 HydrophobicContact CD2-CB 4.21Å; L223-C234 HydrophobicContact CG-CB 4.44Å; E230-C234 PolarHBondContact O-N 3.08Å; E230-C234 VanDerWaalsContact O-N 3.1Å; R231-C234 PolarHBondContact O-N 3.23Å; C234-I237 PolarHBondContact O-N 2.91Å; C234-I238 WeakPolarHBondContact O-CB 3.48Å; C234-I238 WeakPolarHBondContact O-CD1 3.28Å; C234-I238 WeakPolarHBondContact O-CG1 3.34Å; C234-I238 PolarHBondContact O-N 2.95Å
235	G	94.4	Very high	94	Very high	17 Å²	17	52 Å²	52	18%	0.175	26%	0.263	C	S	.	.	H	α-helix	trans	-61.2	-44.9	176.4	0	0	0	0	0	113	R231 W232 V233 I238 K239	R231-G235 PolarHBondContact O-N 3.27Å; W232-G235 PolarHBondContact O-N 3.37Å; V233-G235 VanDerWaalsContact C-N 3.32Å; V233-G235 PolarHBondContact O-N 2.81Å; G235-I238 PolarHBondContact O-N 3.1Å; G235-K239 PolarHBondContact O-N 3.39Å
236	N	95.8	Very high	94.2	Very high	11 Å²	11	48.7 Å²	48.7	6%	0.059	24%	0.243	C	C	.	.	H	α-helix	trans	-62	-44.8	175.5	-77.3	-4.5	0	0	0	112.1	P199 F201 W232 V233 K239 L240 M257	P199-N236 PolarHBondContact O-ND2 3.24Å; F201-N236 WeakPolarHBondContact CD2-OD1 3.49Å; W232-N236 PolarHBondContact O-N 2.9Å; V233-N236 PolarHBondContact O-N 3.37Å; N236-K239 PolarHBondContact O-N 2.8Å; N236-L240 VanDerWaalsContact O-CG 3.31Å; N236-L240 WeakPolarHBondContact O-CG 3.44Å; N236-L240 PolarHBondContact O-N 2.72Å; N236-M257 HydrophobicContact CB-CB 4.48Å; N236-M257 VanDerWaalsContact CB-O 3.29Å; N236-M257 WeakPolarHBondContact CB-O 3.33Å; N236-M257 PolarHBondContact ND2-O 3.29Å
237	I	95.9	Very high	94.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-66.2	-42.7	178.6	-70.4	170.7	0	0	0	111.2	V233 C234 K239 L240 L241 I258 M261 I269	V233-I237 HydrophobicContact CG1-CD1 3.86Å; V233-I237 HydrophobicContact CG1-CG1 4.49Å; V233-I237 WeakPolarHBondContact O-CG1 3.28Å; V233-I237 PolarHBondContact O-N 3.48Å; C234-I237 PolarHBondContact O-N 2.91Å; I237-K239 VanDerWaalsContact C-N 3.29Å; I237-K239 PolarHBondContact O-N 2.97Å; I237-L240 PolarHBondContact O-N 2.89Å; I237-L241 HydrophobicContact CG2-CD1 3.8Å; I237-L241 HydrophobicContact CG2-CG 4.21Å; I237-L241 WeakPolarHBondContact O-CB 3.34Å; I237-L241 VanDerWaalsContact O-CG 3.31Å; I237-L241 WeakPolarHBondContact O-CG 3.42Å; I237-L241 PolarHBondContact O-N 3.21Å; I237-I258 HydrophobicContact CD1-CB 4.25Å; I237-I258 HydrophobicContact CD1-CG2 4.18Å; I237-I258 HydrophobicContact CG1-CB 4.26Å; I237-I258 HydrophobicContact CG1-CG2 3.67Å; I237-M261 HydrophobicContact CD1-SD 4.39Å; I237-I269 HydrophobicContact CD1-CD1 3.45Å; I237-I269 VanDerWaalsContact CD1-CD1 3.45Å; I237-I269 HydrophobicContact CG2-CG2 3.9Å
238	I	94.9	Very high	94.8	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-55.6	-46.5	173.5	-71.4	166	0	0	0	110.3	L209 L219 T220 L223 C234 G235 R242 Y273	L209-I238 HydrophobicContact CD2-CG2 4.35Å; L219-I238 HydrophobicContact CD2-CD1 4.39Å; L219-I238 HydrophobicContact CG-CD1 4.23Å; T220-I238 HydrophobicContact CG2-CD1 4.38Å; L223-I238 HydrophobicContact CD2-CD1 3.77Å; L223-I238 HydrophobicContact CD2-CG1 3.86Å; C234-I238 WeakPolarHBondContact O-CB 3.48Å; C234-I238 WeakPolarHBondContact O-CD1 3.28Å; C234-I238 WeakPolarHBondContact O-CG1 3.34Å; C234-I238 PolarHBondContact O-N 2.95Å; G235-I238 PolarHBondContact O-N 3.1Å; I238-R242 VanDerWaalsContact CG2-NE 3.31Å; I238-R242 VanDerWaalsContact O-CD 3.31Å; I238-R242 WeakPolarHBondContact O-CD 3.3Å; I238-R242 WeakPolarHBondContact O-CG 3.45Å; I238-R242 PolarHBondContact O-N 3.03Å; I238-R242 VanDerWaalsContact O-N 3.07Å; I238-Y273 HydrophobicContact CB-CE2 4.27Å; I238-Y273 HydrophobicContact CD1-CD2 4.34Å; I238-Y273 HydrophobicContact CD1-CE2 4.44Å; I238-Y273 HydrophobicContact CG1-CD2 3.73Å; I238-Y273 HydrophobicContact CG1-CE2 3.78Å; I238-Y273 HydrophobicContact CG2-CE2 3.8Å
239	K	94.8	Very high	95	Very high	72 Å²	72	36.7 Å²	36.7	31%	0.313	17%	0.17	S	C	.	.	H	α-helix	trans	-62.4	-49	177.3	180	177.1	167.2	-177	0	111.8	F201 G235 N236 I237 L241 R242 E243	F201-K239 HydrophobicContact CD2-CD 3.7Å; F201-K239 HydrophobicContact CE2-CD 3.76Å; F201-K239 HydrophobicContact CG-CD 4.16Å; F201-K239 HydrophobicContact CZ-CD 4.27Å; G235-K239 PolarHBondContact O-N 3.39Å; N236-K239 PolarHBondContact O-N 2.8Å; I237-K239 VanDerWaalsContact C-N 3.29Å; I237-K239 PolarHBondContact O-N 2.97Å; K239-L241 VanDerWaalsContact C-N 3.34Å; K239-L241 PolarHBondContact O-N 3.32Å; K239-R242 WeakPolarHBondContact O-CB 3.46Å; K239-R242 PolarHBondContact O-N 3.37Å; K239-E243 WeakPolarHBondContact CE-OE1 3.41Å; K239-E243 IonicContact NZ-OE1 2.72Å; K239-E243 WeakPolarHBondContact O-CG 3.44Å; K239-E243 PolarHBondContact O-N 2.68Å
240	L	96.1	Very high	95.2	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-61.2	-39.9	180	-71.8	167.8	0	0	0	112.4	N236 I237 E243 E244 N245 M250 R254 M257 I258	N236-L240 VanDerWaalsContact O-CG 3.31Å; N236-L240 WeakPolarHBondContact O-CG 3.44Å; N236-L240 PolarHBondContact O-N 2.72Å; I237-L240 PolarHBondContact O-N 2.89Å; L240-E243 CarbonylContact O-C 3.6Å; L240-E243 PolarHBondContact O-N 2.85Å; L240-E244 PolarHBondContact O-N 2.93Å; L240-N245 HydrophobicContact CB-CB 4.24Å; L240-N245 VanDerWaalsContact O-CB 3.26Å; L240-N245 WeakPolarHBondContact O-CB 3.38Å; L240-N245 PolarHBondContact O-N 3.35Å; L240-N245 PolarHBondContact O-ND2 3.16Å; L240-M250 HydrophobicContact CB-CG 4.2Å; L240-M250 HydrophobicContact CB-SD 3.48Å; L240-M250 WeakPolarHBondContact CB-SD 3.19Å; L240-M250 HydrophobicContact CD1-CG 4.17Å; L240-M250 HydrophobicContact CD1-SD 3.94Å; L240-M250 HydrophobicContact CG-SD 4.32Å; L240-R254 HydrophobicContact CD1-CB 4.25Å; L240-R254 HydrophobicContact CD2-CG 4.23Å; L240-M257 HydrophobicContact CD1-CE 4.43Å; L240-M257 HydrophobicContact CD2-CE 4.04Å; L240-I258 HydrophobicContact CD1-CG2 3.89Å
241	L	94.4	Very high	95.2	Very high	31 Å²	31	31.9 Å²	31.9	16%	0.162	15%	0.147	C	C	.	.	H	α-helix	trans	-66	-38.5	175.5	-71.9	171.6	0	0	0	112.3	I237 K239 E243 E244 M250 Q270 Y273	I237-L241 HydrophobicContact CG2-CD1 3.8Å; I237-L241 HydrophobicContact CG2-CG 4.21Å; I237-L241 WeakPolarHBondContact O-CB 3.34Å; I237-L241 VanDerWaalsContact O-CG 3.31Å; I237-L241 WeakPolarHBondContact O-CG 3.42Å; I237-L241 PolarHBondContact O-N 3.21Å; K239-L241 VanDerWaalsContact C-N 3.34Å; K239-L241 PolarHBondContact O-N 3.32Å; L241-E243 VanDerWaalsContact C-N 3.33Å; L241-E244 PolarHBondContact O-N 3.17Å; L241-E244 VanDerWaalsContact O-N 3.13Å; L241-M250 HydrophobicContact CD2-CE 3.77Å; L241-M250 HydrophobicContact CG-CE 4.34Å; L241-Q270 HydrophobicContact CD1-CB 4.14Å; L241-Q270 HydrophobicContact CD1-CG 4.08Å; L241-Q270 HydrophobicContact CD2-CG 4.08Å; L241-Y273 HydrophobicContact CD1-CD1 4.06Å; L241-Y273 HydrophobicContact CD1-CE1 4.45Å
242	R	92.2	Very high	95.3	Very high	93 Å²	93	28.9 Å²	28.9	35%	0.351	14%	0.136	S	C	.	.	H	α-helix	trans	-66.3	-34.7	174.5	-72	161.8	173	-121.4	-4.5	112.8	L209 E212 I238 K239 E244	L209-R242 VanDerWaalsContact CD2-CZ 3.46Å; E212-R242 IonicContact OE1-NH1 3.17Å; E212-R242 IonicContact OE2-CZ 2.89Å; E212-R242 IonicContact OE2-NH1 3.7Å; E212-R242 PolarHBondContact OE2-NH1 3.3Å; E212-R242 IonicContact OE2-NH2 2.68Å; E212-R242 PolarHBondContact OE2-NH2 3.4Å; I238-R242 VanDerWaalsContact CG2-NE 3.31Å; I238-R242 VanDerWaalsContact O-CD 3.31Å; I238-R242 WeakPolarHBondContact O-CD 3.3Å; I238-R242 WeakPolarHBondContact O-CG 3.45Å; I238-R242 PolarHBondContact O-N 3.03Å; I238-R242 VanDerWaalsContact O-N 3.07Å; K239-R242 WeakPolarHBondContact O-CB 3.46Å; K239-R242 PolarHBondContact O-N 3.37Å; R242-E244 PolarHBondContact O-N 3.2Å
243	E	93.6	Very high	95.4	Very high	83 Å²	83	27.5 Å²	27.5	39%	0.388	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	13.7	171.6	-70.8	173.3	-177.5	0	0	113.2	K239 L240 L241 N245 K779	K239-E243 WeakPolarHBondContact CE-OE1 3.41Å; K239-E243 IonicContact NZ-OE1 2.72Å; K239-E243 WeakPolarHBondContact O-CG 3.44Å; K239-E243 PolarHBondContact O-N 2.68Å; L240-E243 CarbonylContact O-C 3.6Å; L240-E243 PolarHBondContact O-N 2.85Å; L241-E243 VanDerWaalsContact C-N 3.33Å; E243-N245 VanDerWaalsContact C-N 3.25Å; E243-N245 VanDerWaalsContact CB-ND2 3.28Å; E243-N245 WeakPolarHBondContact CB-ND2 3.47Å; E243-N245 PolarHBondContact O-N 2.95Å; E243-N245 PolarHBondContact OE2-ND2 3.47Å; E243-K779 WeakPolarHBondContact O-CD 3.17Å; E243-K779 WeakPolarHBondContact O-CE 3.41Å; E243-K779 PolarHBondContact O-NZ 2.68Å
244	E	94.1	Very high	95.5	Very high	144 Å²	144	29.7 Å²	29.7	67%	0.673	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	33.9	-179.1	-54.5	-170.8	169.6	0	0	114.2	L240 L241 R242 K779	L240-E244 PolarHBondContact O-N 2.93Å; L241-E244 PolarHBondContact O-N 3.17Å; L241-E244 VanDerWaalsContact O-N 3.13Å; R242-E244 PolarHBondContact O-N 3.2Å; E244-K779 HydrophobicContact CB-CG 4.39Å; E244-K779 WeakPolarHBondContact O-CE 3.17Å
245	N	96.6	Very high	95.3	Very high	6 Å²	6	32.8 Å²	32.8	3%	0.032	15%	0.152	C	C	.	.			trans	-78	124.1	171	-62.8	-80.3	0	0	0	110.3	L240 E243 F249 M250 K779 Q783	L240-N245 HydrophobicContact CB-CB 4.24Å; L240-N245 VanDerWaalsContact O-CB 3.26Å; L240-N245 WeakPolarHBondContact O-CB 3.38Å; L240-N245 PolarHBondContact O-N 3.35Å; L240-N245 PolarHBondContact O-ND2 3.16Å; E243-N245 VanDerWaalsContact C-N 3.25Å; E243-N245 VanDerWaalsContact CB-ND2 3.28Å; E243-N245 WeakPolarHBondContact CB-ND2 3.47Å; E243-N245 PolarHBondContact O-N 2.95Å; E243-N245 PolarHBondContact OE2-ND2 3.47Å; N245-F249 HydrophobicContact CB-CD1 4.25Å; N245-F249 WeakPolarHBondContact OD1-CD1 3.38Å; N245-F249 WeakPolarHBondContact OD1-CE1 3.47Å; N245-M250 HydrophobicContact CB-CG 3.74Å; N245-M250 HydrophobicContact CB-SD 4.3Å; N245-K779 VanDerWaalsContact CG-NZ 3.31Å; N245-K779 PolarHBondContact ND2-NZ 2.81Å; N245-K779 PolarHBondContact OD1-NZ 2.78Å; N245-Q783 PolarHBondContact OD1-NE2 2.88Å; N245-Q783 VanDerWaalsContact OD1-NE2 3.11Å
246	T	96.6	Very high	95.2	Very high	26 Å²	26	33.9 Å²	33.9	16%	0.16	15%	0.153	C	C	.	.			trans	-70.8	153.9	175.6	62.1	0	0	0	0	111.4	F249 M250 A744 Q783	T246-F249 PolarHBondContact O-N 2.87Å; T246-F249 WeakPolarHBondContact OG1-CB 3.38Å; T246-F249 PolarHBondContact OG1-N 2.8Å; T246-M250 WeakPolarHBondContact O-CG 3.31Å; T246-M250 PolarHBondContact O-N 3.22Å; T246-A744 HydrophobicContact CG2-CB 4.27Å; T246-A744 WeakPolarHBondContact OG1-CB 3.2Å; T246-Q783 HydrophobicContact CG2-CB 4.47Å; T246-Q783 HydrophobicContact CG2-CG 4.39Å; T246-Q783 PolarHBondContact OG1-OE1 3.06Å
247	V	96	Very high	95.1	Very high	8 Å²	8	35.1 Å²	35.1	5%	0.048	16%	0.159	C	C	.	.	H	α-helix	trans	-58.3	-45.8	179	179.5	0	0	0	0	112.6	F249 M250 V251 A263 V266 R267 Q270	V247-F249 VanDerWaalsContact C-N 3.3Å; V247-F249 PolarHBondContact O-N 3.45Å; V247-M250 HydrophobicContact CG2-CE 4.08Å; V247-M250 PolarHBondContact O-N 2.77Å; V247-V251 HydrophobicContact CG1-CG2 4.14Å; V247-V251 VanDerWaalsContact O-CG2 3.3Å; V247-V251 WeakPolarHBondContact O-CG2 3.14Å; V247-V251 PolarHBondContact O-N 2.93Å; V247-A263 HydrophobicContact CG1-CB 3.9Å; V247-V266 HydrophobicContact CG1-CB 4.18Å; V247-V266 HydrophobicContact CG1-CG1 4.03Å; V247-V266 HydrophobicContact CG2-CG1 4.15Å; V247-R267 HydrophobicContact CG1-CG 4.39Å; V247-R267 HydrophobicContact CG2-CG 4.26Å; V247-Q270 VanDerWaalsContact CG2-OE1 3.28Å
248	P	96.8	Very high	95	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.9	-39	177.3	-23.6	35.9	0	0	0	112.4	R252 E722 E723 F727 A744 F787	P248-R252 WeakPolarHBondContact O-CB 3.47Å; P248-R252 PolarHBondContact O-N 2.89Å; P248-R252 VanDerWaalsContact O-N 3.08Å; P248-E722 HydrophobicContact CG-CG 4.25Å; P248-E723 HydrophobicContact CG-CB 4.37Å; P248-F727 HydrophobicContact CB-CD1 4.36Å; P248-F727 HydrophobicContact CB-CE1 3.9Å; P248-A744 HydrophobicContact CB-CB 4.04Å; P248-A744 HydrophobicContact CG-CB 4.05Å; P248-F787 HydrophobicContact CB-CE1 4.44Å; P248-F787 HydrophobicContact CB-CE2 4.3Å; P248-F787 HydrophobicContact CB-CZ 3.85Å
249	F	97.4	Very high	95	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.8	-45.4	177.3	-176.4	-90.8	0	0	0	111.9	N245 T246 V247 V251 R252 Y253 R254 Q782 Q783 F787 H835	N245-F249 HydrophobicContact CB-CD1 4.25Å; N245-F249 WeakPolarHBondContact OD1-CD1 3.38Å; N245-F249 WeakPolarHBondContact OD1-CE1 3.47Å; T246-F249 PolarHBondContact O-N 2.87Å; T246-F249 WeakPolarHBondContact OG1-CB 3.38Å; T246-F249 PolarHBondContact OG1-N 2.8Å; V247-F249 VanDerWaalsContact C-N 3.3Å; V247-F249 PolarHBondContact O-N 3.45Å; F249-V251 PolarHBondContact O-N 2.72Å; F249-R252 PolarHBondContact O-N 3.2Å; F249-Y253 AromaticContact CD2-CD2 3.47Å; F249-Y253 HydrophobicContact CD2-CD2 3.47Å; F249-Y253 VanDerWaalsContact CD2-CD2 3.47Å; F249-Y253 HydrophobicContact CD2-CE2 4.09Å; F249-Y253 HydrophobicContact CD2-CG 4.4Å; F249-Y253 AromaticContact CE2-CD2 3.68Å; F249-Y253 HydrophobicContact CE2-CD2 3.68Å; F249-Y253 HydrophobicContact CE2-CE2 4.42Å; F249-Y253 HydrophobicContact CE2-CG 4.23Å; F249-Y253 HydrophobicContact CG-CD2 4.07Å; F249-Y253 HydrophobicContact CZ-CD2 4.45Å; F249-Y253 PolarHBondContact O-N 2.96Å; F249-R254 HydrophobicContact CD1-CG 4.24Å; F249-R254 HydrophobicContact CE1-CG 3.93Å; F249-Q782 WeakPolarHBondContact CD2-O 3.33Å; F249-Q782 HydrophobicContact CE2-CG 3.94Å; F249-Q782 WeakPolarHBondContact CE2-O 3.34Å; F249-Q782 HydrophobicContact CZ-CG 3.67Å; F249-Q783 VanDerWaalsContact CD1-NE2 3.28Å; F249-Q783 VanDerWaalsContact CG-OE1 3.31Å; F249-F787 HydrophobicContact CB-CE2 4.26Å; F249-H835 AromaticContact CE2-NE2 3.99Å
250	M	96.7	Very high	94.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.9	-47.3	177.2	-70.9	-170.9	-75.3	0	0	112	L240 L241 N245 T246 V247 R252 R254 K255 V266	L240-M250 HydrophobicContact CB-CG 4.2Å; L240-M250 HydrophobicContact CB-SD 3.48Å; L240-M250 WeakPolarHBondContact CB-SD 3.19Å; L240-M250 HydrophobicContact CD1-CG 4.17Å; L240-M250 HydrophobicContact CD1-SD 3.94Å; L240-M250 HydrophobicContact CG-SD 4.32Å; L241-M250 HydrophobicContact CD2-CE 3.77Å; L241-M250 HydrophobicContact CG-CE 4.34Å; N245-M250 HydrophobicContact CB-CG 3.74Å; N245-M250 HydrophobicContact CB-SD 4.3Å; T246-M250 WeakPolarHBondContact O-CG 3.31Å; T246-M250 PolarHBondContact O-N 3.22Å; V247-M250 HydrophobicContact CG2-CE 4.08Å; V247-M250 PolarHBondContact O-N 2.77Å; M250-R252 PolarHBondContact O-N 3.38Å; M250-R254 CarbonylContact O-C 3.55Å; M250-R254 VanDerWaalsContact O-CA 3.31Å; M250-R254 WeakPolarHBondContact O-CA 3.49Å; M250-R254 WeakPolarHBondContact O-CB 3.49Å; M250-R254 PolarHBondContact O-N 3.26Å; M250-K255 PolarHBondContact O-N 2.59Å; M250-V266 HydrophobicContact CE-CG1 3.72Å
251	V	95.6	Very high	94.6	Very high	21 Å²	21	41 Å²	41	13%	0.127	19%	0.189	C	C	.	.	H	α-helix	trans	-67.6	-33.9	-177	174.2	0	0	0	0	112.4	V247 F249 I258 A263 V266 F727	V247-V251 HydrophobicContact CG1-CG2 4.14Å; V247-V251 VanDerWaalsContact O-CG2 3.3Å; V247-V251 WeakPolarHBondContact O-CG2 3.14Å; V247-V251 PolarHBondContact O-N 2.93Å; F249-V251 PolarHBondContact O-N 2.72Å; V251-I258 HydrophobicContact CG2-CD1 4.08Å; V251-A263 HydrophobicContact CG2-CB 4.08Å; V251-V266 HydrophobicContact CG2-CG2 4.27Å; V251-F727 HydrophobicContact CB-CZ 4.14Å; V251-F727 HydrophobicContact CG1-CZ 3.86Å
252	R	95.1	Very high	94.5	Very high	50 Å²	50	44 Å²	44	19%	0.189	21%	0.206	C	C	.	.	H	α-helix	trans	-86.1	-46.2	179.3	-174	172.2	-77.6	-174.8	-7.7	113.5	P248 F249 M250 F727 F787 L890	P248-R252 WeakPolarHBondContact O-CB 3.47Å; P248-R252 PolarHBondContact O-N 2.89Å; P248-R252 VanDerWaalsContact O-N 3.08Å; F249-R252 PolarHBondContact O-N 3.2Å; M250-R252 PolarHBondContact O-N 3.38Å; R252-F727 HydrophobicContact CB-CE1 4.37Å; R252-F727 VanDerWaalsContact NH2-CA 3.33Å; R252-F727 PolarHBondContact NH2-O 3.02Å; R252-F787 HydrophobicContact CB-CE1 4.41Å; R252-L890 HydrophobicContact CG-CD1 4.12Å; R252-L890 HydrophobicContact CG-CD2 3.92Å
253	Y	96.5	Very high	94.4	Very high	14 Å²	14	39.8 Å²	39.8	6%	0.055	19%	0.191	C	C	.	.	H	α-helix	trans	-112.8	-7.1	-167.5	-52.8	-70.4	0	0	0	114.4	F249 G786 F787 C833 H835 L890	F249-Y253 AromaticContact CD2-CD2 3.47Å; F249-Y253 HydrophobicContact CD2-CD2 3.47Å; F249-Y253 VanDerWaalsContact CD2-CD2 3.47Å; F249-Y253 HydrophobicContact CD2-CE2 4.09Å; F249-Y253 HydrophobicContact CD2-CG 4.4Å; F249-Y253 AromaticContact CE2-CD2 3.68Å; F249-Y253 HydrophobicContact CE2-CD2 3.68Å; F249-Y253 HydrophobicContact CE2-CE2 4.42Å; F249-Y253 HydrophobicContact CE2-CG 4.23Å; F249-Y253 HydrophobicContact CG-CD2 4.07Å; F249-Y253 HydrophobicContact CZ-CD2 4.45Å; F249-Y253 PolarHBondContact O-N 2.96Å; Y253-G786 VanDerWaalsContact OH-CA 3.25Å; Y253-G786 WeakPolarHBondContact OH-CA 3.23Å; Y253-G786 PolarHBondContact OH-O 3.11Å; Y253-F787 HydrophobicContact CD2-CZ 4.31Å; Y253-F787 AromaticContact CE2-CE1 3.9Å; Y253-F787 HydrophobicContact CE2-CE1 3.9Å; Y253-F787 HydrophobicContact CE2-CE2 4.08Å; Y253-F787 AromaticContact CE2-CZ 3.62Å; Y253-F787 HydrophobicContact CE2-CZ 3.62Å; Y253-C833 WeakPolarHBondContact CE1-O 3.47Å; Y253-C833 PolarHBondContact OH-O 2.83Å; Y253-H835 HydrophobicContact CD1-CB 3.8Å; Y253-H835 HydrophobicContact CE1-CB 3.64Å; Y253-H835 HydrophobicContact CG-CB 4.48Å; Y253-L890 HydrophobicContact CD1-CD2 3.57Å; Y253-L890 HydrophobicContact CE1-CD2 3.55Å
254	R	95.7	Very high	94.1	Very high	45 Å²	45	38.6 Å²	38.6	17%	0.17	19%	0.187	C	C	.	.	S	Bend	trans	-127.1	22.2	179.6	-53	-68.1	177.4	-99.7	7.2	112.3	L240 F249 M250 E256 M257 I258 E837	L240-R254 HydrophobicContact CD1-CB 4.25Å; L240-R254 HydrophobicContact CD2-CG 4.23Å; F249-R254 HydrophobicContact CD1-CG 4.24Å; F249-R254 HydrophobicContact CE1-CG 3.93Å; M250-R254 CarbonylContact O-C 3.55Å; M250-R254 VanDerWaalsContact O-CA 3.31Å; M250-R254 WeakPolarHBondContact O-CA 3.49Å; M250-R254 WeakPolarHBondContact O-CB 3.49Å; M250-R254 PolarHBondContact O-N 3.26Å; R254-E256 VanDerWaalsContact C-N 3.31Å; R254-E256 PolarHBondContact O-N 3.24Å; R254-E256 VanDerWaalsContact O-N 3.16Å; R254-M257 HydrophobicContact CB-CE 3.92Å; R254-M257 VanDerWaalsContact CD-CE 3.47Å; R254-M257 HydrophobicContact CG-CE 4.14Å; R254-M257 PolarHBondContact O-N 3.37Å; R254-I258 PolarHBondContact O-N 3.48Å; R254-E837 IonicContact CZ-OE1 3.41Å; R254-E837 IonicContact CZ-OE2 3.6Å; R254-E837 IonicContact NH1-OE1 3.52Å; R254-E837 PolarHBondContact NH1-OE1 2.86Å; R254-E837 IonicContact NH1-OE2 2.67Å; R254-E837 VanDerWaalsContact NH2-CD 3.33Å; R254-E837 IonicContact NH2-OE1 3.67Å; R254-E837 PolarHBondContact NH2-OE1 2.86Å; R254-E837 IonicContact NH2-OE2 3.63Å; R254-E837 PolarHBondContact NH2-OE2 3.29Å
255	K	92.6	Very high	93.9	Very high	65 Å²	65	33.1 Å²	33.1	28%	0.283	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-37.9	-168.2	-170.7	174.8	172.1	-158.2	0	114.8	M250 I258 N259 H260 E886	M250-K255 PolarHBondContact O-N 2.59Å; K255-I258 WeakPolarHBondContact O-CG1 3.4Å; K255-I258 PolarHBondContact O-N 3.45Å; K255-N259 PolarHBondContact O-N 2.97Å; K255-H260 HydrophobicContact CG-CB 4.36Å; K255-H260 WeakPolarHBondContact O-CA 3.43Å; K255-H260 PolarHBondContact O-N 3.2Å; K255-E886 HydrophobicContact CD-CB 4.49Å; K255-E886 HydrophobicContact CD-CG 4.29Å; K255-E886 WeakPolarHBondContact CE-OE2 3.39Å; K255-E886 IonicContact NZ-OE1 3.39Å; K255-E886 PolarHBondContact NZ-OE1 2.57Å; K255-E886 IonicContact NZ-OE2 3.83Å; K255-E886 PolarHBondContact NZ-OE2 2.89Å
256	E	92	Very high	93.8	Very high	41 Å²	41	32.9 Å²	32.9	19%	0.192	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-35.9	-179.7	-64.6	-179	-155.1	0	0	112.7	R254 I258 N259 T884 P885 E886	R254-E256 VanDerWaalsContact C-N 3.31Å; R254-E256 PolarHBondContact O-N 3.24Å; R254-E256 VanDerWaalsContact O-N 3.16Å; E256-I258 PolarHBondContact O-N 3.27Å; E256-N259 PolarHBondContact O-N 2.83Å; E256-N259 VanDerWaalsContact O-N 3.08Å; E256-T884 VanDerWaalsContact CD-CB 3.44Å; E256-T884 VanDerWaalsContact CD-OG1 3.23Å; E256-T884 WeakPolarHBondContact OE1-CB 3.27Å; E256-T884 PolarHBondContact OE1-OG1 3.06Å; E256-T884 VanDerWaalsContact OE2-CB 3.3Å; E256-T884 WeakPolarHBondContact OE2-CB 3.43Å; E256-P885 WeakPolarHBondContact OE1-CD 3.49Å; E256-E886 HydrophobicContact CG-CB 3.91Å; E256-E886 HydrophobicContact CG-CG 3.61Å; E256-E886 VanDerWaalsContact OE1-CB 3.28Å; E256-E886 WeakPolarHBondContact OE1-CB 3.43Å; E256-E886 WeakPolarHBondContact OE1-CG 3.41Å; E256-E886 PolarHBondContact OE1-N 2.99Å
257	M	93.6	Very high	93.5	Very high	36 Å²	36	33 Å²	33	18%	0.177	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-22.6	178	-66.3	-165.5	-66	0	0	112.8	P199 F201 N236 L240 R254	P199-M257 HydrophobicContact CB-CG 4.43Å; F201-M257 HydrophobicContact CD2-SD 4.45Å; F201-M257 HydrophobicContact CE1-SD 4.27Å; F201-M257 HydrophobicContact CE2-CE 4.4Å; F201-M257 HydrophobicContact CE2-SD 3.48Å; F201-M257 WeakPolarHBondContact CE2-SD 3.36Å; F201-M257 HydrophobicContact CZ-CE 4.08Å; F201-M257 HydrophobicContact CZ-SD 3.38Å; F201-M257 WeakPolarHBondContact CZ-SD 3.39Å; N236-M257 HydrophobicContact CB-CB 4.48Å; N236-M257 VanDerWaalsContact CB-O 3.29Å; N236-M257 WeakPolarHBondContact CB-O 3.33Å; N236-M257 PolarHBondContact ND2-O 3.29Å; L240-M257 HydrophobicContact CD1-CE 4.43Å; L240-M257 HydrophobicContact CD2-CE 4.04Å; R254-M257 HydrophobicContact CB-CE 3.92Å; R254-M257 VanDerWaalsContact CD-CE 3.47Å; R254-M257 HydrophobicContact CG-CE 4.14Å; R254-M257 PolarHBondContact O-N 3.37Å
258	I	94.6	Very high	93.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	17.1	172.8	67.9	166.2	0	0	0	112.7	I237 L240 V251 R254 K255 E256 H260 M261 V266	I237-I258 HydrophobicContact CD1-CB 4.25Å; I237-I258 HydrophobicContact CD1-CG2 4.18Å; I237-I258 HydrophobicContact CG1-CB 4.26Å; I237-I258 HydrophobicContact CG1-CG2 3.67Å; L240-I258 HydrophobicContact CD1-CG2 3.89Å; V251-I258 HydrophobicContact CG2-CD1 4.08Å; R254-I258 PolarHBondContact O-N 3.48Å; K255-I258 WeakPolarHBondContact O-CG1 3.4Å; K255-I258 PolarHBondContact O-N 3.45Å; E256-I258 PolarHBondContact O-N 3.27Å; I258-H260 VanDerWaalsContact C-N 3.29Å; I258-H260 PolarHBondContact O-N 3.27Å; I258-M261 HydrophobicContact CD1-CB 4.41Å; I258-M261 WeakPolarHBondContact CD1-O 3.25Å; I258-M261 WeakPolarHBondContact O-CB 3.47Å; I258-M261 WeakPolarHBondContact O-CG 3.28Å; I258-M261 PolarHBondContact O-N 3.43Å; I258-V266 HydrophobicContact CD1-CG2 3.79Å
259	N	94.3	Very high	93	Very high	71 Å²	71	35.8 Å²	35.8	38%	0.38	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	42.8	-179.8	-163.7	19	0	0	0	114.1	W232 V233 K255 E256 M261	W232-N259 HydrophobicContact CH2-CB 3.86Å; W232-N259 HydrophobicContact CZ2-CB 3.91Å; V233-N259 HydrophobicContact CG1-CB 4.18Å; V233-N259 HydrophobicContact CG2-CB 3.59Å; K255-N259 PolarHBondContact O-N 2.97Å; E256-N259 PolarHBondContact O-N 2.83Å; E256-N259 VanDerWaalsContact O-N 3.08Å; N259-M261 PolarHBondContact O-N 3.48Å; N259-M261 VanDerWaalsContact O-N 3.12Å
260	H	91.6	Very high	92.8	Very high	92 Å²	92	38.2 Å²	38.2	43%	0.426	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	59	21.8	177.3	-41.9	-102.7	0	0	0	114.8	K255 I258 E886	K255-H260 HydrophobicContact CG-CB 4.36Å; K255-H260 WeakPolarHBondContact O-CA 3.43Å; K255-H260 PolarHBondContact O-N 3.2Å; I258-H260 VanDerWaalsContact C-N 3.29Å; I258-H260 PolarHBondContact O-N 3.27Å; H260-E886 IonicContact CE1-OE1 3.79Å; H260-E886 PolarHBondContact CE1-OE1 3.22Å; H260-E886 IonicContact ND1-OE1 2.75Å; H260-E886 PolarHBondContact ND1-OE1 2.85Å
261	M	91.8	Very high	92.5	Very high	34 Å²	34	41.8 Å²	41.8	17%	0.167	21%	0.207	C	C	.	.			trans	-63	149.9	175.7	-68.9	179.8	73.1	0	0	112.3	V229 V233 I237 I258 N259 A265 V266 I269	V229-M261 HydrophobicContact CG1-SD 4.08Å; V229-M261 HydrophobicContact CG2-CE 4.06Å; V233-M261 HydrophobicContact CG1-SD 3.95Å; I237-M261 HydrophobicContact CD1-SD 4.39Å; I258-M261 HydrophobicContact CD1-CB 4.41Å; I258-M261 WeakPolarHBondContact CD1-O 3.25Å; I258-M261 WeakPolarHBondContact O-CB 3.47Å; I258-M261 WeakPolarHBondContact O-CG 3.28Å; I258-M261 PolarHBondContact O-N 3.43Å; N259-M261 PolarHBondContact O-N 3.48Å; N259-M261 VanDerWaalsContact O-N 3.12Å; M261-A265 HydrophobicContact CB-CB 4.45Å; M261-A265 HydrophobicContact CE-CB 3.36Å; M261-V266 HydrophobicContact CB-CG2 4.02Å; M261-I269 HydrophobicContact CE-CD1 3.56Å; M261-I269 HydrophobicContact CE-CG1 4.39Å; M261-I269 HydrophobicContact SD-CD1 3.88Å
262	D	90.6	Very high	92.3	Very high	96 Å²	96	41.9 Å²	41.9	51%	0.513	21%	0.207	S	C	.	.			trans	-84.8	172.8	173.6	66.7	34.5	0	0	0	112.4	D264 A265 V266	D262-D264 VanDerWaalsContact C-N 3.29Å; D262-D264 PolarHBondContact O-N 3.04Å; D262-D264 PolarHBondContact OD1-N 3.08Å; D262-D264 VanDerWaalsContact OD1-N 3.14Å; D262-A265 PolarHBondContact O-N 2.66Å; D262-A265 WeakPolarHBondContact OD1-CB 3.36Å; D262-A265 PolarHBondContact OD1-N 2.67Å; D262-V266 WeakPolarHBondContact O-CG2 3.38Å; D262-V266 PolarHBondContact O-N 3.05Å
263	A	90.4	Very high	92.2	Very high	4 Å²	4	41 Å²	41	3%	0.033	20%	0.204	C	C	.	.	H	α-helix	trans	-64.2	-30.9	-176.5	0	0	0	0	0	113.5	V247 V251 R267 E723	V247-A263 HydrophobicContact CG1-CB 3.9Å; V251-A263 HydrophobicContact CG2-CB 4.08Å; A263-R267 VanDerWaalsContact O-CG 3.29Å; A263-R267 WeakPolarHBondContact O-CG 3.43Å; A263-R267 PolarHBondContact O-N 3.15Å; A263-R267 PolarHBondContact O-NH1 2.93Å; A263-E723 HydrophobicContact CB-CG 4.38Å; A263-E723 WeakPolarHBondContact CB-OE2 3.17Å
264	D	88	Confident	92	Very high	57 Å²	57	45.2 Å²	45.2	31%	0.305	22%	0.224	S	C	.	.	H	α-helix	trans	-74.6	-41.8	179.9	-71.2	-21.2	0	0	0	110.6	D262 V266 R267 D268 R548	D262-D264 VanDerWaalsContact C-N 3.29Å; D262-D264 PolarHBondContact O-N 3.04Å; D262-D264 PolarHBondContact OD1-N 3.08Å; D262-D264 VanDerWaalsContact OD1-N 3.14Å; D264-V266 PolarHBondContact O-N 3.01Å; D264-R267 PolarHBondContact O-N 3.45Å; D264-R267 IonicContact OD1-NH1 2.98Å; D264-R267 PolarHBondContact OD1-NH1 3.42Å; D264-D268 PolarHBondContact O-N 3.17Å; D264-R548 VanDerWaalsContact CG-NH2 3.34Å; D264-R548 IonicContact OD1-CZ 3.38Å; D264-R548 IonicContact OD1-NH1 3.97Å; D264-R548 IonicContact OD1-NH2 3.23Å; D264-R548 PolarHBondContact OD1-NH2 3.38Å; D264-R548 IonicContact OD2-CZ 2.74Å; D264-R548 IonicContact OD2-NH1 2.86Å; D264-R548 PolarHBondContact OD2-NH1 2.73Å; D264-R548 IonicContact OD2-NH2 3.94Å; D264-R548 PolarHBondContact OD2-NH2 2.67Å
265	A	90.2	Very high	91.7	Very high	30 Å²	30	49 Å²	49	25%	0.248	24%	0.244	C	C	.	.	H	α-helix	trans	-68	-33.9	176.3	0	0	0	0	0	112.8	M261 D262 D268 I269	M261-A265 HydrophobicContact CB-CB 4.45Å; M261-A265 HydrophobicContact CE-CB 3.36Å; D262-A265 PolarHBondContact O-N 2.66Å; D262-A265 WeakPolarHBondContact OD1-CB 3.36Å; D262-A265 PolarHBondContact OD1-N 2.67Å; A265-D268 PolarHBondContact O-N 3.39Å; A265-I269 PolarHBondContact O-N 2.93Å
266	V	93.6	Very high	91.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-68.2	-40.5	172.4	174	0	0	0	0	111.6	V247 M250 V251 I258 M261 D262 D264 D268 I269 Q270	V247-V266 HydrophobicContact CG1-CB 4.18Å; V247-V266 HydrophobicContact CG1-CG1 4.03Å; V247-V266 HydrophobicContact CG2-CG1 4.15Å; M250-V266 HydrophobicContact CE-CG1 3.72Å; V251-V266 HydrophobicContact CG2-CG2 4.27Å; I258-V266 HydrophobicContact CD1-CG2 3.79Å; M261-V266 HydrophobicContact CB-CG2 4.02Å; D262-V266 WeakPolarHBondContact O-CG2 3.38Å; D262-V266 PolarHBondContact O-N 3.05Å; D264-V266 PolarHBondContact O-N 3.01Å; V266-D268 VanDerWaalsContact C-N 3.33Å; V266-D268 PolarHBondContact O-N 3.36Å; V266-I269 PolarHBondContact O-N 3.08Å; V266-Q270 PolarHBondContact O-N 3.36Å
267	R	91.1	Very high	91.7	Very high	29 Å²	29	45 Å²	45	11%	0.109	23%	0.228	C	C	.	.	H	α-helix	trans	-61.9	-40.4	173.3	-77.3	178.3	-165.5	103.5	4.8	112.4	V247 A263 D264 I269 Q270 M271 G719 E723	V247-R267 HydrophobicContact CG1-CG 4.39Å; V247-R267 HydrophobicContact CG2-CG 4.26Å; A263-R267 VanDerWaalsContact O-CG 3.29Å; A263-R267 WeakPolarHBondContact O-CG 3.43Å; A263-R267 PolarHBondContact O-N 3.15Å; A263-R267 PolarHBondContact O-NH1 2.93Å; D264-R267 PolarHBondContact O-N 3.45Å; D264-R267 IonicContact OD1-NH1 2.98Å; D264-R267 PolarHBondContact OD1-NH1 3.42Å; R267-I269 VanDerWaalsContact C-N 3.29Å; R267-I269 PolarHBondContact O-N 3.1Å; R267-Q270 WeakPolarHBondContact O-CB 3.29Å; R267-Q270 PolarHBondContact O-N 2.89Å; R267-Q270 VanDerWaalsContact O-N 3.13Å; R267-M271 WeakPolarHBondContact O-CG 3.36Å; R267-M271 PolarHBondContact O-N 3.02Å; R267-G719 PolarHBondContact NH2-O 3.49Å; R267-E723 IonicContact CZ-OE2 2.81Å; R267-E723 IonicContact NH1-OE2 3.82Å; R267-E723 PolarHBondContact NH1-OE2 3.3Å; R267-E723 VanDerWaalsContact NH2-CB 3.3Å; R267-E723 IonicContact NH2-OE2 3.63Å; R267-E723 PolarHBondContact NH2-OE2 2.77Å
268	D	88.8	Confident	91.7	Very high	65 Å²	65	46.9 Å²	46.9	35%	0.348	25%	0.245	S	C	.	.	H	α-helix	trans	-58.2	-42	176.6	-108.3	14.7	0	0	0	111.7	D264 A265 V266 V272 K537	D264-D268 PolarHBondContact O-N 3.17Å; A265-D268 PolarHBondContact O-N 3.39Å; V266-D268 VanDerWaalsContact C-N 3.33Å; V266-D268 PolarHBondContact O-N 3.36Å; D268-V272 WeakPolarHBondContact O-CG2 3.34Å; D268-V272 PolarHBondContact O-N 2.67Å; D268-K537 WeakPolarHBondContact OD1-CE 3.48Å; D268-K537 IonicContact OD1-NZ 3.8Å; D268-K537 PolarHBondContact OD1-NZ 3.44Å; D268-K537 WeakPolarHBondContact OD2-CE 3.3Å; D268-K537 IonicContact OD2-NZ 3.64Å; D268-K537 PolarHBondContact OD2-NZ 3.49Å
269	I	93.3	Very high	91.7	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-66.3	-46.2	172.5	-63.6	171.3	0	0	0	110.9	L223 T227 V229 I237 M261 A265 V266 R267 M271 V272 Y273	L223-I269 HydrophobicContact CD1-CG2 4.13Å; L223-I269 HydrophobicContact CD2-CG2 3.78Å; L223-I269 HydrophobicContact CG-CG2 4.13Å; T227-I269 HydrophobicContact CG2-CG1 4.09Å; V229-I269 HydrophobicContact CB-CD1 4.3Å; V229-I269 HydrophobicContact CG1-CD1 4.01Å; V229-I269 HydrophobicContact CG2-CD1 4.07Å; V229-I269 HydrophobicContact CG2-CG1 4.41Å; I237-I269 HydrophobicContact CD1-CD1 3.45Å; I237-I269 VanDerWaalsContact CD1-CD1 3.45Å; I237-I269 HydrophobicContact CG2-CG2 3.9Å; M261-I269 HydrophobicContact CE-CD1 3.56Å; M261-I269 HydrophobicContact CE-CG1 4.39Å; M261-I269 HydrophobicContact SD-CD1 3.88Å; A265-I269 PolarHBondContact O-N 2.93Å; V266-I269 PolarHBondContact O-N 3.08Å; R267-I269 VanDerWaalsContact C-N 3.29Å; R267-I269 PolarHBondContact O-N 3.1Å; I269-M271 VanDerWaalsContact C-N 3.33Å; I269-M271 PolarHBondContact O-N 3.35Å; I269-V272 PolarHBondContact O-N 3.41Å; I269-Y273 WeakPolarHBondContact O-CB 3.46Å; I269-Y273 PolarHBondContact O-N 2.92Å
270	Q	93.3	Very high	91.6	Very high	50 Å²	50	44 Å²	44	23%	0.234	23%	0.229	C	C	.	.	H	α-helix	trans	-57.8	-44.8	180	-179.3	-177.7	-12.3	0	0	111.6	L241 V247 V266 R267 Y273 E274	L241-Q270 HydrophobicContact CD1-CB 4.14Å; L241-Q270 HydrophobicContact CD1-CG 4.08Å; L241-Q270 HydrophobicContact CD2-CG 4.08Å; V247-Q270 VanDerWaalsContact CG2-OE1 3.28Å; V266-Q270 PolarHBondContact O-N 3.36Å; R267-Q270 WeakPolarHBondContact O-CB 3.29Å; R267-Q270 PolarHBondContact O-N 2.89Å; R267-Q270 VanDerWaalsContact O-N 3.13Å; Q270-Y273 WeakPolarHBondContact O-CB 3.42Å; Q270-Y273 PolarHBondContact O-N 2.9Å; Q270-E274 HydrophobicContact CG-CG 4.43Å; Q270-E274 VanDerWaalsContact CG-OE1 3.32Å; Q270-E274 WeakPolarHBondContact CG-OE1 3.34Å; Q270-E274 PolarHBondContact NE2-OE1 2.89Å; Q270-E274 WeakPolarHBondContact O-CB 3.11Å; Q270-E274 WeakPolarHBondContact O-CG 3.33Å; Q270-E274 PolarHBondContact O-N 3.05Å
271	M	89.6	Confident	91.7	Very high	76 Å²	76	46.6 Å²	46.6	37%	0.374	24%	0.239	S	C	.	.	H	α-helix	trans	-59.7	-48.8	177.5	-74.1	-178.5	63.9	0	0	111.7	R267 I269 Y273 E274 E275	R267-M271 WeakPolarHBondContact O-CG 3.36Å; R267-M271 PolarHBondContact O-N 3.02Å; I269-M271 VanDerWaalsContact C-N 3.33Å; I269-M271 PolarHBondContact O-N 3.35Å; M271-Y273 VanDerWaalsContact C-N 3.32Å; M271-Y273 PolarHBondContact O-N 2.66Å; M271-E274 PolarHBondContact O-N 3.31Å; M271-E275 WeakPolarHBondContact O-CB 3.33Å; M271-E275 WeakPolarHBondContact O-CG 3.28Å; M271-E275 PolarHBondContact O-N 3.18Å
272	V	91.8	Very high	91.9	Very high	23 Å²	23	49.7 Å²	49.7	14%	0.139	25%	0.252	C	S	.	.	H	α-helix	trans	-65.4	-36.9	178.6	178.8	0	0	0	0	111.3	L223 L226 T227 D268 I269 E275 L276	L223-V272 HydrophobicContact CD1-CB 3.74Å; L223-V272 HydrophobicContact CD1-CG1 3.59Å; L226-V272 HydrophobicContact CB-CG1 3.99Å; L226-V272 HydrophobicContact CD1-CG1 3.81Å; T227-V272 HydrophobicContact CG2-CB 4.19Å; T227-V272 HydrophobicContact CG2-CG1 4.39Å; T227-V272 HydrophobicContact CG2-CG2 4.17Å; D268-V272 WeakPolarHBondContact O-CG2 3.34Å; D268-V272 PolarHBondContact O-N 2.67Å; I269-V272 PolarHBondContact O-N 3.41Å; V272-E275 PolarHBondContact O-N 3.1Å; V272-L276 HydrophobicContact CG1-CD1 4.15Å; V272-L276 HydrophobicContact CG1-CG 4.49Å; V272-L276 WeakPolarHBondContact O-CB 3.46Å; V272-L276 VanDerWaalsContact O-CG 3.27Å; V272-L276 WeakPolarHBondContact O-CG 3.27Å; V272-L276 PolarHBondContact O-N 2.96Å
273	Y	93.4	Very high	92.1	Very high	31 Å²	31	45.1 Å²	45.1	12%	0.122	23%	0.227	C	C	.	.	H	α-helix	trans	-62.6	-44.8	173.6	170.1	-101.5	0	0	0	112.3	L219 L223 I238 L241 I269 Q270 M271 L276 C277	L219-Y273 HydrophobicContact CD1-CD2 4.35Å; L219-Y273 HydrophobicContact CD2-CD2 4.06Å; L219-Y273 HydrophobicContact CD2-CE2 3.64Å; L219-Y273 HydrophobicContact CG-CD2 4.41Å; L219-Y273 HydrophobicContact CG-CE2 4.46Å; L223-Y273 HydrophobicContact CD2-CD2 4.45Å; I238-Y273 HydrophobicContact CB-CE2 4.27Å; I238-Y273 HydrophobicContact CD1-CD2 4.34Å; I238-Y273 HydrophobicContact CD1-CE2 4.44Å; I238-Y273 HydrophobicContact CG1-CD2 3.73Å; I238-Y273 HydrophobicContact CG1-CE2 3.78Å; I238-Y273 HydrophobicContact CG2-CE2 3.8Å; L241-Y273 HydrophobicContact CD1-CD1 4.06Å; L241-Y273 HydrophobicContact CD1-CE1 4.45Å; I269-Y273 WeakPolarHBondContact O-CB 3.46Å; I269-Y273 PolarHBondContact O-N 2.92Å; Q270-Y273 WeakPolarHBondContact O-CB 3.42Å; Q270-Y273 PolarHBondContact O-N 2.9Å; M271-Y273 VanDerWaalsContact C-N 3.32Å; M271-Y273 PolarHBondContact O-N 2.66Å; Y273-L276 PolarHBondContact O-N 2.83Å; Y273-C277 WeakPolarHBondContact O-CB 3.5Å; Y273-C277 PolarHBondContact O-N 3.38Å; Y273-C277 PolarHBondContact O-SG 3.21Å
274	E	91.7	Very high	92.2	Very high	103 Å²	103	47.9 Å²	47.9	48%	0.481	24%	0.239	S	C	.	.	H	α-helix	trans	-65.9	-39.5	176.9	-74.4	176.5	-165.6	0	0	112	Q270 M271 C277 S278	Q270-E274 HydrophobicContact CG-CG 4.43Å; Q270-E274 VanDerWaalsContact CG-OE1 3.32Å; Q270-E274 WeakPolarHBondContact CG-OE1 3.34Å; Q270-E274 PolarHBondContact NE2-OE1 2.89Å; Q270-E274 WeakPolarHBondContact O-CB 3.11Å; Q270-E274 WeakPolarHBondContact O-CG 3.33Å; Q270-E274 PolarHBondContact O-N 3.05Å; M271-E274 PolarHBondContact O-N 3.31Å; E274-C277 PolarHBondContact O-N 3.02Å; E274-S278 VanDerWaalsContact O-CB 3.25Å; E274-S278 WeakPolarHBondContact O-CB 3.36Å; E274-S278 PolarHBondContact O-N 3.28Å
275	E	90.4	Very high	92.5	Very high	124 Å²	124	48.4 Å²	48.4	58%	0.579	25%	0.248	S	C	*	.	H	α-helix	trans	-60.3	-46.9	172.6	-76.4	178.8	-175.7	0	0	111.9	M271 V272 S278 L279	M271-E275 WeakPolarHBondContact O-CB 3.33Å; M271-E275 WeakPolarHBondContact O-CG 3.28Å; M271-E275 PolarHBondContact O-N 3.18Å; V272-E275 PolarHBondContact O-N 3.1Å; E275-S278 WeakPolarHBondContact O-CB 3.37Å; E275-S278 PolarHBondContact O-N 2.97Å; E275-L279 WeakPolarHBondContact O-CB 3.33Å; E275-L279 PolarHBondContact O-N 3.13Å
276	L	92.5	Very high	92.6	Very high	5 Å²	5	47.4 Å²	47.4	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-64.7	-39.2	176.9	-70.5	171	0	0	0	112.1	W217 L219 V222 L223 L226 V272 Y273 L279 A280	W217-L276 HydrophobicContact CH2-CB 4.17Å; W217-L276 HydrophobicContact CH2-CD2 4.2Å; W217-L276 HydrophobicContact CZ2-CD2 4.45Å; L219-L276 HydrophobicContact CD1-CB 3.78Å; L219-L276 HydrophobicContact CD1-CD1 3.89Å; L219-L276 HydrophobicContact CD1-CG 4.47Å; V222-L276 HydrophobicContact CB-CD1 4.45Å; V222-L276 HydrophobicContact CG1-CD1 3.9Å; V222-L276 HydrophobicContact CG1-CD2 3.83Å; L223-L276 HydrophobicContact CB-CD1 4.36Å; L223-L276 HydrophobicContact CD1-CD1 4.47Å; L226-L276 HydrophobicContact CD1-CD1 4.35Å; L226-L276 HydrophobicContact CD1-CD2 4.31Å; V272-L276 HydrophobicContact CG1-CD1 4.15Å; V272-L276 HydrophobicContact CG1-CG 4.49Å; V272-L276 WeakPolarHBondContact O-CB 3.46Å; V272-L276 VanDerWaalsContact O-CG 3.27Å; V272-L276 WeakPolarHBondContact O-CG 3.27Å; V272-L276 PolarHBondContact O-N 2.96Å; Y273-L276 PolarHBondContact O-N 2.83Å; L276-L279 PolarHBondContact O-N 3.33Å; L276-A280 PolarHBondContact O-N 2.82Å
277	C	92.5	Very high	92.7	Very high	17 Å²	17	48.1 Å²	48.1	12%	0.115	24%	0.242	C	C	.	.	H	α-helix	trans	-66.3	-39.2	174.2	-69.9	0	0	0	0	112.3	Y273 E274 K281	Y273-C277 WeakPolarHBondContact O-CB 3.5Å; Y273-C277 PolarHBondContact O-N 3.38Å; Y273-C277 PolarHBondContact O-SG 3.21Å; E274-C277 PolarHBondContact O-N 3.02Å; C277-K281 VanDerWaalsContact O-CG 3.3Å; C277-K281 WeakPolarHBondContact O-CG 3.32Å; C277-K281 PolarHBondContact O-N 3.39Å; C277-K281 VanDerWaalsContact O-N 3.07Å
278	S	92.7	Very high	92.8	Very high	75 Å²	75	52.1 Å²	52.1	52%	0.524	26%	0.262	S	S	.	.	H	α-helix	trans	-65.7	-42.8	175.3	-173.7	0	0	0	0	111.4	E274 E275 K281 K282	E274-S278 VanDerWaalsContact O-CB 3.25Å; E274-S278 WeakPolarHBondContact O-CB 3.36Å; E274-S278 PolarHBondContact O-N 3.28Å; E275-S278 WeakPolarHBondContact O-CB 3.37Å; E275-S278 PolarHBondContact O-N 2.97Å; S278-K281 PolarHBondContact O-N 3.16Å; S278-K282 WeakPolarHBondContact O-CB 3.27Å; S278-K282 PolarHBondContact O-N 2.65Å
279	L	93.6	Very high	92.9	Very high	12 Å²	12	51 Å²	51	6%	0.063	26%	0.258	C	S	.	.	H	α-helix	trans	-57.9	-52.4	173.1	177.9	64	0	0	0	111.2	W217 E275 L276 K281 K282 T283 R308 S309 L313	W217-L279 HydrophobicContact CZ2-CD2 4.48Å; E275-L279 WeakPolarHBondContact O-CB 3.33Å; E275-L279 PolarHBondContact O-N 3.13Å; L276-L279 PolarHBondContact O-N 3.33Å; L279-K281 PolarHBondContact O-N 3.05Å; L279-K282 PolarHBondContact O-N 2.98Å; L279-K282 VanDerWaalsContact O-N 3.13Å; L279-T283 PolarHBondContact O-N 3.14Å; L279-T283 PolarHBondContact O-OG1 3.43Å; L279-R308 WeakPolarHBondContact CD2-O 2.8Å; L279-S309 WeakPolarHBondContact CD1-O 3.38Å; L279-L313 HydrophobicContact CD1-CB 4.05Å; L279-L313 HydrophobicContact CD1-CD2 3.9Å
280	A	93.6	Very high	92.8	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.1	-47.1	179.5	0	0	0	0	0	112.1	L213 M215 L276 K282 T283 Q284	L213-A280 HydrophobicContact CB-CB 4.03Å; L213-A280 HydrophobicContact CD1-CB 4.14Å; L213-A280 HydrophobicContact CD2-CB 4.09Å; L213-A280 HydrophobicContact CG-CB 4.32Å; M215-A280 HydrophobicContact CG-CB 3.82Å; M215-A280 HydrophobicContact SD-CB 4.2Å; L276-A280 PolarHBondContact O-N 2.82Å; A280-K282 VanDerWaalsContact C-N 3.32Å; A280-K282 PolarHBondContact O-N 3.12Å; A280-T283 PolarHBondContact O-N 2.9Å; A280-Q284 WeakPolarHBondContact O-CG 3.31Å; A280-Q284 PolarHBondContact O-N 3.34Å
281	K	94.1	Very high	92.8	Very high	145 Å²	145	56.1 Å²	56.1	63%	0.63	28%	0.279	S	S	*	.	H	α-helix	trans	-58.4	-41.7	175	-73.3	169.6	-178.8	175.2	0	112.2	C277 S278 L279 S285	C277-K281 VanDerWaalsContact O-CG 3.3Å; C277-K281 WeakPolarHBondContact O-CG 3.32Å; C277-K281 PolarHBondContact O-N 3.39Å; C277-K281 VanDerWaalsContact O-N 3.07Å; S278-K281 PolarHBondContact O-N 3.16Å; L279-K281 PolarHBondContact O-N 3.05Å; K281-S285 PolarHBondContact O-N 3.06Å; K281-S285 VanDerWaalsContact O-N 3.09Å
282	K	94.3	Very high	92.9	Very high	100 Å²	100	60.7 Å²	60.7	44%	0.435	30%	0.297	S	S	.	.	H	α-helix	trans	-67.8	-42.4	177.6	-170.8	179	172.4	-173.3	0	111.7	S278 L279 A280 S285 V286 L313	S278-K282 WeakPolarHBondContact O-CB 3.27Å; S278-K282 PolarHBondContact O-N 2.65Å; L279-K282 PolarHBondContact O-N 2.98Å; L279-K282 VanDerWaalsContact O-N 3.13Å; A280-K282 VanDerWaalsContact C-N 3.32Å; A280-K282 PolarHBondContact O-N 3.12Å; K282-S285 PolarHBondContact O-N 3.29Å; K282-V286 WeakPolarHBondContact O-CG2 3.38Å; K282-V286 PolarHBondContact O-N 3.47Å; K282-L313 HydrophobicContact CB-CD2 4.13Å; K282-L313 HydrophobicContact CD-CD2 3.92Å; K282-L313 HydrophobicContact CG-CD2 3.8Å
283	T	94.6	Very high	92.7	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-58.8	-48.2	174	-66.3	0	0	0	0	111.3	M215 L279 A280 S285 V286 I287 L304	M215-T283 HydrophobicContact CE-CG2 4.02Å; M215-T283 HydrophobicContact SD-CG2 3.78Å; L279-T283 PolarHBondContact O-N 3.14Å; L279-T283 PolarHBondContact O-OG1 3.43Å; A280-T283 PolarHBondContact O-N 2.9Å; T283-S285 VanDerWaalsContact C-N 3.34Å; T283-S285 PolarHBondContact O-N 2.97Å; T283-V286 WeakPolarHBondContact O-CB 3.45Å; T283-V286 PolarHBondContact O-N 3.43Å; T283-I287 HydrophobicContact CG2-CD1 3.77Å; T283-I287 HydrophobicContact CG2-CG1 4.42Å; T283-I287 WeakPolarHBondContact O-CG1 3.34Å; T283-I287 PolarHBondContact O-N 2.98Å; T283-L304 HydrophobicContact CG2-CB 4.15Å; T283-L304 VanDerWaalsContact CG2-O 3.27Å; T283-L304 WeakPolarHBondContact CG2-O 3.39Å
284	Q	93.6	Very high	92.3	Very high	61 Å²	61	64.4 Å²	64.4	29%	0.285	34%	0.335	S	S	.	.	H	α-helix	trans	-58.7	-43.4	176.5	-69.8	176	7.5	0	0	112.1	L213 A280 V286 I287 Q288	L213-Q284 PolarHBondContact O-NE2 2.84Å; A280-Q284 WeakPolarHBondContact O-CG 3.31Å; A280-Q284 PolarHBondContact O-N 3.34Å; Q284-V286 PolarHBondContact O-N 2.62Å; Q284-I287 PolarHBondContact O-N 3.31Å; Q284-Q288 WeakPolarHBondContact O-CG 3.48Å; Q284-Q288 PolarHBondContact O-N 3.5Å
285	S	94.1	Very high	92.1	Very high	68 Å²	68	61.8 Å²	61.8	48%	0.476	33%	0.326	S	S	.	.	H	α-helix	trans	-62.9	-39.5	175.9	-176.3	0	0	0	0	112.8	K281 K282 T283 T289	K281-S285 PolarHBondContact O-N 3.06Å; K281-S285 VanDerWaalsContact O-N 3.09Å; K282-S285 PolarHBondContact O-N 3.29Å; T283-S285 VanDerWaalsContact C-N 3.34Å; T283-S285 PolarHBondContact O-N 2.97Å; S285-T289 WeakPolarHBondContact O-CB 3.22Å; S285-T289 PolarHBondContact O-N 3.41Å; S285-T289 PolarHBondContact O-OG1 3.01Å
286	V	93.3	Very high	92.1	Very high	9 Å²	9	57.6 Å²	57.6	6%	0.055	31%	0.307	C	S	.	.	H	α-helix	trans	-63.5	-49.1	173.3	167.3	0	0	0	0	111	K282 T283 Q284 Q288 T289 L290 L304 Y317	K282-V286 WeakPolarHBondContact O-CG2 3.38Å; K282-V286 PolarHBondContact O-N 3.47Å; T283-V286 WeakPolarHBondContact O-CB 3.45Å; T283-V286 PolarHBondContact O-N 3.43Å; Q284-V286 PolarHBondContact O-N 2.62Å; V286-Q288 PolarHBondContact O-N 2.95Å; V286-T289 WeakPolarHBondContact O-CB 3.3Å; V286-T289 PolarHBondContact O-N 3.48Å; V286-T289 VanDerWaalsContact O-N 3.08Å; V286-L290 HydrophobicContact CG1-CD1 3.75Å; V286-L290 HydrophobicContact CG1-CG 4.28Å; V286-L290 WeakPolarHBondContact O-CG 3.46Å; V286-L290 PolarHBondContact O-N 3.33Å; V286-L304 HydrophobicContact CG1-CD1 4.15Å; V286-L304 HydrophobicContact CG1-CD2 3.96Å; V286-Y317 HydrophobicContact CG1-CD1 4.34Å; V286-Y317 HydrophobicContact CG1-CD2 3.44Å; V286-Y317 VanDerWaalsContact CG1-CD2 3.44Å; V286-Y317 HydrophobicContact CG1-CE2 3.83Å; V286-Y317 HydrophobicContact CG1-CG 3.75Å; V286-Y317 HydrophobicContact CG2-CD1 3.9Å; V286-Y317 HydrophobicContact CG2-CD2 4.42Å; V286-Y317 HydrophobicContact CG2-CE1 3.97Å; V286-Y317 HydrophobicContact CG2-CE2 4.49Å; V286-Y317 HydrophobicContact CG2-CG 4.14Å
287	I	94.1	Very high	91.9	Very high	16 Å²	16	60.4 Å²	60.4	8%	0.082	32%	0.324	C	S	.	.	H	α-helix	trans	-57.5	-46.7	177.5	-69.8	168.1	0	0	0	110.8	T283 Q284 T289 L290 K291 L296 E301 L304 R305	T283-I287 HydrophobicContact CG2-CD1 3.77Å; T283-I287 HydrophobicContact CG2-CG1 4.42Å; T283-I287 WeakPolarHBondContact O-CG1 3.34Å; T283-I287 PolarHBondContact O-N 2.98Å; Q284-I287 PolarHBondContact O-N 3.31Å; I287-T289 VanDerWaalsContact C-N 3.3Å; I287-T289 PolarHBondContact O-N 3.28Å; I287-L290 PolarHBondContact O-N 3.3Å; I287-K291 WeakPolarHBondContact O-CB 3.12Å; I287-K291 PolarHBondContact O-N 2.93Å; I287-L296 HydrophobicContact CG2-CD2 3.83Å; I287-E301 HydrophobicContact CD1-CG 4.15Å; I287-E301 HydrophobicContact CG1-CG 4.46Å; I287-E301 HydrophobicContact CG2-CG 4.26Å; I287-L304 HydrophobicContact CD1-CB 4.16Å; I287-L304 HydrophobicContact CG1-CB 4.07Å; I287-L304 HydrophobicContact CG1-CD1 3.85Å; I287-R305 HydrophobicContact CD1-CG 3.88Å
288	Q	93.4	Very high	91.7	Very high	112 Å²	112	64 Å²	64	52%	0.523	35%	0.348	S	S	.	.	H	α-helix	trans	-61	-36.6	175.8	-72.5	179.3	16.9	0	0	113	Q284 V286 K292	Q284-Q288 WeakPolarHBondContact O-CG 3.48Å; Q284-Q288 PolarHBondContact O-N 3.5Å; V286-Q288 PolarHBondContact O-N 2.95Å; Q288-K292 WeakPolarHBondContact O-CG 3.42Å; Q288-K292 PolarHBondContact O-N 3.19Å; Q288-K292 VanDerWaalsContact O-N 3.15Å
289	T	92	Very high	91.3	Very high	43 Å²	43	66 Å²	66	26%	0.264	35%	0.349	S	S	.	.	H	α-helix	trans	-68.8	-47.8	177.6	-57.2	0	0	0	0	110.9	S285 V286 I287 K291 K292 D293	S285-T289 WeakPolarHBondContact O-CB 3.22Å; S285-T289 PolarHBondContact O-N 3.41Å; S285-T289 PolarHBondContact O-OG1 3.01Å; V286-T289 WeakPolarHBondContact O-CB 3.3Å; V286-T289 PolarHBondContact O-N 3.48Å; V286-T289 VanDerWaalsContact O-N 3.08Å; I287-T289 VanDerWaalsContact C-N 3.3Å; I287-T289 PolarHBondContact O-N 3.28Å; T289-K291 VanDerWaalsContact C-N 3.31Å; T289-K291 PolarHBondContact O-N 3.22Å; T289-K292 PolarHBondContact O-N 3.32Å; T289-K292 VanDerWaalsContact O-N 3.17Å; T289-D293 PolarHBondContact O-N 3.3Å
290	L	91.2	Very high	90.9	Very high	2 Å²	2	66 Å²	66	1%	0.01	35%	0.349	C	S	.	.	H	α-helix	trans	-63.4	-35.4	178.1	-66.2	171.3	0	0	0	112.7	V286 I287 D293 G294 V295 L296 L300 L304 Y317 Y320	V286-L290 HydrophobicContact CG1-CD1 3.75Å; V286-L290 HydrophobicContact CG1-CG 4.28Å; V286-L290 WeakPolarHBondContact O-CG 3.46Å; V286-L290 PolarHBondContact O-N 3.33Å; I287-L290 PolarHBondContact O-N 3.3Å; L290-D293 PolarHBondContact O-N 3.33Å; L290-G294 PolarHBondContact O-N 3.48Å; L290-G294 VanDerWaalsContact O-N 3.1Å; L290-V295 PolarHBondContact O-N 3.19Å; L290-L296 HydrophobicContact CB-CB 4.01Å; L290-L296 HydrophobicContact CB-CD1 4.07Å; L290-L296 HydrophobicContact CD1-CD1 4.23Å; L290-L296 PolarHBondContact O-N 3.1Å; L290-L300 HydrophobicContact CD1-CD2 4.07Å; L290-L300 HydrophobicContact CD1-CG 4.49Å; L290-L304 HydrophobicContact CD1-CD1 3.48Å; L290-L304 VanDerWaalsContact CD1-CD1 3.48Å; L290-Y317 HydrophobicContact CD1-CD2 4.4Å; L290-Y317 HydrophobicContact CD2-CD2 4.37Å; L290-Y317 HydrophobicContact CD2-CE2 4.08Å; L290-Y317 HydrophobicContact CG-CE2 4.39Å; L290-Y320 VanDerWaalsContact CD2-CB 3.48Å; L290-Y320 HydrophobicContact CD2-CD1 4.16Å; L290-Y320 HydrophobicContact CD2-CG 3.91Å
291	K	93	Very high	90.8	Very high	157 Å²	157	68.3 Å²	68.3	68%	0.683	36%	0.36	S	S	*	.	H	α-helix	trans	-65.4	-40.7	173.9	-170.8	169.2	-176.5	168.7	0	112	I287 T289 G294 L296	I287-K291 WeakPolarHBondContact O-CB 3.12Å; I287-K291 PolarHBondContact O-N 2.93Å; T289-K291 VanDerWaalsContact C-N 3.31Å; T289-K291 PolarHBondContact O-N 3.22Å; K291-G294 PolarHBondContact O-N 3.09Å; K291-L296 HydrophobicContact CB-CD2 3.93Å; K291-L296 HydrophobicContact CG-CD2 4.48Å
292	K	92.1	Very high	90.6	Very high	172 Å²	172	67.1 Å²	67.1	75%	0.748	36%	0.356	S	S	*	.	H	α-helix	trans	-68.4	-36	174.5	-73.9	171.5	-178.5	176.1	0	112.7	Q288 T289 G294	Q288-K292 WeakPolarHBondContact O-CG 3.42Å; Q288-K292 PolarHBondContact O-N 3.19Å; Q288-K292 VanDerWaalsContact O-N 3.15Å; T289-K292 PolarHBondContact O-N 3.32Å; T289-K292 VanDerWaalsContact O-N 3.17Å; K292-G294 PolarHBondContact O-N 3.16Å
293	D	86.6	Confident	90.2	Very high	62 Å²	62	64.9 Å²	64.9	33%	0.332	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-4	177.7	-66.9	-19.7	0	0	0	113	T289 L290 V295 K322	T289-D293 PolarHBondContact O-N 3.3Å; L290-D293 PolarHBondContact O-N 3.33Å; D293-V295 VanDerWaalsContact C-N 3.33Å; D293-V295 HydrophobicContact CB-CG2 4.07Å; D293-V295 VanDerWaalsContact O-CG2 3.28Å; D293-V295 WeakPolarHBondContact O-CG2 3.4Å; D293-V295 PolarHBondContact O-N 2.85Å; D293-K322 VanDerWaalsContact CG-CE 3.44Å; D293-K322 VanDerWaalsContact CG-NZ 3.34Å; D293-K322 VanDerWaalsContact OD1-CE 3.31Å; D293-K322 WeakPolarHBondContact OD1-CE 3.36Å; D293-K322 IonicContact OD1-NZ 3.83Å; D293-K322 PolarHBondContact OD1-NZ 3.07Å; D293-K322 WeakPolarHBondContact OD2-CE 3.27Å; D293-K322 IonicContact OD2-NZ 3.16Å; D293-K322 PolarHBondContact OD2-NZ 3.49Å
294	G	86.2	Confident	90	Very high	70 Å²	70	64.9 Å²	64.9	72%	0.722	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	17.7	176.8	0	0	0	0	0	115.2	L290 K291 K292	L290-G294 PolarHBondContact O-N 3.48Å; L290-G294 VanDerWaalsContact O-N 3.1Å; K291-G294 PolarHBondContact O-N 3.09Å; K292-G294 PolarHBondContact O-N 3.16Å
295	V	85.6	Confident	90	Very high	47 Å²	47	64.6 Å²	64.6	29%	0.285	35%	0.349	S	S	.	.			trans	-112.7	5.7	-173.1	-151	0	0	0	0	113	L290 D293 T297 Y320	L290-V295 PolarHBondContact O-N 3.19Å; D293-V295 VanDerWaalsContact C-N 3.33Å; D293-V295 HydrophobicContact CB-CG2 4.07Å; D293-V295 VanDerWaalsContact O-CG2 3.28Å; D293-V295 WeakPolarHBondContact O-CG2 3.4Å; D293-V295 PolarHBondContact O-N 2.85Å; V295-T297 PolarHBondContact O-N 3.28Å; V295-Y320 HydrophobicContact CB-CD1 4.42Å; V295-Y320 HydrophobicContact CG1-CD1 3.85Å; V295-Y320 HydrophobicContact CG1-CE1 3.86Å
296	L	90.8	Very high	89.8	Confident	37 Å²	37	64.1 Å²	64.1	19%	0.194	35%	0.346	C	S	.	.			trans	-82.3	111.5	179.6	-172.7	68.3	0	0	0	110.8	I287 L290 K291 L300 E301 L304	I287-L296 HydrophobicContact CG2-CD2 3.83Å; L290-L296 HydrophobicContact CB-CB 4.01Å; L290-L296 HydrophobicContact CB-CD1 4.07Å; L290-L296 HydrophobicContact CD1-CD1 4.23Å; L290-L296 PolarHBondContact O-N 3.1Å; K291-L296 HydrophobicContact CB-CD2 3.93Å; K291-L296 HydrophobicContact CG-CD2 4.48Å; L296-L300 HydrophobicContact CD1-CD2 4.45Å; L296-L300 HydrophobicContact CD1-CG 4.36Å; L296-E301 HydrophobicContact CD1-CB 3.92Å; L296-E301 HydrophobicContact CD2-CB 4.47Å; L296-E301 HydrophobicContact CG-CB 4.28Å; L296-L304 HydrophobicContact CD1-CD1 4.31Å
297	T	88.2	Confident	89.6	Confident	63 Å²	63	64.1 Å²	64.1	39%	0.387	35%	0.346	S	S	.	.			trans	-94.6	158.2	168.2	81.6	0	0	0	0	109.8	V295 E299 L300 E301	V295-T297 PolarHBondContact O-N 3.28Å; T297-E299 VanDerWaalsContact C-N 3.31Å; T297-E299 WeakPolarHBondContact CB-OE2 3.32Å; T297-E299 PolarHBondContact O-N 2.71Å; T297-E299 PolarHBondContact OG1-OE2 2.89Å; T297-L300 PolarHBondContact O-N 3.38Å; T297-L300 WeakPolarHBondContact OG1-CB 3.16Å; T297-L300 PolarHBondContact OG1-N 3.1Å; T297-E301 PolarHBondContact O-N 2.94Å
298	P	88.4	Confident	89.3	Confident	94 Å²	94	70.3 Å²	70.3	61%	0.61	37%	0.369	S	S	*	.	H	α-helix	trans	-62.6	-36.2	-179.5	23.7	-32	0	0	0	112.7	L300 E301 E302	P298-L300 VanDerWaalsContact C-N 3.33Å; P298-L300 PolarHBondContact O-N 2.83Å; P298-E301 PolarHBondContact O-N 3.33Å; P298-E302 PolarHBondContact O-N 3.38Å
299	E	84.8	Confident	89	Confident	117 Å²	117	67 Å²	67	55%	0.547	36%	0.358	S	S	.	.	H	α-helix	trans	-67.8	-35.1	177.3	-44.3	76	-168.8	0	0	111.3	T297 S303	T297-E299 VanDerWaalsContact C-N 3.31Å; T297-E299 WeakPolarHBondContact CB-OE2 3.32Å; T297-E299 PolarHBondContact O-N 2.71Å; T297-E299 PolarHBondContact OG1-OE2 2.89Å; E299-S303 VanDerWaalsContact O-CB 3.31Å; E299-S303 WeakPolarHBondContact O-CB 3.33Å; E299-S303 PolarHBondContact O-N 2.91Å; E299-S303 PolarHBondContact O-OG 3.32Å
300	L	85.3	Confident	88.7	Confident	11 Å²	11	67.5 Å²	67.5	6%	0.058	37%	0.367	C	S	.	.	H	α-helix	trans	-69.7	-40.1	174	-179.6	60	0	0	0	111	L290 L296 T297 P298 S303 L304 V316 Y320	L290-L300 HydrophobicContact CD1-CD2 4.07Å; L290-L300 HydrophobicContact CD1-CG 4.49Å; L296-L300 HydrophobicContact CD1-CD2 4.45Å; L296-L300 HydrophobicContact CD1-CG 4.36Å; T297-L300 PolarHBondContact O-N 3.38Å; T297-L300 WeakPolarHBondContact OG1-CB 3.16Å; T297-L300 PolarHBondContact OG1-N 3.1Å; P298-L300 VanDerWaalsContact C-N 3.33Å; P298-L300 PolarHBondContact O-N 2.83Å; L300-S303 PolarHBondContact O-N 3.46Å; L300-L304 HydrophobicContact CD1-CD1 4.27Å; L300-L304 HydrophobicContact CD1-CG 4.36Å; L300-L304 HydrophobicContact CG-CD1 4.05Å; L300-L304 WeakPolarHBondContact O-CB 3.36Å; L300-L304 WeakPolarHBondContact O-CD1 3.44Å; L300-L304 WeakPolarHBondContact O-CG 3.24Å; L300-L304 PolarHBondContact O-N 3Å; L300-V316 HydrophobicContact CD1-CG1 3.83Å; L300-Y320 HydrophobicContact CD1-CE2 3.76Å; L300-Y320 HydrophobicContact CD2-CD1 4.31Å; L300-Y320 HydrophobicContact CD2-CD2 4.39Å; L300-Y320 HydrophobicContact CD2-CE1 3.78Å; L300-Y320 HydrophobicContact CD2-CE2 3.86Å; L300-Y320 HydrophobicContact CG-CE2 4.5Å
301	E	90.8	Very high	88.3	Confident	49 Å²	49	69.6 Å²	69.6	23%	0.229	38%	0.378	C	S	.	.	H	α-helix	trans	-62.7	-43.8	175	-170	169.3	171.9	0	0	111.7	I287 L296 T297 P298 L304 R305	I287-E301 HydrophobicContact CD1-CG 4.15Å; I287-E301 HydrophobicContact CG1-CG 4.46Å; I287-E301 HydrophobicContact CG2-CG 4.26Å; L296-E301 HydrophobicContact CD1-CB 3.92Å; L296-E301 HydrophobicContact CD2-CB 4.47Å; L296-E301 HydrophobicContact CG-CB 4.28Å; T297-E301 PolarHBondContact O-N 2.94Å; P298-E301 PolarHBondContact O-N 3.33Å; E301-L304 PolarHBondContact O-N 3.03Å; E301-R305 HydrophobicContact CG-CG 4.46Å; E301-R305 WeakPolarHBondContact O-CB 3.17Å; E301-R305 VanDerWaalsContact O-CG 3.28Å; E301-R305 WeakPolarHBondContact O-CG 3.18Å; E301-R305 PolarHBondContact O-N 3.15Å; E301-R305 IonicContact OE1-CZ 3.4Å; E301-R305 IonicContact OE1-NE 2.72Å; E301-R305 PolarHBondContact OE1-NE 3.42Å; E301-R305 IonicContact OE1-NH2 3.27Å; E301-R305 PolarHBondContact OE1-NH2 3.1Å
302	E	89.5	Confident	87.9	Confident	120 Å²	120	64.3 Å²	64.3	56%	0.561	36%	0.357	S	S	*	.	H	α-helix	trans	-63.3	-43.1	175.3	-167.3	-179.2	-177.5	0	0	112.2	N216 P298 L304 R305 S306	N216-E302 WeakPolarHBondContact ND2-CG 3.44Å; P298-E302 PolarHBondContact O-N 3.38Å; E302-L304 VanDerWaalsContact C-N 3.3Å; E302-L304 PolarHBondContact O-N 3.49Å; E302-R305 PolarHBondContact O-N 2.99Å; E302-S306 WeakPolarHBondContact O-CB 3.3Å; E302-S306 PolarHBondContact O-N 2.95Å; E302-S306 PolarHBondContact O-OG 2.75Å
303	S	86.8	Confident	87.7	Confident	53 Å²	53	56.1 Å²	56.1	37%	0.371	32%	0.322	S	S	.	.	H	α-helix	trans	-60.3	-38.7	175.1	-61.8	0	0	0	0	112.2	E299 L300 S306 C307	E299-S303 VanDerWaalsContact O-CB 3.31Å; E299-S303 WeakPolarHBondContact O-CB 3.33Å; E299-S303 PolarHBondContact O-N 2.91Å; E299-S303 PolarHBondContact O-OG 3.32Å; L300-S303 PolarHBondContact O-N 3.46Å; S303-S306 WeakPolarHBondContact CA-OG 3.39Å; S303-S306 PolarHBondContact O-OG 3.23Å; S303-S306 VanDerWaalsContact O-OG 3.05Å; S303-C307 PolarHBondContact O-SG 3.44Å
304	L	90.8	Very high	87.7	Confident	0 Å²	0	55 Å²	55	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-71	-43.8	176.7	-71.3	165.4	0	0	0	112	T283 V286 I287 L290 L296 L300 E301 E302 S306 C307 L313 V316	T283-L304 HydrophobicContact CG2-CB 4.15Å; T283-L304 VanDerWaalsContact CG2-O 3.27Å; T283-L304 WeakPolarHBondContact CG2-O 3.39Å; V286-L304 HydrophobicContact CG1-CD1 4.15Å; V286-L304 HydrophobicContact CG1-CD2 3.96Å; I287-L304 HydrophobicContact CD1-CB 4.16Å; I287-L304 HydrophobicContact CG1-CB 4.07Å; I287-L304 HydrophobicContact CG1-CD1 3.85Å; L290-L304 HydrophobicContact CD1-CD1 3.48Å; L290-L304 VanDerWaalsContact CD1-CD1 3.48Å; L296-L304 HydrophobicContact CD1-CD1 4.31Å; L300-L304 HydrophobicContact CD1-CD1 4.27Å; L300-L304 HydrophobicContact CD1-CG 4.36Å; L300-L304 HydrophobicContact CG-CD1 4.05Å; L300-L304 WeakPolarHBondContact O-CB 3.36Å; L300-L304 WeakPolarHBondContact O-CD1 3.44Å; L300-L304 WeakPolarHBondContact O-CG 3.24Å; L300-L304 PolarHBondContact O-N 3Å; E301-L304 PolarHBondContact O-N 3.03Å; E302-L304 VanDerWaalsContact C-N 3.3Å; E302-L304 PolarHBondContact O-N 3.49Å; L304-S306 VanDerWaalsContact C-N 3.28Å; L304-S306 PolarHBondContact O-N 3.21Å; L304-C307 WeakPolarHBondContact O-CB 3.26Å; L304-C307 PolarHBondContact O-N 3.09Å; L304-L313 HydrophobicContact CD2-CD1 3.53Å; L304-V316 HydrophobicContact CD2-CB 4.26Å; L304-V316 HydrophobicContact CD2-CG1 3.67Å; L304-V316 HydrophobicContact CG-CG1 3.98Å
305	R	92.3	Very high	87.4	Confident	54 Å²	54	53.8 Å²	53.8	20%	0.204	29%	0.291	C	S	.	.	H	α-helix	trans	-69.5	-20.4	178.7	-69.6	168.1	173.5	-121.1	4.6	113.9	N214 M215 N216 I287 E301 E302	N214-R305 PolarHBondContact ND2-NH2 3.35Å; N214-R305 VanDerWaalsContact ND2-NH2 3.15Å; N214-R305 PolarHBondContact OD1-NH1 2.7Å; N214-R305 PolarHBondContact OD1-NH2 2.77Å; M215-R305 VanDerWaalsContact CE-O 3.32Å; M215-R305 WeakPolarHBondContact CE-O 3.32Å; N216-R305 HydrophobicContact CB-CB 4.37Å; N216-R305 PolarHBondContact N-O 3.42Å; N216-R305 VanDerWaalsContact OD1-CB 3.3Å; N216-R305 WeakPolarHBondContact OD1-CB 3.48Å; I287-R305 HydrophobicContact CD1-CG 3.88Å; E301-R305 HydrophobicContact CG-CG 4.46Å; E301-R305 WeakPolarHBondContact O-CB 3.17Å; E301-R305 VanDerWaalsContact O-CG 3.28Å; E301-R305 WeakPolarHBondContact O-CG 3.18Å; E301-R305 PolarHBondContact O-N 3.15Å; E301-R305 IonicContact OE1-CZ 3.4Å; E301-R305 IonicContact OE1-NE 2.72Å; E301-R305 PolarHBondContact OE1-NE 3.42Å; E301-R305 IonicContact OE1-NH2 3.27Å; E301-R305 PolarHBondContact OE1-NH2 3.1Å; E302-R305 PolarHBondContact O-N 2.99Å
306	S	90.5	Very high	87.3	Confident	59 Å²	59	53.1 Å²	53.1	41%	0.413	29%	0.287	S	S	.	.	H	α-helix	trans	-89.4	-11.5	176.4	53.7	0	0	0	0	114.1	E302 S303 L304 R308	E302-S306 WeakPolarHBondContact O-CB 3.3Å; E302-S306 PolarHBondContact O-N 2.95Å; E302-S306 PolarHBondContact O-OG 2.75Å; S303-S306 WeakPolarHBondContact CA-OG 3.39Å; S303-S306 PolarHBondContact O-OG 3.23Å; S303-S306 VanDerWaalsContact O-OG 3.05Å; L304-S306 VanDerWaalsContact C-N 3.28Å; L304-S306 PolarHBondContact O-N 3.21Å; S306-R308 PolarHBondContact O-N 3.39Å
307	C	89.8	Confident	87.1	Confident	8 Å²	8	53.4 Å²	53.4	5%	0.054	29%	0.286	C	S	.	.			trans	-57.6	130.8	176.1	-72.5	0	0	0	0	111.8	W217 S303 L304 D312 L313	W217-C307 PolarHBondContact NE1-O 2.86Å; S303-C307 PolarHBondContact O-SG 3.44Å; L304-C307 WeakPolarHBondContact O-CB 3.26Å; L304-C307 PolarHBondContact O-N 3.09Å; C307-D312 HydrophobicContact CB-CB 4.25Å; C307-L313 HydrophobicContact CB-CB 4.3Å
308	R	88.1	Confident	86.8	Confident	146 Å²	146	52.8 Å²	52.8	55%	0.551	28%	0.282	S	S	*	.			trans	-110.9	-7.2	-179.4	-64.5	-175.7	-176.7	-176.3	-1.2	114.2	W217 L279 S306	W217-R308 HydrophobicContact CG-CG 4.48Å; L279-R308 WeakPolarHBondContact CD2-O 2.8Å; S306-R308 PolarHBondContact O-N 3.39Å
309	S	85.9	Confident	86.3	Confident	43 Å²	43	49.1 Å²	49.1	30%	0.301	26%	0.258	S	S	.	.	S	Bend	trans	-137.9	163.1	173.7	75.2	0	0	0	0	112.3	L279 D311 D312 L313	L279-S309 WeakPolarHBondContact CD1-O 3.38Å; S309-D311 VanDerWaalsContact C-N 3.26Å; S309-D311 PolarHBondContact O-N 2.85Å; S309-D312 WeakPolarHBondContact CB-OD2 3.27Å; S309-D312 PolarHBondContact N-OD2 2.86Å; S309-D312 VanDerWaalsContact N-OD2 3.14Å; S309-D312 PolarHBondContact O-N 3.34Å; S309-D312 PolarHBondContact OG-N 2.77Å; S309-D312 VanDerWaalsContact OG-N 3.13Å; S309-D312 PolarHBondContact OG-OD2 2.97Å; S309-L313 PolarHBondContact O-N 2.74Å; S309-L313 VanDerWaalsContact O-N 3.11Å
310	A	87.1	Confident	86.2	Confident	54 Å²	54	45.9 Å²	45.9	45%	0.446	24%	0.241	S	C	.	.	H	α-helix	trans	-65.4	-29.4	174.7	0	0	0	0	0	112.9	D314	A310-D314 WeakPolarHBondContact O-CB 3.28Å; A310-D314 PolarHBondContact O-N 2.72Å
311	D	82.3	Confident	86.1	Confident	45 Å²	45	48.7 Å²	48.7	24%	0.241	25%	0.253	C	S	.	.	H	α-helix	trans	-71.1	-40.1	175.6	-84	-4.9	0	0	0	111.3	S309 D314 H315 T529	S309-D311 VanDerWaalsContact C-N 3.26Å; S309-D311 PolarHBondContact O-N 2.85Å; D311-D314 PolarHBondContact O-N 3.46Å; D311-H315 WeakPolarHBondContact O-CB 3.37Å; D311-H315 PolarHBondContact O-N 3.27Å; D311-T529 PolarHBondContact OD2-OG1 2.91Å
312	D	83.6	Confident	85.3	Confident	46 Å²	46	53.6 Å²	53.6	25%	0.246	27%	0.274	C	S	.	.	H	α-helix	trans	-63.3	-46.2	174	-56.1	-48.8	0	0	0	110.5	C307 S309 D314 H315 V316	C307-D312 HydrophobicContact CB-CB 4.25Å; S309-D312 WeakPolarHBondContact CB-OD2 3.27Å; S309-D312 PolarHBondContact N-OD2 2.86Å; S309-D312 VanDerWaalsContact N-OD2 3.14Å; S309-D312 PolarHBondContact O-N 3.34Å; S309-D312 PolarHBondContact OG-N 2.77Å; S309-D312 VanDerWaalsContact OG-N 3.13Å; S309-D312 PolarHBondContact OG-OD2 2.97Å; D312-D314 VanDerWaalsContact C-N 3.33Å; D312-D314 PolarHBondContact O-N 3.4Å; D312-H315 WeakPolarHBondContact O-CB 3.49Å; D312-H315 PolarHBondContact O-N 3.49Å; D312-V316 WeakPolarHBondContact O-CG2 3.13Å; D312-V316 PolarHBondContact O-N 3.16Å
313	L	89.4	Confident	84	Confident	1 Å²	1	52 Å²	52	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-61.4	-40.7	176.2	178.5	63.5	0	0	0	111.8	L279 K282 L304 C307 S309 H315 Y317	L279-L313 HydrophobicContact CD1-CB 4.05Å; L279-L313 HydrophobicContact CD1-CD2 3.9Å; K282-L313 HydrophobicContact CB-CD2 4.13Å; K282-L313 HydrophobicContact CD-CD2 3.92Å; K282-L313 HydrophobicContact CG-CD2 3.8Å; L304-L313 HydrophobicContact CD2-CD1 3.53Å; C307-L313 HydrophobicContact CB-CB 4.3Å; S309-L313 PolarHBondContact O-N 2.74Å; S309-L313 VanDerWaalsContact O-N 3.11Å; L313-H315 VanDerWaalsContact C-N 3.35Å; L313-Y317 WeakPolarHBondContact O-CB 3.47Å; L313-Y317 PolarHBondContact O-N 2.61Å
314	D	85.1	Confident	83.1	Confident	38 Å²	38	52.2 Å²	52.2	20%	0.203	29%	0.291	C	S	.	.	H	α-helix	trans	-65.7	-38.3	176.2	-161.5	68.7	0	0	0	112	A310 D311 D312 T318 K321 R525	A310-D314 WeakPolarHBondContact O-CB 3.28Å; A310-D314 PolarHBondContact O-N 2.72Å; D311-D314 PolarHBondContact O-N 3.46Å; D312-D314 VanDerWaalsContact C-N 3.33Å; D312-D314 PolarHBondContact O-N 3.4Å; D314-T318 WeakPolarHBondContact O-CB 3.34Å; D314-T318 PolarHBondContact O-N 3.43Å; D314-T318 PolarHBondContact O-OG1 3.26Å; D314-T318 PolarHBondContact OD2-OG1 3.28Å; D314-K321 IonicContact OD1-NZ 3.8Å; D314-K321 PolarHBondContact OD1-NZ 3.26Å; D314-K321 IonicContact OD2-NZ 3.58Å; D314-K321 PolarHBondContact OD2-NZ 3.45Å; D314-R525 IonicContact OD2-NH1 2.92Å; D314-R525 PolarHBondContact OD2-NH1 2.85Å
315	H	81.3	Confident	82.3	Confident	45 Å²	45	61.6 Å²	61.6	21%	0.208	33%	0.332	C	S	.	.	H	α-helix	trans	-62.7	-49.2	176.3	-177.1	87.8	0	0	0	111.6	D311 D312 L313 F522	D311-H315 WeakPolarHBondContact O-CB 3.37Å; D311-H315 PolarHBondContact O-N 3.27Å; D312-H315 WeakPolarHBondContact O-CB 3.49Å; D312-H315 PolarHBondContact O-N 3.49Å; L313-H315 VanDerWaalsContact C-N 3.35Å; H315-F522 HydrophobicContact CB-CD2 4.35Å; H315-F522 HydrophobicContact CB-CE2 4.09Å; H315-F522 AromaticContact ND1-CD2 3.51Å; H315-F522 AromaticContact ND1-CE2 3.92Å; H315-F522 AromaticContact ND1-CG 3.94Å
316	V	83.6	Confident	81.5	Confident	33 Å²	33	64 Å²	64	20%	0.2	35%	0.348	C	S	.	.	H	α-helix	trans	-67.2	-41.1	178.6	177.3	0	0	0	0	111.9	L300 L304 D312 P319	L300-V316 HydrophobicContact CD1-CG1 3.83Å; L304-V316 HydrophobicContact CD2-CB 4.26Å; L304-V316 HydrophobicContact CD2-CG1 3.67Å; L304-V316 HydrophobicContact CG-CG1 3.98Å; D312-V316 WeakPolarHBondContact O-CG2 3.13Å; D312-V316 PolarHBondContact O-N 3.16Å; V316-P319 WeakPolarHBondContact O-CD 3.36Å
317	Y	85.6	Confident	81.1	Confident	42 Å²	42	62.6 Å²	62.6	17%	0.165	34%	0.337	C	S	.	.	H	α-helix	trans	-83.2	-26.8	-174.1	178.5	-131.7	0	0	0	114.7	V286 L290 L313 P319 Y320 K321	V286-Y317 HydrophobicContact CG1-CD1 4.34Å; V286-Y317 HydrophobicContact CG1-CD2 3.44Å; V286-Y317 VanDerWaalsContact CG1-CD2 3.44Å; V286-Y317 HydrophobicContact CG1-CE2 3.83Å; V286-Y317 HydrophobicContact CG1-CG 3.75Å; V286-Y317 HydrophobicContact CG2-CD1 3.9Å; V286-Y317 HydrophobicContact CG2-CD2 4.42Å; V286-Y317 HydrophobicContact CG2-CE1 3.97Å; V286-Y317 HydrophobicContact CG2-CE2 4.49Å; V286-Y317 HydrophobicContact CG2-CG 4.14Å; L290-Y317 HydrophobicContact CD1-CD2 4.4Å; L290-Y317 HydrophobicContact CD2-CD2 4.37Å; L290-Y317 HydrophobicContact CD2-CE2 4.08Å; L290-Y317 HydrophobicContact CG-CE2 4.39Å; L313-Y317 WeakPolarHBondContact O-CB 3.47Å; L313-Y317 PolarHBondContact O-N 2.61Å; Y317-P319 VanDerWaalsContact C-CD 3.4Å; Y317-P319 VanDerWaalsContact C-N 3.35Å; Y317-P319 VanDerWaalsContact O-N 3.15Å; Y317-Y320 PolarHBondContact O-N 3.03Å; Y317-K321 HydrophobicContact CD1-CG 3.98Å; Y317-K321 HydrophobicContact CE1-CG 3.69Å
318	T	82.2	Confident	81.1	Confident	51 Å²	51	65.4 Å²	65.4	31%	0.313	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-50.9	-39.2	-174.9	-76.7	0	0	0	0	115.7	D314 Y320 K321	D314-T318 WeakPolarHBondContact O-CB 3.34Å; D314-T318 PolarHBondContact O-N 3.43Å; D314-T318 PolarHBondContact O-OG1 3.26Å; D314-T318 PolarHBondContact OD2-OG1 3.28Å; T318-Y320 PolarHBondContact O-N 2.94Å; T318-Y320 VanDerWaalsContact O-N 3.08Å; T318-K321 PolarHBondContact O-N 3.08Å; T318-K321 PolarHBondContact OG1-NZ 3.05Å
319	P	78.8	Confident	81	Confident	17 Å²	17	58.6 Å²	58.6	11%	0.11	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-62.6	-9.3	175.1	-25	36.4	0	0	0	116.1	V316 Y317 T327 R330	V316-P319 WeakPolarHBondContact O-CD 3.36Å; Y317-P319 VanDerWaalsContact C-CD 3.4Å; Y317-P319 VanDerWaalsContact C-N 3.35Å; Y317-P319 VanDerWaalsContact O-N 3.15Å; P319-T327 HydrophobicContact CB-CG2 3.86Å; P319-T327 HydrophobicContact CG-CG2 4.37Å; P319-R330 PolarHBondContact O-NH1 3.42Å
320	Y	82.4	Confident	81	Confident	49 Å²	49	59.9 Å²	59.9	19%	0.192	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-118.9	-2.2	-174.2	-53.9	-88.1	0	0	0	113.7	L290 V295 L300 Y317 T318 K322	L290-Y320 VanDerWaalsContact CD2-CB 3.48Å; L290-Y320 HydrophobicContact CD2-CD1 4.16Å; L290-Y320 HydrophobicContact CD2-CG 3.91Å; V295-Y320 HydrophobicContact CB-CD1 4.42Å; V295-Y320 HydrophobicContact CG1-CD1 3.85Å; V295-Y320 HydrophobicContact CG1-CE1 3.86Å; L300-Y320 HydrophobicContact CD1-CE2 3.76Å; L300-Y320 HydrophobicContact CD2-CD1 4.31Å; L300-Y320 HydrophobicContact CD2-CD2 4.39Å; L300-Y320 HydrophobicContact CD2-CE1 3.78Å; L300-Y320 HydrophobicContact CD2-CE2 3.86Å; L300-Y320 HydrophobicContact CG-CE2 4.5Å; Y317-Y320 PolarHBondContact O-N 3.03Å; T318-Y320 PolarHBondContact O-N 2.94Å; T318-Y320 VanDerWaalsContact O-N 3.08Å; Y320-K322 PolarHBondContact O-N 3.48Å
321	K	82.5	Confident	81.1	Confident	69 Å²	69	63.8 Å²	63.8	30%	0.3	33%	0.325	S	S	.	.	S	Bend	trans	-63.1	133.9	176.6	-71.4	173.1	-179.2	162.5	0	111.2	D314 Y317 T318 G323 S324	D314-K321 IonicContact OD1-NZ 3.8Å; D314-K321 PolarHBondContact OD1-NZ 3.26Å; D314-K321 IonicContact OD2-NZ 3.58Å; D314-K321 PolarHBondContact OD2-NZ 3.45Å; Y317-K321 HydrophobicContact CD1-CG 3.98Å; Y317-K321 HydrophobicContact CE1-CG 3.69Å; T318-K321 PolarHBondContact O-N 3.08Å; T318-K321 PolarHBondContact OG1-NZ 3.05Å; K321-G323 PolarHBondContact O-N 2.9Å; K321-S324 WeakPolarHBondContact O-CB 3.3Å; K321-S324 PolarHBondContact O-N 3.15Å
322	K	73.3	Confident	81.4	Confident	152 Å²	152	61.9 Å²	61.9	66%	0.661	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	133.7	177	-60.9	-170.2	178.7	-169.2	0	110.7	D293 Y320 S324	D293-K322 VanDerWaalsContact CG-CE 3.44Å; D293-K322 VanDerWaalsContact CG-NZ 3.34Å; D293-K322 VanDerWaalsContact OD1-CE 3.31Å; D293-K322 WeakPolarHBondContact OD1-CE 3.36Å; D293-K322 IonicContact OD1-NZ 3.83Å; D293-K322 PolarHBondContact OD1-NZ 3.07Å; D293-K322 WeakPolarHBondContact OD2-CE 3.27Å; D293-K322 IonicContact OD2-NZ 3.16Å; D293-K322 PolarHBondContact OD2-NZ 3.49Å; Y320-K322 PolarHBondContact O-N 3.48Å; K322-S324 VanDerWaalsContact C-N 3.29Å; K322-S324 PolarHBondContact O-N 3.07Å
323	G	63.8	Low	81.6	Confident	87 Å²	87	63.2 Å²	63.2	90%	0.897	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-5.5	-173.8	0	0	0	0	0	115.4	K321	K321-G323 PolarHBondContact O-N 2.9Å
324	S	66.1	Low	81.5	Confident	58 Å²	58	67.4 Å²	67.4	41%	0.406	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-68.4	133.8	168.9	-165.6	0	0	0	0	110.1	K321 K322 L326	K321-S324 WeakPolarHBondContact O-CB 3.3Å; K321-S324 PolarHBondContact O-N 3.15Å; K322-S324 VanDerWaalsContact C-N 3.29Å; K322-S324 PolarHBondContact O-N 3.07Å; S324-L326 PolarHBondContact O-N 3.39Å
325	K	74.1	Confident	81.8	Confident	196 Å²	196	68.3 Å²	68.3	85%	0.852	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-63	135.9	170	-69	-172.9	178.1	-174.3	0	108.5	T327	K325-T327 PolarHBondContact O-N 2.92Å
326	L	76.1	Confident	82.2	Confident	104 Å²	104	67.8 Å²	67.8	55%	0.545	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-47.3	125.8	173.3	-81.8	160.4	0	0	0	109.8	S324 R330 R331	S324-L326 PolarHBondContact O-N 3.39Å; L326-R330 HydrophobicContact CD2-CB 4.03Å; L326-R331 HydrophobicContact CB-CG 3.7Å
327	T	83.1	Confident	82.6	Confident	31 Å²	31	66.2 Å²	66.2	19%	0.19	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-60.4	152.4	-178.5	68.8	0	0	0	0	109.7	P319 K325 A329 R330 R331	P319-T327 HydrophobicContact CB-CG2 3.86Å; P319-T327 HydrophobicContact CG-CG2 4.37Å; K325-T327 PolarHBondContact O-N 2.92Å; T327-A329 PolarHBondContact O-N 3.49Å; T327-R330 PolarHBondContact O-N 3.2Å; T327-R330 WeakPolarHBondContact OG1-CG 3.43Å; T327-R330 PolarHBondContact OG1-N 3.05Å; T327-R330 VanDerWaalsContact OG1-N 3.14Å; T327-R331 PolarHBondContact O-N 3.09Å
328	K	88.8	Confident	82.8	Confident	67 Å²	67	68 Å²	68	29%	0.291	37%	0.365	S	S	.	.	H	α-helix	trans	-45.5	-48.3	173.9	-83.2	178.4	152.7	-154.4	0	112	R331 A332 H376	K328-R331 PolarHBondContact O-N 2.85Å; K328-A332 PolarHBondContact O-N 2.79Å; K328-A332 VanDerWaalsContact O-N 3.1Å; K328-H376 HydrophobicContact CB-CB 3.84Å; K328-H376 WeakPolarHBondContact CB-ND1 3.48Å; K328-H376 PolarHBondContact NZ-NE2 3.16Å
329	A	86.5	Confident	83.2	Confident	2 Å²	2	70.7 Å²	70.7	2%	0.017	38%	0.378	C	S	.	.	H	α-helix	trans	-60.6	-48.1	174.5	0	0	0	0	0	113.7	T327 R331 A332 K333 H376 D380	T327-A329 PolarHBondContact O-N 3.49Å; A329-R331 VanDerWaalsContact C-N 3.28Å; A329-R331 PolarHBondContact O-N 2.71Å; A329-A332 PolarHBondContact O-N 3.2Å; A329-K333 WeakPolarHBondContact O-CG 3.39Å; A329-K333 PolarHBondContact O-N 3.09Å; A329-H376 WeakPolarHBondContact CB-O 3.36Å; A329-D380 HydrophobicContact CB-CB 3.43Å; A329-D380 VanDerWaalsContact CB-CB 3.43Å
330	R	85.8	Confident	83.8	Confident	71 Å²	71	69.9 Å²	69.9	27%	0.268	37%	0.373	S	S	.	.	H	α-helix	trans	-63.6	-32.5	179.5	-72.6	-176.8	75.2	-177.6	4.1	112.6	P319 L326 T327 A334	P319-R330 PolarHBondContact O-NH1 3.42Å; L326-R330 HydrophobicContact CD2-CB 4.03Å; T327-R330 PolarHBondContact O-N 3.2Å; T327-R330 WeakPolarHBondContact OG1-CG 3.43Å; T327-R330 PolarHBondContact OG1-N 3.05Å; T327-R330 VanDerWaalsContact OG1-N 3.14Å; R330-A334 WeakPolarHBondContact O-CB 3.34Å; R330-A334 PolarHBondContact O-N 3.18Å; R330-A334 VanDerWaalsContact O-N 3.08Å
331	R	88.3	Confident	84.2	Confident	136 Å²	136	67.6 Å²	67.6	51%	0.513	36%	0.364	S	S	.	.	H	α-helix	trans	-67	-46.1	172.2	-67.3	-168.9	-69.5	153.7	5.7	111.6	L326 T327 K328 A329 K333 A334 L335	L326-R331 HydrophobicContact CB-CG 3.7Å; T327-R331 PolarHBondContact O-N 3.09Å; K328-R331 PolarHBondContact O-N 2.85Å; A329-R331 VanDerWaalsContact C-N 3.28Å; A329-R331 PolarHBondContact O-N 2.71Å; R331-K333 PolarHBondContact O-N 3.31Å; R331-A334 PolarHBondContact O-N 3.48Å; R331-L335 PolarHBondContact O-N 3.29Å
332	A	90	Very high	84.6	Confident	5 Å²	5	66.5 Å²	66.5	4%	0.041	36%	0.363	C	S	.	.	H	α-helix	trans	-63.9	-38.2	175.8	0	0	0	0	0	113.1	K328 A329 L335 G336 L337 G373 I377	K328-A332 PolarHBondContact O-N 2.79Å; K328-A332 VanDerWaalsContact O-N 3.1Å; A329-A332 PolarHBondContact O-N 3.2Å; A332-L335 WeakPolarHBondContact O-CB 3.47Å; A332-L335 PolarHBondContact O-N 2.68Å; A332-L335 VanDerWaalsContact O-N 3.15Å; A332-G336 PolarHBondContact O-N 3.43Å; A332-L337 HydrophobicContact CB-CD1 4.24Å; A332-L337 PolarHBondContact O-N 3.28Å; A332-G373 VanDerWaalsContact CB-O 3.31Å; A332-G373 WeakPolarHBondContact CB-O 3.34Å; A332-I377 HydrophobicContact CB-CD1 3.75Å; A332-I377 HydrophobicContact CB-CG1 3.71Å
333	K	87.6	Confident	85.5	Confident	74 Å²	74	60.4 Å²	60.4	32%	0.322	34%	0.341	S	S	.	.	H	α-helix	trans	-62.3	-41.3	172.8	-71.6	-175.9	168.7	-134.4	0	112.3	A329 R331 L335 G336 E338 I377	A329-K333 WeakPolarHBondContact O-CG 3.39Å; A329-K333 PolarHBondContact O-N 3.09Å; R331-K333 PolarHBondContact O-N 3.31Å; K333-L335 PolarHBondContact O-N 3.4Å; K333-G336 PolarHBondContact O-N 2.96Å; K333-E338 WeakPolarHBondContact CD-OE2 3.46Å; K333-E338 WeakPolarHBondContact CE-OE1 2.81Å; K333-E338 WeakPolarHBondContact CE-OE2 3.42Å; K333-E338 HydrophobicContact CG-CB 4.33Å; K333-E338 WeakPolarHBondContact CG-OE2 3.31Å; K333-E338 IonicContact NZ-OE1 3.69Å; K333-E338 PolarHBondContact NZ-OE1 3.07Å; K333-E338 IonicContact NZ-OE2 3.62Å; K333-E338 PolarHBondContact NZ-OE2 3.45Å; K333-I377 HydrophobicContact CG-CD1 3.96Å; K333-I377 HydrophobicContact CG-CG1 4.08Å
334	A	87.2	Confident	86.8	Confident	89 Å²	89	56.3 Å²	56.3	74%	0.736	30%	0.299	S	S	*	.	H	α-helix	trans	-64.8	-19.6	175.5	0	0	0	0	0	113.6	R330 R331 G336	R330-A334 WeakPolarHBondContact O-CB 3.34Å; R330-A334 PolarHBondContact O-N 3.18Å; R330-A334 VanDerWaalsContact O-N 3.08Å; R331-A334 PolarHBondContact O-N 3.48Å; A334-G336 VanDerWaalsContact C-N 3.34Å
335	L	90.3	Very high	88	Confident	56 Å²	56	54.5 Å²	54.5	29%	0.293	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-2	171.7	-65.8	170.2	0	0	0	113.2	R331 A332 K333 T361 L364	R331-L335 PolarHBondContact O-N 3.29Å; A332-L335 WeakPolarHBondContact O-CB 3.47Å; A332-L335 PolarHBondContact O-N 2.68Å; A332-L335 VanDerWaalsContact O-N 3.15Å; K333-L335 PolarHBondContact O-N 3.4Å; L335-T361 HydrophobicContact CD2-CG2 4.14Å; L335-L364 HydrophobicContact CB-CD1 4.13Å; L335-L364 HydrophobicContact CB-CD2 4.24Å; L335-L364 HydrophobicContact CB-CG 4.16Å; L335-L364 HydrophobicContact CD1-CG 4.31Å; L335-L364 HydrophobicContact CD2-CD1 4.24Å; L335-L364 HydrophobicContact CD2-CG 4.33Å
336	G	90.3	Very high	88.9	Confident	35 Å²	35	48.8 Å²	48.8	36%	0.361	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	7.3	179.3	0	0	0	0	0	115.4	A332 K333 A334 E338 W356	A332-G336 PolarHBondContact O-N 3.43Å; K333-G336 PolarHBondContact O-N 2.96Å; A334-G336 VanDerWaalsContact C-N 3.34Å; G336-E338 PolarHBondContact O-N 3.36Å; G336-E338 VanDerWaalsContact O-N 3.1Å; G336-W356 WeakPolarHBondContact O-CZ3 3.42Å
337	L	92.2	Very high	89.5	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	5.1	-174.6	-66.1	172.1	0	0	0	115	A332 A340 A341 W356 L364 V370 I377	A332-L337 HydrophobicContact CB-CD1 4.24Å; A332-L337 PolarHBondContact O-N 3.28Å; L337-A340 HydrophobicContact CD2-CB 4.49Å; L337-A340 PolarHBondContact O-N 3.43Å; L337-A341 WeakPolarHBondContact O-CB 3.26Å; L337-A341 PolarHBondContact O-N 2.97Å; L337-W356 HydrophobicContact CD2-CB 4.31Å; L337-W356 HydrophobicContact CD2-CE3 4.23Å; L337-L364 HydrophobicContact CD1-CD2 3.83Å; L337-L364 HydrophobicContact CD2-CD2 3.7Å; L337-L364 HydrophobicContact CG-CD2 3.84Å; L337-V370 HydrophobicContact CD2-CG1 3.96Å; L337-I377 HydrophobicContact CB-CD1 3.75Å; L337-I377 WeakPolarHBondContact O-CD1 3.48Å
338	E	89.2	Confident	89.8	Confident	78 Å²	78	43.7 Å²	43.7	36%	0.364	24%	0.239	S	C	.	.	H	α-helix	trans	-70	-40.5	-179.2	-176.2	150.6	-163.1	0	0	112.5	K333 G336 A340 A341 T342	K333-E338 WeakPolarHBondContact CD-OE2 3.46Å; K333-E338 WeakPolarHBondContact CE-OE1 2.81Å; K333-E338 WeakPolarHBondContact CE-OE2 3.42Å; K333-E338 HydrophobicContact CG-CB 4.33Å; K333-E338 WeakPolarHBondContact CG-OE2 3.31Å; K333-E338 IonicContact NZ-OE1 3.69Å; K333-E338 PolarHBondContact NZ-OE1 3.07Å; K333-E338 IonicContact NZ-OE2 3.62Å; K333-E338 PolarHBondContact NZ-OE2 3.45Å; G336-E338 PolarHBondContact O-N 3.36Å; G336-E338 VanDerWaalsContact O-N 3.1Å; E338-A340 VanDerWaalsContact C-N 3.34Å; E338-A341 PolarHBondContact O-N 3.23Å; E338-T342 WeakPolarHBondContact O-CG2 3.35Å; E338-T342 PolarHBondContact O-N 3.18Å; E338-T342 PolarHBondContact O-OG1 3.07Å
339	D	90.4	Very high	89.6	Confident	109 Å²	109	45.3 Å²	45.3	58%	0.583	25%	0.248	S	C	*	.	H	α-helix	trans	-65.5	-38.4	174.7	-65.1	-28.7	0	0	0	111.2	T342 A343 W356	D339-T342 WeakPolarHBondContact CA-OG1 3.28Å; D339-T342 PolarHBondContact O-OG1 3.17Å; D339-A343 WeakPolarHBondContact O-CB 3.31Å; D339-A343 PolarHBondContact O-N 2.82Å; D339-W356 HydrophobicContact CB-CH2 3.72Å; D339-W356 HydrophobicContact CB-CZ2 4.45Å; D339-W356 HydrophobicContact CB-CZ3 4.5Å
340	A	91.3	Very high	89.5	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-63.4	-44.5	174	0	0	0	0	0	112.1	L337 E338 A343 L344 L351 W356 M374	L337-A340 HydrophobicContact CD2-CB 4.49Å; L337-A340 PolarHBondContact O-N 3.43Å; E338-A340 VanDerWaalsContact C-N 3.34Å; A340-A343 PolarHBondContact O-N 3.13Å; A340-L344 PolarHBondContact O-N 2.93Å; A340-L344 VanDerWaalsContact O-N 3.09Å; A340-L351 HydrophobicContact CB-CD1 4.29Å; A340-L351 WeakPolarHBondContact O-CD2 3.31Å; A340-W356 HydrophobicContact CB-CD2 3.82Å; A340-W356 HydrophobicContact CB-CE3 4.14Å; A340-W356 HydrophobicContact CB-CG 4.34Å; A340-W356 HydrophobicContact CB-CH2 4.28Å; A340-W356 HydrophobicContact CB-CZ2 3.92Å; A340-W356 HydrophobicContact CB-CZ3 4.36Å; A340-M374 HydrophobicContact CB-CE 4.4Å; A340-M374 HydrophobicContact CB-CG 4.04Å; A340-M374 HydrophobicContact CB-SD 3.87Å
341	A	91.9	Very high	89.6	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-66.6	-39.4	178.5	0	0	0	0	0	112.6	L337 E338 L344 I377 L378	L337-A341 WeakPolarHBondContact O-CB 3.26Å; L337-A341 PolarHBondContact O-N 2.97Å; E338-A341 PolarHBondContact O-N 3.23Å; A341-L344 PolarHBondContact O-N 3.26Å; A341-I377 HydrophobicContact CB-CB 4.06Å; A341-I377 HydrophobicContact CB-CD1 4.46Å; A341-I377 HydrophobicContact CB-CG2 3.74Å; A341-L378 HydrophobicContact CB-CD2 4.32Å; A341-L378 HydrophobicContact CB-CG 4.24Å
342	T	90.9	Very high	89.6	Confident	46 Å²	46	44.7 Å²	44.7	28%	0.282	27%	0.266	S	S	.	.	H	α-helix	trans	-75.6	-32.7	176.8	51.9	0	0	0	0	112.7	E338 D339 L344 L345 N346	E338-T342 WeakPolarHBondContact O-CG2 3.35Å; E338-T342 PolarHBondContact O-N 3.18Å; E338-T342 PolarHBondContact O-OG1 3.07Å; D339-T342 WeakPolarHBondContact CA-OG1 3.28Å; D339-T342 PolarHBondContact O-OG1 3.17Å; T342-L344 VanDerWaalsContact C-N 3.33Å; T342-L345 PolarHBondContact O-N 3.38Å; T342-N346 PolarHBondContact O-N 2.97Å; T342-N346 VanDerWaalsContact O-N 3.09Å; T342-N346 PolarHBondContact O-ND2 3.08Å
343	A	91.6	Very high	89.4	Confident	25 Å²	25	45.3 Å²	45.3	21%	0.207	27%	0.268	C	S	.	.	H	α-helix	trans	-61.8	-38.5	170.5	0	0	0	0	0	111.8	D339 A340 L345 N346 A347 P348 L351	D339-A343 WeakPolarHBondContact O-CB 3.31Å; D339-A343 PolarHBondContact O-N 2.82Å; A340-A343 PolarHBondContact O-N 3.13Å; A343-L345 PolarHBondContact O-N 2.94Å; A343-N346 PolarHBondContact O-N 3.41Å; A343-A347 CarbonylContact O-C 3.06Å; A343-A347 WeakPolarHBondContact O-CA 3.47Å; A343-A347 PolarHBondContact O-N 3.18Å; A343-P348 VanDerWaalsContact O-N 3.12Å; A343-L351 HydrophobicContact CB-CD1 4.25Å; A343-L351 HydrophobicContact CB-CD2 4.46Å
344	L	92.1	Very high	89.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.2	-35.1	176.3	-173.2	151.6	0	0	0	112.8	A340 A341 T342 P348 L351 M374 L378 L503 I506 L507	A340-L344 PolarHBondContact O-N 2.93Å; A340-L344 VanDerWaalsContact O-N 3.09Å; A341-L344 PolarHBondContact O-N 3.26Å; T342-L344 VanDerWaalsContact C-N 3.33Å; L344-P348 WeakPolarHBondContact O-CB 3.44Å; L344-P348 WeakPolarHBondContact O-CD 3.4Å; L344-L351 HydrophobicContact CB-CD2 3.77Å; L344-L351 HydrophobicContact CG-CD2 4.48Å; L344-M374 HydrophobicContact CB-CE 4.22Å; L344-M374 HydrophobicContact CD1-CE 3.56Å; L344-L378 HydrophobicContact CD1-CD1 4.26Å; L344-L378 HydrophobicContact CD2-CD1 4.09Å; L344-L503 HydrophobicContact CD1-CB 4.25Å; L344-L503 HydrophobicContact CD1-CD2 4.35Å; L344-L503 HydrophobicContact CG-CB 4.49Å; L344-I506 HydrophobicContact CD1-CB 4.08Å; L344-I506 HydrophobicContact CD1-CG2 3.72Å; L344-L507 HydrophobicContact CD2-CB 4.27Å
345	L	90.8	Very high	89.4	Confident	21 Å²	21	45.1 Å²	45.1	11%	0.11	28%	0.276	C	S	.	.	H	α-helix	trans	-82.9	-37	179.1	-62.8	175.6	0	0	0	112.8	T342 A343 L378 M381 W493 P495 K496 L507	T342-L345 PolarHBondContact O-N 3.38Å; A343-L345 PolarHBondContact O-N 2.94Å; L345-L378 HydrophobicContact CD1-CD2 3.8Å; L345-L378 HydrophobicContact CD2-CD2 4.22Å; L345-L378 HydrophobicContact CG-CD2 3.95Å; L345-M381 HydrophobicContact CD1-CE 4.26Å; L345-W493 HydrophobicContact CD1-CE3 3.93Å; L345-W493 HydrophobicContact CD1-CZ3 3.88Å; L345-W493 HydrophobicContact CD2-CE3 4.31Å; L345-P495 WeakPolarHBondContact O-CA 3.21Å; L345-K496 PolarHBondContact O-N 2.91Å; L345-L507 HydrophobicContact CD2-CD1 4.34Å
346	N	91.9	Very high	89.3	Confident	76 Å²	76	46 Å²	46	41%	0.406	28%	0.276	S	S	.	.	H	α-helix	trans	-95.4	-40.2	-171.8	-70.6	-66	0	0	0	114.6	T342 A343 K496	T342-N346 PolarHBondContact O-N 2.97Å; T342-N346 VanDerWaalsContact O-N 3.09Å; T342-N346 PolarHBondContact O-ND2 3.08Å; A343-N346 PolarHBondContact O-N 3.41Å; N346-K496 WeakPolarHBondContact OD1-CE 3.08Å; N346-K496 PolarHBondContact OD1-NZ 2.94Å
347	A	89.5	Confident	89.3	Confident	26 Å²	26	46.1 Å²	46.1	22%	0.215	27%	0.269	C	S	.	.			trans	-147.6	56.9	-174.6	0	0	0	0	0	111.8	A343 Q349 T350	A343-A347 CarbonylContact O-C 3.06Å; A343-A347 WeakPolarHBondContact O-CA 3.47Å; A343-A347 PolarHBondContact O-N 3.18Å; A347-Q349 VanDerWaalsContact C-OE1 3.29Å; A347-Q349 PolarHBondContact O-N 3.22Å; A347-T350 PolarHBondContact O-N 3.38Å; A347-T350 PolarHBondContact O-OG1 2.93Å
348	P	88.6	Confident	89.1	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.006	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-54.5	-26.1	-179.7	22.6	-37.1	0	0	0	114.2	A343 L344 T350 L351 P495 T497 A499 L503	A343-P348 VanDerWaalsContact O-N 3.12Å; L344-P348 WeakPolarHBondContact O-CB 3.44Å; L344-P348 WeakPolarHBondContact O-CD 3.4Å; P348-T350 VanDerWaalsContact C-N 3.26Å; P348-T350 PolarHBondContact O-N 3.25Å; P348-L351 PolarHBondContact O-N 3.19Å; P348-P495 HydrophobicContact CG-CB 3.92Å; P348-T497 VanDerWaalsContact CD-OG1 3.22Å; P348-T497 WeakPolarHBondContact CD-OG1 3.15Å; P348-T497 WeakPolarHBondContact CG-OG1 3.46Å; P348-A499 HydrophobicContact CB-CB 3.72Å; P348-A499 HydrophobicContact CG-CB 3.92Å; P348-L503 HydrophobicContact CB-CD1 3.98Å; P348-L503 VanDerWaalsContact O-CD1 3.26Å; P348-L503 WeakPolarHBondContact O-CD1 3.3Å
349	Q	85.3	Confident	88.9	Confident	102 Å²	102	53.5 Å²	53.5	48%	0.477	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-65.5	-24	178	74.4	-74.1	-7.2	0	0	114.2	A347 T497	A347-Q349 VanDerWaalsContact C-OE1 3.29Å; A347-Q349 PolarHBondContact O-N 3.22Å; Q349-T497 PolarHBondContact OE1-OG1 3.01Å
350	T	84.3	Confident	88.4	Confident	101 Å²	101	52.1 Å²	52.1	62%	0.62	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-95.5	-4.3	177	55.7	0	0	0	0	113	A347 P348	A347-T350 PolarHBondContact O-N 3.38Å; A347-T350 PolarHBondContact O-OG1 2.93Å; P348-T350 VanDerWaalsContact C-N 3.26Å; P348-T350 PolarHBondContact O-N 3.25Å
351	L	88	Confident	88.2	Confident	13 Å²	13	54.8 Å²	54.8	7%	0.068	34%	0.34	C	S	.	.			trans	-87.4	118.3	-175.6	-177.1	59.7	0	0	0	111.4	A340 A343 L344 P348 M374 L503	A340-L351 HydrophobicContact CB-CD1 4.29Å; A340-L351 WeakPolarHBondContact O-CD2 3.31Å; A343-L351 HydrophobicContact CB-CD1 4.25Å; A343-L351 HydrophobicContact CB-CD2 4.46Å; L344-L351 HydrophobicContact CB-CD2 3.77Å; L344-L351 HydrophobicContact CG-CD2 4.48Å; P348-L351 PolarHBondContact O-N 3.19Å; L351-M374 HydrophobicContact CD2-CE 3.75Å; L351-L503 HydrophobicContact CB-CD1 4.25Å; L351-L503 HydrophobicContact CD2-CD1 4.43Å; L351-L503 HydrophobicContact CD2-CD2 4.02Å; L351-L503 HydrophobicContact CG-CD2 4.38Å
352	V	87.9	Confident	87.8	Confident	81 Å²	81	63.2 Å²	63.2	49%	0.491	38%	0.379	S	S	.	.			trans	-115.7	111.2	176.1	-175.8	0	0	0	0	108.7	S354 A355	V352-S354 VanDerWaalsContact C-N 3.33Å; V352-S354 WeakPolarHBondContact CG1-OG 3.48Å; V352-S354 PolarHBondContact O-N 3.36Å; V352-A355 WeakPolarHBondContact O-CB 3.31Å; V352-A355 PolarHBondContact O-N 2.9Å
353	L	87	Confident	87.4	Confident	18 Å²	18	62 Å²	62	9%	0.094	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-62.9	-36	-173.3	-62.5	175	0	0	0	113.3	A355 W356 V367 V370 M374 L503 I506	L353-A355 PolarHBondContact O-N 3.26Å; L353-W356 PolarHBondContact O-N 3.39Å; L353-W356 VanDerWaalsContact O-N 3.09Å; L353-V367 HydrophobicContact CB-CG1 3.9Å; L353-V367 HydrophobicContact CD1-CG1 3.94Å; L353-V370 HydrophobicContact CD2-CG1 4.47Å; L353-M374 HydrophobicContact CD2-CE 3.92Å; L353-M374 HydrophobicContact CD2-SD 3.59Å; L353-M374 VanDerWaalsContact CD2-SD 3.59Å; L353-L503 HydrophobicContact CD1-CD2 4.08Å; L353-L503 HydrophobicContact CD2-CD2 3.81Å; L353-L503 HydrophobicContact CG-CD2 3.91Å; L353-I506 HydrophobicContact CD1-CD1 3.87Å; L353-I506 HydrophobicContact CD2-CD1 4.01Å
354	S	86.2	Confident	87.3	Confident	79 Å²	79	61 Å²	61	55%	0.552	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-63	-24.2	179.7	53.6	0	0	0	0	113.7	V352 W356 V357	V352-S354 VanDerWaalsContact C-N 3.33Å; V352-S354 WeakPolarHBondContact CG1-OG 3.48Å; V352-S354 PolarHBondContact O-N 3.36Å; S354-W356 PolarHBondContact O-N 3.37Å; S354-V357 PolarHBondContact O-N 3.3Å
355	A	88.3	Confident	87.1	Confident	81 Å²	81	63.5 Å²	63.5	67%	0.669	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-68.7	-15.5	176.1	0	0	0	0	0	113.6	V352 L353	V352-A355 WeakPolarHBondContact O-CB 3.31Å; V352-A355 PolarHBondContact O-N 2.9Å; L353-A355 PolarHBondContact O-N 3.26Å
356	W	87.8	Confident	87.1	Confident	75 Å²	75	64.6 Å²	64.6	28%	0.284	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-98.2	-7.6	179.7	-61.9	86	0	0	0	113.3	G336 L337 D339 A340 L353 S354 V370	G336-W356 WeakPolarHBondContact O-CZ3 3.42Å; L337-W356 HydrophobicContact CD2-CB 4.31Å; L337-W356 HydrophobicContact CD2-CE3 4.23Å; D339-W356 HydrophobicContact CB-CH2 3.72Å; D339-W356 HydrophobicContact CB-CZ2 4.45Å; D339-W356 HydrophobicContact CB-CZ3 4.5Å; A340-W356 HydrophobicContact CB-CD2 3.82Å; A340-W356 HydrophobicContact CB-CE3 4.14Å; A340-W356 HydrophobicContact CB-CG 4.34Å; A340-W356 HydrophobicContact CB-CH2 4.28Å; A340-W356 HydrophobicContact CB-CZ2 3.92Å; A340-W356 HydrophobicContact CB-CZ3 4.36Å; L353-W356 PolarHBondContact O-N 3.39Å; L353-W356 VanDerWaalsContact O-N 3.09Å; S354-W356 PolarHBondContact O-N 3.37Å; W356-V370 HydrophobicContact CB-CG1 3.77Å; W356-V370 HydrophobicContact CB-CG2 4.14Å
357	V	90.1	Very high	87.1	Confident	37 Å²	37	63.5 Å²	63.5	22%	0.224	39%	0.389	C	S	.	.			trans	-74.3	127.2	180	178.8	0	0	0	0	109.7	S354 P359 L364 S365 V367 V370	S354-V357 PolarHBondContact O-N 3.3Å; V357-P359 HydrophobicContact CG1-CG 4.47Å; V357-L364 CarbonylContact C-O 3.49Å; V357-L364 WeakPolarHBondContact CA-O 3.38Å; V357-L364 WeakPolarHBondContact CG1-O 3.43Å; V357-S365 WeakPolarHBondContact CG1-O 3.44Å; V357-V367 HydrophobicContact CG2-CG2 3.8Å; V357-V370 HydrophobicContact CG2-CG2 4Å
358	K	88	Confident	87.2	Confident	120 Å²	120	68.4 Å²	68.4	52%	0.522	41%	0.408	S	S	.	.			trans	-124.1	92.2	175.5	-67.2	-176.4	-174.8	169.4	0	108.7	G360 T361 L364	K358-G360 PolarHBondContact O-N 2.89Å; K358-T361 WeakPolarHBondContact O-CB 3.44Å; K358-T361 PolarHBondContact O-N 3.18Å; K358-L364 HydrophobicContact CB-CB 4.1Å; K358-L364 HydrophobicContact CB-CD1 4.26Å; K358-L364 HydrophobicContact CD-CD1 3.91Å; K358-L364 HydrophobicContact CG-CD1 4.27Å; K358-L364 PolarHBondContact N-O 3.04Å
359	P	84.6	Confident	87.3	Confident	112 Å²	112	71.4 Å²	71.4	73%	0.727	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	134.2	-179.8	-27.1	35.9	0	0	0	111.6	V357 T361	V357-P359 HydrophobicContact CG1-CG 4.47Å; P359-T361 VanDerWaalsContact C-N 3.34Å
360	G	80.4	Confident	87.6	Confident	81 Å²	81	66.5 Å²	66.5	84%	0.835	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	-3.3	-176.6	0	0	0	0	0	116	K358	K358-G360 PolarHBondContact O-N 2.89Å
361	T	86.5	Confident	88	Confident	56 Å²	56	62.3 Å²	62.3	34%	0.344	37%	0.374	S	S	.	.	S	Bend	trans	-97.5	118.3	170.3	-55.2	0	0	0	0	110.4	L335 K358 P359 G363 L364 S365	L335-T361 HydrophobicContact CD2-CG2 4.14Å; K358-T361 WeakPolarHBondContact O-CB 3.44Å; K358-T361 PolarHBondContact O-N 3.18Å; P359-T361 VanDerWaalsContact C-N 3.34Å; T361-G363 PolarHBondContact O-N 2.94Å; T361-L364 HydrophobicContact CG2-CB 4.31Å; T361-L364 HydrophobicContact CG2-CD1 4.12Å; T361-L364 HydrophobicContact CG2-CG 4.43Å; T361-L364 CarbonylContact O-C 3.44Å; T361-L364 PolarHBondContact O-N 2.92Å; T361-S365 PolarHBondContact O-N 3.39Å; T361-S365 VanDerWaalsContact O-N 3.13Å
362	E	83.5	Confident	88.3	Confident	176 Å²	176	64.1 Å²	64.1	82%	0.822	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	122.4	177.9	-169.9	-171.2	158.8	0	0	110.9
363	G	82.8	Confident	88.5	Confident	21 Å²	21	60.6 Å²	60.6	22%	0.216	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.4	0.9	-175.8	0	0	0	0	0	115.2	T361 E369	T361-G363 PolarHBondContact O-N 2.94Å; G363-E369 VanDerWaalsContact CA-OE2 3.27Å; G363-E369 WeakPolarHBondContact CA-OE2 3.48Å; G363-E369 PolarHBondContact N-OE2 3.46Å
364	L	89.5	Confident	88.9	Confident	5 Å²	5	59.8 Å²	59.8	3%	0.026	36%	0.362	C	S	.	.	S	Bend	trans	-134.5	10.1	170.1	-64.3	177.8	0	0	0	112.2	L335 L337 V357 K358 T361 C366 E369 V370	L335-L364 HydrophobicContact CB-CD1 4.13Å; L335-L364 HydrophobicContact CB-CD2 4.24Å; L335-L364 HydrophobicContact CB-CG 4.16Å; L335-L364 HydrophobicContact CD1-CG 4.31Å; L335-L364 HydrophobicContact CD2-CD1 4.24Å; L335-L364 HydrophobicContact CD2-CG 4.33Å; L337-L364 HydrophobicContact CD1-CD2 3.83Å; L337-L364 HydrophobicContact CD2-CD2 3.7Å; L337-L364 HydrophobicContact CG-CD2 3.84Å; V357-L364 CarbonylContact C-O 3.49Å; V357-L364 WeakPolarHBondContact CA-O 3.38Å; V357-L364 WeakPolarHBondContact CG1-O 3.43Å; K358-L364 HydrophobicContact CB-CB 4.1Å; K358-L364 HydrophobicContact CB-CD1 4.26Å; K358-L364 HydrophobicContact CD-CD1 3.91Å; K358-L364 HydrophobicContact CG-CD1 4.27Å; K358-L364 PolarHBondContact N-O 3.04Å; T361-L364 HydrophobicContact CG2-CB 4.31Å; T361-L364 HydrophobicContact CG2-CD1 4.12Å; T361-L364 HydrophobicContact CG2-CG 4.43Å; T361-L364 CarbonylContact O-C 3.44Å; T361-L364 PolarHBondContact O-N 2.92Å; L364-C366 VanDerWaalsContact C-N 3.33Å; L364-C366 PolarHBondContact O-N 3.42Å; L364-E369 PolarHBondContact N-OE2 3.11Å; L364-V370 HydrophobicContact CD2-CG2 3.98Å
365	S	87.3	Confident	89.3	Confident	52 Å²	52	57.3 Å²	57.3	36%	0.364	34%	0.342	S	S	.	.	S	Bend	trans	-74	-23.9	-167.1	67.9	0	0	0	0	113.7	V357 T361 E369	V357-S365 WeakPolarHBondContact CG1-O 3.44Å; T361-S365 PolarHBondContact O-N 3.39Å; T361-S365 VanDerWaalsContact O-N 3.13Å; S365-E369 WeakPolarHBondContact CB-OE2 3.5Å; S365-E369 PolarHBondContact N-OE2 2.97Å; S365-E369 PolarHBondContact OG-OE2 3.37Å
366	C	92	Very high	89.6	Confident	43 Å²	43	55.5 Å²	55.5	29%	0.291	32%	0.319	S	S	.	.	S	Bend	trans	-143.5	172.1	176	69.8	0	0	0	0	111.8	L364 E368 E369 V370	L364-C366 VanDerWaalsContact C-N 3.33Å; L364-C366 PolarHBondContact O-N 3.42Å; C366-E368 VanDerWaalsContact C-N 3.26Å; C366-E368 VanDerWaalsContact CB-OE2 3.3Å; C366-E368 WeakPolarHBondContact CB-OE2 3.45Å; C366-E368 PolarHBondContact O-N 3.2Å; C366-E368 PolarHBondContact SG-OE2 3.46Å; C366-E369 PolarHBondContact O-N 2.93Å; C366-V370 PolarHBondContact O-N 2.92Å
367	V	91.4	Very high	89.8	Confident	54 Å²	54	52 Å²	52	33%	0.327	31%	0.306	S	S	.	.	H	α-helix	trans	-64	-33.8	-178.5	175.2	0	0	0	0	111.3	L353 V357 V370 A371	L353-V367 HydrophobicContact CB-CG1 3.9Å; L353-V367 HydrophobicContact CD1-CG1 3.94Å; V357-V367 HydrophobicContact CG2-CG2 3.8Å; V367-V370 PolarHBondContact O-N 2.89Å; V367-A371 VanDerWaalsContact O-CB 3.28Å; V367-A371 WeakPolarHBondContact O-CB 3.46Å; V367-A371 PolarHBondContact O-N 3.36Å
368	E	91.3	Very high	90	Very high	128 Å²	128	50.2 Å²	50.2	60%	0.598	30%	0.295	S	S	*	.	H	α-helix	trans	-68.1	-36.9	179.2	-59.1	73.3	-163.7	0	0	111.9	C366 T372	C366-E368 VanDerWaalsContact C-N 3.26Å; C366-E368 VanDerWaalsContact CB-OE2 3.3Å; C366-E368 WeakPolarHBondContact CB-OE2 3.45Å; C366-E368 PolarHBondContact O-N 3.2Å; C366-E368 PolarHBondContact SG-OE2 3.46Å; E368-T372 VanDerWaalsContact O-CB 3.24Å; E368-T372 WeakPolarHBondContact O-CB 3.45Å; E368-T372 PolarHBondContact O-N 3.14Å; E368-T372 PolarHBondContact O-OG1 3.13Å
369	E	91.4	Very high	90.3	Very high	64 Å²	64	44.5 Å²	44.5	30%	0.299	27%	0.27	S	S	.	.	H	α-helix	trans	-68.9	-44.2	173.9	-76.6	-168.3	154.2	0	0	111.6	G363 L364 S365 C366 A371 T372 G373	G363-E369 VanDerWaalsContact CA-OE2 3.27Å; G363-E369 WeakPolarHBondContact CA-OE2 3.48Å; G363-E369 PolarHBondContact N-OE2 3.46Å; L364-E369 PolarHBondContact N-OE2 3.11Å; S365-E369 WeakPolarHBondContact CB-OE2 3.5Å; S365-E369 PolarHBondContact N-OE2 2.97Å; S365-E369 PolarHBondContact OG-OE2 3.37Å; C366-E369 PolarHBondContact O-N 2.93Å; E369-A371 PolarHBondContact O-N 2.77Å; E369-T372 PolarHBondContact O-N 2.95Å; E369-G373 PolarHBondContact O-N 2.9Å
370	V	92	Very high	90.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-56.6	-50.4	173.3	167.8	0	0	0	0	110.5	L337 L353 W356 V357 L364 C366 V367 G373 M374	L337-V370 HydrophobicContact CD2-CG1 3.96Å; L353-V370 HydrophobicContact CD2-CG1 4.47Å; W356-V370 HydrophobicContact CB-CG1 3.77Å; W356-V370 HydrophobicContact CB-CG2 4.14Å; V357-V370 HydrophobicContact CG2-CG2 4Å; L364-V370 HydrophobicContact CD2-CG2 3.98Å; C366-V370 PolarHBondContact O-N 2.92Å; V367-V370 PolarHBondContact O-N 2.89Å; V370-G373 PolarHBondContact O-N 3.43Å; V370-M374 HydrophobicContact CG1-SD 4.05Å; V370-M374 WeakPolarHBondContact O-CG 3.48Å; V370-M374 PolarHBondContact O-N 2.89Å
371	A	92.7	Very high	91.1	Very high	13 Å²	13	39 Å²	39	11%	0.107	21%	0.214	C	C	.	.	H	α-helix	trans	-58.4	-49.3	177	0	0	0	0	0	111.4	V367 E369 G373 M374 E375 I506	V367-A371 VanDerWaalsContact O-CB 3.28Å; V367-A371 WeakPolarHBondContact O-CB 3.46Å; V367-A371 PolarHBondContact O-N 3.36Å; E369-A371 PolarHBondContact O-N 2.77Å; A371-G373 VanDerWaalsContact C-N 3.28Å; A371-G373 PolarHBondContact O-N 2.65Å; A371-M374 WeakPolarHBondContact O-CB 3.29Å; A371-M374 PolarHBondContact O-N 2.88Å; A371-M374 VanDerWaalsContact O-N 3.16Å; A371-E375 WeakPolarHBondContact O-CG 3.45Å; A371-E375 PolarHBondContact O-N 3.08Å; A371-I506 HydrophobicContact CB-CD1 3.69Å; A371-I506 HydrophobicContact CB-CG1 3.95Å
372	T	94.1	Very high	91.4	Very high	50 Å²	50	36.3 Å²	36.3	31%	0.307	20%	0.198	S	C	.	.	H	α-helix	trans	-59.7	-37.2	177	-61.3	0	0	0	0	112.2	E368 E369 H376	E368-T372 VanDerWaalsContact O-CB 3.24Å; E368-T372 WeakPolarHBondContact O-CB 3.45Å; E368-T372 PolarHBondContact O-N 3.14Å; E368-T372 PolarHBondContact O-OG1 3.13Å; E369-T372 PolarHBondContact O-N 2.95Å; T372-H376 WeakPolarHBondContact CG2-CE1 3.27Å; T372-H376 WeakPolarHBondContact CG2-NE2 3.38Å; T372-H376 PolarHBondContact O-CD2 2.61Å; T372-H376 VanDerWaalsContact O-CG 3.24Å; T372-H376 PolarHBondContact O-N 3.44Å; T372-H376 VanDerWaalsContact O-N 3.1Å; T372-H376 PolarHBondContact O-ND1 2.91Å
373	G	92.6	Very high	91.7	Very high	8 Å²	8	28 Å²	28	8%	0.082	16%	0.16	C	C	.	.	H	α-helix	trans	-66	-45.2	174.6	0	0	0	0	0	112.3	A332 E369 V370 A371 H376 I377	A332-G373 VanDerWaalsContact CB-O 3.31Å; A332-G373 WeakPolarHBondContact CB-O 3.34Å; E369-G373 PolarHBondContact O-N 2.9Å; V370-G373 PolarHBondContact O-N 3.43Å; A371-G373 VanDerWaalsContact C-N 3.28Å; A371-G373 PolarHBondContact O-N 2.65Å; G373-H376 PolarHBondContact O-N 2.98Å; G373-I377 WeakPolarHBondContact O-CG1 3.37Å; G373-I377 PolarHBondContact O-N 3.33Å; G373-I377 VanDerWaalsContact O-N 3.16Å
374	M	94.6	Very high	91.8	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.6	-43.6	173.5	-68.6	166.8	56.8	0	0	112	A340 L344 L351 L353 V370 A371 H376 I377 L378 I506	A340-M374 HydrophobicContact CB-CE 4.4Å; A340-M374 HydrophobicContact CB-CG 4.04Å; A340-M374 HydrophobicContact CB-SD 3.87Å; L344-M374 HydrophobicContact CB-CE 4.22Å; L344-M374 HydrophobicContact CD1-CE 3.56Å; L351-M374 HydrophobicContact CD2-CE 3.75Å; L353-M374 HydrophobicContact CD2-CE 3.92Å; L353-M374 HydrophobicContact CD2-SD 3.59Å; L353-M374 VanDerWaalsContact CD2-SD 3.59Å; V370-M374 HydrophobicContact CG1-SD 4.05Å; V370-M374 WeakPolarHBondContact O-CG 3.48Å; V370-M374 PolarHBondContact O-N 2.89Å; A371-M374 WeakPolarHBondContact O-CB 3.29Å; A371-M374 PolarHBondContact O-N 2.88Å; A371-M374 VanDerWaalsContact O-N 3.16Å; M374-H376 VanDerWaalsContact C-N 3.28Å; M374-H376 PolarHBondContact O-N 3.38Å; M374-I377 PolarHBondContact O-N 3.31Å; M374-L378 WeakPolarHBondContact O-CG 3.4Å; M374-L378 PolarHBondContact O-N 3.38Å; M374-I506 HydrophobicContact CB-CG2 4.23Å; M374-I506 HydrophobicContact CE-CD1 4.25Å; M374-I506 HydrophobicContact CE-CG2 4.42Å
375	E	95.1	Very high	91.6	Very high	27 Å²	27	31.1 Å²	31.1	13%	0.126	17%	0.168	C	C	.	.	H	α-helix	trans	-54.7	-44.9	174.5	-73.3	178.5	-174	0	0	111.3	A371 I377 A379 I506 N509 A510	A371-E375 WeakPolarHBondContact O-CG 3.45Å; A371-E375 PolarHBondContact O-N 3.08Å; E375-I377 PolarHBondContact O-N 2.61Å; E375-A379 WeakPolarHBondContact O-CB 3.19Å; E375-A379 PolarHBondContact O-N 2.89Å; E375-I506 HydrophobicContact CG-CB 4.48Å; E375-I506 HydrophobicContact CG-CG2 3.91Å; E375-N509 HydrophobicContact CG-CB 3.99Å; E375-N509 WeakPolarHBondContact OE1-CB 3.32Å; E375-N509 PolarHBondContact OE1-ND2 3.2Å; E375-A510 HydrophobicContact CB-CB 4.42Å
376	H	94.4	Very high	91.4	Very high	43 Å²	43	33.3 Å²	33.3	20%	0.199	18%	0.181	C	C	.	.	H	α-helix	trans	-67.5	-33.6	-179.9	-66.9	164.2	0	0	0	113.2	K328 A329 T372 G373 M374 D380 D513	K328-H376 HydrophobicContact CB-CB 3.84Å; K328-H376 WeakPolarHBondContact CB-ND1 3.48Å; K328-H376 PolarHBondContact NZ-NE2 3.16Å; A329-H376 WeakPolarHBondContact CB-O 3.36Å; T372-H376 WeakPolarHBondContact CG2-CE1 3.27Å; T372-H376 WeakPolarHBondContact CG2-NE2 3.38Å; T372-H376 PolarHBondContact O-CD2 2.61Å; T372-H376 VanDerWaalsContact O-CG 3.24Å; T372-H376 PolarHBondContact O-N 3.44Å; T372-H376 VanDerWaalsContact O-N 3.1Å; T372-H376 PolarHBondContact O-ND1 2.91Å; G373-H376 PolarHBondContact O-N 2.98Å; M374-H376 VanDerWaalsContact C-N 3.28Å; M374-H376 PolarHBondContact O-N 3.38Å; H376-D380 PolarHBondContact O-N 3.08Å; H376-D513 IonicContact CD2-OD2 3.63Å
377	I	92.4	Very high	91.3	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-68.9	-53.3	174.8	-65.6	173.3	0	0	0	109.8	A332 K333 L337 A341 G373 M374 E375 A379 D380 M381	A332-I377 HydrophobicContact CB-CD1 3.75Å; A332-I377 HydrophobicContact CB-CG1 3.71Å; K333-I377 HydrophobicContact CG-CD1 3.96Å; K333-I377 HydrophobicContact CG-CG1 4.08Å; L337-I377 HydrophobicContact CB-CD1 3.75Å; L337-I377 WeakPolarHBondContact O-CD1 3.48Å; A341-I377 HydrophobicContact CB-CB 4.06Å; A341-I377 HydrophobicContact CB-CD1 4.46Å; A341-I377 HydrophobicContact CB-CG2 3.74Å; G373-I377 WeakPolarHBondContact O-CG1 3.37Å; G373-I377 PolarHBondContact O-N 3.33Å; G373-I377 VanDerWaalsContact O-N 3.16Å; M374-I377 PolarHBondContact O-N 3.31Å; E375-I377 PolarHBondContact O-N 2.61Å; I377-A379 VanDerWaalsContact C-N 3.28Å; I377-A379 PolarHBondContact O-N 2.83Å; I377-D380 PolarHBondContact O-N 3.33Å; I377-D380 VanDerWaalsContact O-N 3.09Å; I377-M381 HydrophobicContact CG2-SD 4.02Å; I377-M381 WeakPolarHBondContact O-CG 3.5Å; I377-M381 PolarHBondContact O-N 3.49Å
378	L	94.3	Very high	91.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-57	-43.1	178.1	-70.6	172	0	0	0	111.1	A341 L344 L345 M374 D380 M381 I382 I506 A510	A341-L378 HydrophobicContact CB-CD2 4.32Å; A341-L378 HydrophobicContact CB-CG 4.24Å; L344-L378 HydrophobicContact CD1-CD1 4.26Å; L344-L378 HydrophobicContact CD2-CD1 4.09Å; L345-L378 HydrophobicContact CD1-CD2 3.8Å; L345-L378 HydrophobicContact CD2-CD2 4.22Å; L345-L378 HydrophobicContact CG-CD2 3.95Å; M374-L378 WeakPolarHBondContact O-CG 3.4Å; M374-L378 PolarHBondContact O-N 3.38Å; L378-D380 VanDerWaalsContact C-N 3.29Å; L378-D380 PolarHBondContact O-N 3.44Å; L378-M381 HydrophobicContact CD2-SD 4.39Å; L378-M381 WeakPolarHBondContact O-CB 2.95Å; L378-M381 PolarHBondContact O-N 3.49Å; L378-I382 HydrophobicContact CB-CD1 4.5Å; L378-I382 WeakPolarHBondContact O-CB 3.47Å; L378-I382 WeakPolarHBondContact O-CD1 3.04Å; L378-I382 WeakPolarHBondContact O-CG1 3.3Å; L378-I382 PolarHBondContact O-N 2.66Å; L378-I506 HydrophobicContact CD1-CG2 4.15Å; L378-A510 HydrophobicContact CB-CB 3.58Å; L378-A510 HydrophobicContact CD1-CB 4.3Å
379	A	94.3	Very high	91.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.9	-34.3	178.3	0	0	0	0	0	113.6	E375 I377 A383 A510 D513 S514 L518	E375-A379 WeakPolarHBondContact O-CB 3.19Å; E375-A379 PolarHBondContact O-N 2.89Å; I377-A379 VanDerWaalsContact C-N 3.28Å; I377-A379 PolarHBondContact O-N 2.83Å; A379-A383 VanDerWaalsContact O-CB 3.28Å; A379-A383 WeakPolarHBondContact O-CB 3.42Å; A379-A383 PolarHBondContact O-N 2.98Å; A379-A383 VanDerWaalsContact O-N 3.09Å; A379-A510 WeakPolarHBondContact CB-O 3.43Å; A379-D513 HydrophobicContact CB-CB 4.39Å; A379-S514 VanDerWaalsContact O-CB 3.27Å; A379-S514 WeakPolarHBondContact O-CB 3.08Å; A379-L518 WeakPolarHBondContact O-CD1 3.29Å
380	D	90.1	Very high	91.1	Very high	20 Å²	20	29.6 Å²	29.6	11%	0.107	16%	0.162	C	C	.	.	H	α-helix	trans	-76.6	-32.4	176.7	-173.9	82.1	0	0	0	112.1	A329 H376 I377 L378 K384	A329-D380 HydrophobicContact CB-CB 3.43Å; A329-D380 VanDerWaalsContact CB-CB 3.43Å; H376-D380 PolarHBondContact O-N 3.08Å; I377-D380 PolarHBondContact O-N 3.33Å; I377-D380 VanDerWaalsContact O-N 3.09Å; L378-D380 VanDerWaalsContact C-N 3.29Å; L378-D380 PolarHBondContact O-N 3.44Å; D380-K384 WeakPolarHBondContact O-CD 3.47Å; D380-K384 WeakPolarHBondContact O-CG 3.28Å; D380-K384 PolarHBondContact O-N 2.91Å; D380-K384 WeakPolarHBondContact OD1-CE 3.43Å; D380-K384 IonicContact OD1-NZ 3.38Å; D380-K384 PolarHBondContact OD1-NZ 3.49Å; D380-K384 IonicContact OD2-NZ 2.77Å; D380-K384 PolarHBondContact OD2-NZ 2.92Å
381	M	90	Very high	91.2	Very high	57 Å²	57	32.9 Å²	32.9	28%	0.281	18%	0.175	S	C	.	.	H	α-helix	trans	-66.3	-49.9	169.9	-63.9	171.1	71.3	0	0	111.3	L345 I377 L378 A383 K384 D385 W493	L345-M381 HydrophobicContact CD1-CE 4.26Å; I377-M381 HydrophobicContact CG2-SD 4.02Å; I377-M381 WeakPolarHBondContact O-CG 3.5Å; I377-M381 PolarHBondContact O-N 3.49Å; L378-M381 HydrophobicContact CD2-SD 4.39Å; L378-M381 WeakPolarHBondContact O-CB 2.95Å; L378-M381 PolarHBondContact O-N 3.49Å; M381-A383 VanDerWaalsContact C-N 3.33Å; M381-A383 PolarHBondContact O-N 3.34Å; M381-K384 PolarHBondContact O-N 3.44Å; M381-D385 PolarHBondContact O-N 3.4Å; M381-W493 HydrophobicContact CB-CH2 3.73Å; M381-W493 HydrophobicContact CB-CZ3 4.04Å; M381-W493 HydrophobicContact CE-CZ3 4.22Å
382	I	93.1	Very high	91.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-57.5	-45	178.2	-64.7	157.1	0	0	0	111	L378 K384 T388 F484 W493 A510 V511 S514	L378-I382 HydrophobicContact CB-CD1 4.5Å; L378-I382 WeakPolarHBondContact O-CB 3.47Å; L378-I382 WeakPolarHBondContact O-CD1 3.04Å; L378-I382 WeakPolarHBondContact O-CG1 3.3Å; L378-I382 PolarHBondContact O-N 2.66Å; I382-K384 VanDerWaalsContact C-N 3.26Å; I382-K384 PolarHBondContact O-N 3.24Å; I382-T388 HydrophobicContact CG2-CG2 3.93Å; I382-T388 WeakPolarHBondContact O-CG2 3.46Å; I382-F484 HydrophobicContact CG2-CZ 4.24Å; I382-W493 VanDerWaalsContact CA-CZ2 3.47Å; I382-W493 HydrophobicContact CB-CZ2 4.27Å; I382-W493 HydrophobicContact CG1-CD2 3.56Å; I382-W493 HydrophobicContact CG1-CE3 4.03Å; I382-W493 HydrophobicContact CG1-CG 3.89Å; I382-W493 HydrophobicContact CG1-CH2 4.41Å; I382-W493 HydrophobicContact CG1-CZ2 3.97Å; I382-W493 HydrophobicContact CG1-CZ3 4.42Å; I382-A510 HydrophobicContact CD1-CB 4.25Å; I382-V511 HydrophobicContact CD1-CB 4.49Å; I382-V511 HydrophobicContact CD1-CG2 3.7Å; I382-S514 VanDerWaalsContact CG2-OG 3.26Å; I382-S514 WeakPolarHBondContact CG2-OG 3.44Å
383	A	90.1	Very high	91.1	Very high	2 Å²	2	33.5 Å²	33.5	2%	0.017	17%	0.171	C	C	.	.	H	α-helix	trans	-70.6	-15.7	-177	0	0	0	0	0	115.1	A379 M381 L518 I519	A379-A383 VanDerWaalsContact O-CB 3.28Å; A379-A383 WeakPolarHBondContact O-CB 3.42Å; A379-A383 PolarHBondContact O-N 2.98Å; A379-A383 VanDerWaalsContact O-N 3.09Å; M381-A383 VanDerWaalsContact C-N 3.33Å; M381-A383 PolarHBondContact O-N 3.34Å; A383-L518 HydrophobicContact CB-CB 3.62Å; A383-L518 HydrophobicContact CB-CD1 3.54Å; A383-L518 HydrophobicContact CB-CG 4.22Å; A383-I519 HydrophobicContact CB-CD1 4.44Å; A383-I519 HydrophobicContact CB-CG1 3.98Å
384	K	84.4	Confident	91.1	Very high	76 Å²	76	35.4 Å²	35.4	33%	0.33	18%	0.181	S	C	.	.	H	α-helix	trans	-106.6	-11.9	-177.9	-70	173.6	-174.8	166.5	0	114	D380 M381 I382	D380-K384 WeakPolarHBondContact O-CD 3.47Å; D380-K384 WeakPolarHBondContact O-CG 3.28Å; D380-K384 PolarHBondContact O-N 2.91Å; D380-K384 WeakPolarHBondContact OD1-CE 3.43Å; D380-K384 IonicContact OD1-NZ 3.38Å; D380-K384 PolarHBondContact OD1-NZ 3.49Å; D380-K384 IonicContact OD2-NZ 2.77Å; D380-K384 PolarHBondContact OD2-NZ 2.92Å; M381-K384 PolarHBondContact O-N 3.44Å; I382-K384 VanDerWaalsContact C-N 3.26Å; I382-K384 PolarHBondContact O-N 3.24Å
385	D	86.9	Confident	91.1	Very high	16 Å²	16	36.8 Å²	36.8	9%	0.086	19%	0.189	C	C	.	.			trans	-68.2	125.4	-175.7	170.5	59.4	0	0	0	112.6	M381 E387 T388 L389 R492 W493	M381-D385 PolarHBondContact O-N 3.4Å; D385-E387 VanDerWaalsContact C-N 3.33Å; D385-E387 PolarHBondContact O-N 3.06Å; D385-T388 PolarHBondContact O-N 3.24Å; D385-T388 VanDerWaalsContact OD2-CB 3.25Å; D385-T388 WeakPolarHBondContact OD2-CB 3.46Å; D385-T388 PolarHBondContact OD2-N 2.87Å; D385-T388 PolarHBondContact OD2-OG1 3.24Å; D385-L389 PolarHBondContact O-N 2.86Å; D385-R492 IonicContact OD1-CZ 3.37Å; D385-R492 IonicContact OD1-NE 3.76Å; D385-R492 PolarHBondContact OD1-NE 3.41Å; D385-R492 IonicContact OD1-NH2 2.57Å; D385-R492 PolarHBondContact OD1-NH2 3.4Å; D385-R492 IonicContact OD2-CZ 2.77Å; D385-R492 IonicContact OD2-NE 3.17Å; D385-R492 PolarHBondContact OD2-NE 3.46Å; D385-R492 IonicContact OD2-NH2 3.68Å; D385-W493 HydrophobicContact CB-CH2 4.39Å; D385-W493 HydrophobicContact CB-CZ2 3.59Å
386	P	82.7	Confident	91	Very high	97 Å²	97	35.6 Å²	35.6	63%	0.63	18%	0.183	S	C	*	.	H	α-helix	trans	-60	-36.9	-176.4	-26.8	35.3	0	0	0	114.5	T390	P386-T390 VanDerWaalsContact O-CB 3.27Å; P386-T390 WeakPolarHBondContact O-CB 3.33Å; P386-T390 PolarHBondContact O-N 2.84Å; P386-T390 PolarHBondContact O-OG1 3.26Å
387	E	88.8	Confident	90.7	Very high	102 Å²	102	38.8 Å²	38.8	48%	0.477	20%	0.198	S	C	.	.	H	α-helix	trans	-68	-46.6	176.9	-74.9	175.4	-139.3	0	0	110.8	D385 L389 T390 Y391 W487 R492	D385-E387 VanDerWaalsContact C-N 3.33Å; D385-E387 PolarHBondContact O-N 3.06Å; E387-L389 PolarHBondContact O-N 3.49Å; E387-T390 PolarHBondContact O-N 3.04Å; E387-Y391 WeakPolarHBondContact O-CB 3.37Å; E387-Y391 PolarHBondContact O-N 3.13Å; E387-W487 HydrophobicContact CB-CH2 4.5Å; E387-R492 IonicContact OE1-CZ 2.87Å; E387-R492 IonicContact OE1-NH1 2.77Å; E387-R492 PolarHBondContact OE1-NH1 3.32Å; E387-R492 IonicContact OE1-NH2 2.7Å; E387-R492 VanDerWaalsContact OE2-CD 3.28Å; E387-R492 WeakPolarHBondContact OE2-CD 3.39Å; E387-R492 IonicContact OE2-CZ 3.79Å; E387-R492 VanDerWaalsContact OE2-CZ 3.27Å; E387-R492 IonicContact OE2-NE 2.75Å; E387-R492 PolarHBondContact OE2-NE 3.37Å; E387-R492 IonicContact OE2-NH1 3.79Å; E387-R492 PolarHBondContact OE2-NH1 3.24Å
388	T	92.4	Very high	90.6	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-45.6	176.5	-60.6	0	0	0	0	111.9	I382 D385 Y391 I392 F484 W487 W493	I382-T388 HydrophobicContact CG2-CG2 3.93Å; I382-T388 WeakPolarHBondContact O-CG2 3.46Å; D385-T388 PolarHBondContact O-N 3.24Å; D385-T388 VanDerWaalsContact OD2-CB 3.25Å; D385-T388 WeakPolarHBondContact OD2-CB 3.46Å; D385-T388 PolarHBondContact OD2-N 2.87Å; D385-T388 PolarHBondContact OD2-OG1 3.24Å; T388-Y391 PolarHBondContact O-N 3.12Å; T388-I392 WeakPolarHBondContact O-CG2 3.39Å; T388-I392 PolarHBondContact O-N 3.32Å; T388-I392 VanDerWaalsContact O-N 3.08Å; T388-F484 HydrophobicContact CG2-CE2 3.49Å; T388-F484 VanDerWaalsContact CG2-CE2 3.49Å; T388-F484 HydrophobicContact CG2-CZ 3.73Å; T388-W487 HydrophobicContact CG2-CZ3 4.42Å; T388-W493 PolarHBondContact OG1-NE1 3.03Å
389	L	89.7	Confident	90.3	Very high	22 Å²	22	48.1 Å²	48.1	12%	0.115	24%	0.241	C	C	.	.	H	α-helix	trans	-67.7	-36.1	177.3	-73.9	176.7	0	0	0	112.8	D385 E387 I392 K393 F522	D385-L389 PolarHBondContact O-N 2.86Å; E387-L389 PolarHBondContact O-N 3.49Å; L389-I392 WeakPolarHBondContact O-CG2 3.44Å; L389-K393 WeakPolarHBondContact O-CB 3.48Å; L389-K393 WeakPolarHBondContact O-CD 3.33Å; L389-K393 WeakPolarHBondContact O-CG 3.23Å; L389-K393 PolarHBondContact O-N 3.16Å; L389-F522 HydrophobicContact CD2-CD1 4.46Å; L389-F522 HydrophobicContact CD2-CE1 4.23Å
390	T	89	Confident	90.2	Very high	88 Å²	88	54.4 Å²	54.4	54%	0.54	27%	0.269	S	S	.	.	H	α-helix	trans	-65.7	-48.8	173.7	-61.3	0	0	0	0	110.9	P386 E387 I392 K393 T394	P386-T390 VanDerWaalsContact O-CB 3.27Å; P386-T390 WeakPolarHBondContact O-CB 3.33Å; P386-T390 PolarHBondContact O-N 2.84Å; P386-T390 PolarHBondContact O-OG1 3.26Å; E387-T390 PolarHBondContact O-N 3.04Å; T390-I392 PolarHBondContact O-N 3.35Å; T390-K393 PolarHBondContact O-N 3.35Å; T390-T394 PolarHBondContact O-N 3.37Å; T390-T394 PolarHBondContact O-OG1 2.95Å
391	Y	94.2	Very high	90.4	Very high	68 Å²	68	53.5 Å²	53.5	27%	0.267	26%	0.264	S	S	.	.	H	α-helix	trans	-60	-45.9	-178.3	-178	-103	0	0	0	112.5	E387 T388 T394 L395 W487	E387-Y391 WeakPolarHBondContact O-CB 3.37Å; E387-Y391 PolarHBondContact O-N 3.13Å; T388-Y391 PolarHBondContact O-N 3.12Å; Y391-T394 PolarHBondContact O-N 3.43Å; Y391-L395 HydrophobicContact CD1-CD1 4.03Å; Y391-L395 HydrophobicContact CD1-CG 4.32Å; Y391-L395 HydrophobicContact CE1-CD1 3.42Å; Y391-L395 VanDerWaalsContact CE1-CD1 3.42Å; Y391-L395 HydrophobicContact CE1-CD2 4.39Å; Y391-L395 HydrophobicContact CE1-CG 3.87Å; Y391-L395 PolarHBondContact O-N 3.49Å; Y391-W487 HydrophobicContact CD1-CB 4.15Å; Y391-W487 AromaticContact CD1-CD2 3.41Å; Y391-W487 HydrophobicContact CD1-CD2 3.41Å; Y391-W487 VanDerWaalsContact CD1-CD2 3.41Å; Y391-W487 AromaticContact CD1-CE2 3.92Å; Y391-W487 AromaticContact CD1-CE3 3.48Å; Y391-W487 HydrophobicContact CD1-CE3 3.48Å; Y391-W487 VanDerWaalsContact CD1-CE3 3.48Å; Y391-W487 AromaticContact CD1-CG 3.73Å; Y391-W487 HydrophobicContact CD1-CG 3.73Å; Y391-W487 HydrophobicContact CD1-CH2 4.47Å; Y391-W487 HydrophobicContact CD1-CZ2 4.42Å; Y391-W487 HydrophobicContact CD1-CZ3 4.04Å; Y391-W487 HydrophobicContact CD2-CD2 4.13Å; Y391-W487 AromaticContact CD2-CE2 3.8Å; Y391-W487 HydrophobicContact CD2-CG 4.32Å; Y391-W487 HydrophobicContact CD2-CZ2 4.2Å; Y391-W487 AromaticContact CD2-NE1 3.8Å; Y391-W487 HydrophobicContact CE1-CB 3.34Å; Y391-W487 AromaticContact CE1-CD1 3.78Å; Y391-W487 AromaticContact CE1-CD2 3.53Å; Y391-W487 HydrophobicContact CE1-CD2 3.53Å; Y391-W487 AromaticContact CE1-CE3 3.94Å; Y391-W487 HydrophobicContact CE1-CE3 3.94Å; Y391-W487 AromaticContact CE1-CG 3.26Å; Y391-W487 HydrophobicContact CE1-CG 3.26Å; Y391-W487 AromaticContact CE2-CD1 3.56Å; Y391-W487 HydrophobicContact CE2-CD2 4.23Å; Y391-W487 AromaticContact CE2-CG 3.93Å; Y391-W487 HydrophobicContact CE2-CG 3.93Å; Y391-W487 AromaticContact CE2-NE1 3.7Å; Y391-W487 AromaticContact CG-CD2 3.73Å; Y391-W487 HydrophobicContact CG-CD2 3.73Å; Y391-W487 AromaticContact CG-CE2 3.7Å; Y391-W487 AromaticContact CG-CE3 3.97Å; Y391-W487 HydrophobicContact CG-CE3 3.97Å; Y391-W487 HydrophobicContact CG-CG 4.23Å; Y391-W487 HydrophobicContact CG-CH2 4.16Å; Y391-W487 AromaticContact CG-CZ2 3.94Å; Y391-W487 HydrophobicContact CG-CZ2 3.94Å; Y391-W487 HydrophobicContact CG-CZ3 4.19Å; Y391-W487 AromaticContact CZ-CD1 3.39Å; Y391-W487 AromaticContact CZ-CD2 3.95Å; Y391-W487 AromaticContact CZ-CG 3.38Å; Y391-W487 AromaticContact CZ-NE1 3.98Å
392	I	94.4	Very high	90.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-68.1	-36.1	179.3	-162.9	161.5	0	0	0	112.6	T388 L389 T390 T394 L395 C396 V480 F484 Y515 I519 L523	T388-I392 WeakPolarHBondContact O-CG2 3.39Å; T388-I392 PolarHBondContact O-N 3.32Å; T388-I392 VanDerWaalsContact O-N 3.08Å; L389-I392 WeakPolarHBondContact O-CG2 3.44Å; T390-I392 PolarHBondContact O-N 3.35Å; I392-T394 VanDerWaalsContact C-N 3.35Å; I392-T394 PolarHBondContact O-N 3.25Å; I392-L395 PolarHBondContact O-N 3.27Å; I392-C396 PolarHBondContact O-N 3.28Å; I392-C396 PolarHBondContact O-SG 3.23Å; I392-V480 HydrophobicContact CG1-CG1 4.36Å; I392-F484 HydrophobicContact CB-CD2 3.7Å; I392-F484 HydrophobicContact CB-CE2 3.95Å; I392-F484 HydrophobicContact CD1-CB 4.19Å; I392-F484 HydrophobicContact CD1-CD1 4.24Å; I392-F484 HydrophobicContact CD1-CD2 3.36Å; I392-F484 HydrophobicContact CD1-CE2 3.68Å; I392-F484 HydrophobicContact CD1-CG 3.66Å; I392-F484 HydrophobicContact CD1-CZ 4.27Å; I392-F484 HydrophobicContact CG1-CD2 3.79Å; I392-F484 HydrophobicContact CG1-CE2 4.3Å; I392-F484 HydrophobicContact CG1-CG 4.34Å; I392-Y515 HydrophobicContact CD1-CD2 3.67Å; I392-Y515 HydrophobicContact CD1-CE2 3.55Å; I392-I519 HydrophobicContact CD1-CG2 3.62Å; I392-I519 HydrophobicContact CG2-CG2 4.09Å; I392-L523 HydrophobicContact CD1-CD1 4.03Å; I392-L523 HydrophobicContact CG1-CD1 4.06Å; I392-L523 HydrophobicContact CG2-CD1 4.49Å
393	K	90.5	Very high	90.9	Very high	77 Å²	77	51.7 Å²	51.7	34%	0.335	26%	0.256	S	S	.	.	H	α-helix	trans	-58.9	-46.7	172.1	-74.3	170.1	-176.6	179.5	0	110.5	L389 T390 L395 C396 E397 L523	L389-K393 WeakPolarHBondContact O-CB 3.48Å; L389-K393 WeakPolarHBondContact O-CD 3.33Å; L389-K393 WeakPolarHBondContact O-CG 3.23Å; L389-K393 PolarHBondContact O-N 3.16Å; T390-K393 PolarHBondContact O-N 3.35Å; K393-L395 PolarHBondContact O-N 2.92Å; K393-C396 PolarHBondContact O-N 2.87Å; K393-C396 VanDerWaalsContact O-N 3.16Å; K393-E397 WeakPolarHBondContact O-CG 3.48Å; K393-E397 PolarHBondContact O-N 2.91Å; K393-L523 HydrophobicContact CG-CD2 4.39Å
394	T	92.2	Very high	91.1	Very high	48 Å²	48	55 Å²	55	29%	0.294	27%	0.272	S	S	.	.	H	α-helix	trans	-64.2	-34.8	176.2	-59	0	0	0	0	113.5	T390 Y391 I392 K398	T390-T394 PolarHBondContact O-N 3.37Å; T390-T394 PolarHBondContact O-OG1 2.95Å; Y391-T394 PolarHBondContact O-N 3.43Å; I392-T394 VanDerWaalsContact C-N 3.35Å; I392-T394 PolarHBondContact O-N 3.25Å; T394-K398 HydrophobicContact CG2-CD 4.22Å; T394-K398 WeakPolarHBondContact O-CG 3.2Å; T394-K398 PolarHBondContact O-N 2.94Å
395	L	93.8	Very high	91.7	Very high	29 Å²	29	51.4 Å²	51.4	15%	0.152	26%	0.256	C	S	.	.	H	α-helix	trans	-64.9	-44.6	170.9	-73.6	-177.4	0	0	0	111.4	Y391 I392 K393 E397 K398 S399 V480 D483 F484	Y391-L395 HydrophobicContact CD1-CD1 4.03Å; Y391-L395 HydrophobicContact CD1-CG 4.32Å; Y391-L395 HydrophobicContact CE1-CD1 3.42Å; Y391-L395 VanDerWaalsContact CE1-CD1 3.42Å; Y391-L395 HydrophobicContact CE1-CD2 4.39Å; Y391-L395 HydrophobicContact CE1-CG 3.87Å; Y391-L395 PolarHBondContact O-N 3.49Å; I392-L395 PolarHBondContact O-N 3.27Å; K393-L395 PolarHBondContact O-N 2.92Å; L395-E397 PolarHBondContact O-N 3.25Å; L395-K398 PolarHBondContact O-N 3.46Å; L395-S399 WeakPolarHBondContact O-CB 3.48Å; L395-S399 PolarHBondContact O-N 3.27Å; L395-V480 HydrophobicContact CB-CG1 4.07Å; L395-D483 HydrophobicContact CD1-CB 4.18Å; L395-F484 HydrophobicContact CD1-CB 4.09Å
396	C	92.9	Very high	92	Very high	1 Å²	1	53 Å²	53	1%	0.007	27%	0.268	C	S	.	.	H	α-helix	trans	-63	-41.6	178.6	-67.8	0	0	0	0	112.2	I392 K393 K398 S399 V401 Y527	I392-C396 PolarHBondContact O-N 3.28Å; I392-C396 PolarHBondContact O-SG 3.23Å; K393-C396 PolarHBondContact O-N 2.87Å; K393-C396 VanDerWaalsContact O-N 3.16Å; C396-K398 VanDerWaalsContact C-N 3.3Å; C396-K398 PolarHBondContact O-N 3.39Å; C396-S399 WeakPolarHBondContact CA-OG 3.4Å; C396-S399 PolarHBondContact O-N 3.1Å; C396-S399 PolarHBondContact O-OG 2.95Å; C396-V401 HydrophobicContact CB-CG2 4.32Å; C396-Y527 HydrophobicContact CB-CE2 4.4Å; C396-Y527 VanDerWaalsContact CB-OH 3.25Å; C396-Y527 WeakPolarHBondContact CB-OH 3.41Å
397	E	88.5	Confident	92.5	Very high	111 Å²	111	50.2 Å²	50.2	52%	0.519	25%	0.249	S	C	.	.	H	α-helix	trans	-61.2	-35.1	176.7	-74.8	169.4	167.6	0	0	113.4	K393 L395 S399 Q451	K393-E397 WeakPolarHBondContact O-CG 3.48Å; K393-E397 PolarHBondContact O-N 2.91Å; L395-E397 PolarHBondContact O-N 3.25Å; E397-S399 VanDerWaalsContact C-N 3.27Å; E397-Q451 PolarHBondContact O-NE2 3.08Å; E397-Q451 VanDerWaalsContact O-NE2 3.16Å
398	K	89.6	Confident	92.5	Very high	173 Å²	173	45.5 Å²	45.5	75%	0.752	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	0.6	174.8	-67.3	172.7	-178.5	177	0	113.4	T394 L395 C396	T394-K398 HydrophobicContact CG2-CD 4.22Å; T394-K398 WeakPolarHBondContact O-CG 3.2Å; T394-K398 PolarHBondContact O-N 2.94Å; L395-K398 PolarHBondContact O-N 3.46Å; C396-K398 VanDerWaalsContact C-N 3.3Å; C396-K398 PolarHBondContact O-N 3.39Å
399	S	89.9	Confident	92.3	Very high	23 Å²	23	54 Å²	54	16%	0.161	27%	0.265	C	S	.	.	S	Bend	trans	-115	158.4	-174.5	81.9	0	0	0	0	112.8	L395 C396 E397 V401 V480	L395-S399 WeakPolarHBondContact O-CB 3.48Å; L395-S399 PolarHBondContact O-N 3.27Å; C396-S399 WeakPolarHBondContact CA-OG 3.4Å; C396-S399 PolarHBondContact O-N 3.1Å; C396-S399 PolarHBondContact O-OG 2.95Å; E397-S399 VanDerWaalsContact C-N 3.27Å; S399-V401 VanDerWaalsContact C-N 3.27Å; S399-V401 PolarHBondContact O-N 3.09Å; S399-V401 WeakPolarHBondContact OG-CG2 2.89Å; S399-V480 WeakPolarHBondContact OG-CG2 3.25Å
400	F	90.9	Very high	91.9	Very high	132 Å²	132	56.3 Å²	56.3	58%	0.579	28%	0.28	S	S	*	.			trans	-83.7	68.7	179.1	-157.8	-91.9	0	0	0	111.1	T402 N449	F400-T402 HydrophobicContact CD1-CG2 3.58Å; F400-T402 HydrophobicContact CE1-CG2 3.6Å; F400-N449 WeakPolarHBondContact CD2-ND2 3.35Å; F400-N449 HydrophobicContact CE1-CB 3.98Å; F400-N449 HydrophobicContact CE2-CB 3.96Å; F400-N449 VanDerWaalsContact CE2-ND2 3.26Å; F400-N449 WeakPolarHBondContact CE2-ND2 3.48Å; F400-N449 WeakPolarHBondContact CG-ND2 3.37Å; F400-N449 HydrophobicContact CZ-CB 3.64Å
401	V	94.9	Very high	91.6	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.012	25%	0.254	C	S	.	.			trans	-67	130.8	173.7	-178.6	0	0	0	0	109.4	C396 S399 N449 V450 V474 I476 Y527	C396-V401 HydrophobicContact CB-CG2 4.32Å; S399-V401 VanDerWaalsContact C-N 3.27Å; S399-V401 PolarHBondContact O-N 3.09Å; S399-V401 WeakPolarHBondContact OG-CG2 2.89Å; V401-N449 WeakPolarHBondContact O-CA 3.49Å; V401-V450 HydrophobicContact CB-CG2 3.84Å; V401-V450 HydrophobicContact CG1-CG1 3.92Å; V401-V450 HydrophobicContact CG1-CG2 3.99Å; V401-V450 PolarHBondContact O-N 2.88Å; V401-V474 HydrophobicContact CG1-CG1 3.6Å; V401-I476 HydrophobicContact CG1-CG1 4.26Å; V401-Y527 HydrophobicContact CG1-CD2 4.33Å; V401-Y527 HydrophobicContact CG1-CE2 4.15Å; V401-Y527 HydrophobicContact CG2-CE2 4.4Å
402	T	96	Very high	90.9	Very high	18 Å²	18	52.9 Å²	52.9	11%	0.11	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	154.7	180	59.4	0	0	0	0	112.6	F400 T447 C448 V474 N475	F400-T402 HydrophobicContact CD1-CG2 3.58Å; F400-T402 HydrophobicContact CE1-CG2 3.6Å; T402-T447 HydrophobicContact CG2-CG2 4.28Å; T402-C448 CarbonylContact C-O 3.56Å; T402-C448 WeakPolarHBondContact CA-O 3.14Å; T402-C448 VanDerWaalsContact CB-O 3.31Å; T402-C448 WeakPolarHBondContact CB-O 3.4Å; T402-V474 CarbonylContact O-C 3.56Å; T402-V474 WeakPolarHBondContact O-CA 3.47Å; T402-N475 PolarHBondContact N-O 3.16Å; T402-N475 VanDerWaalsContact N-O 3.08Å; T402-N475 PolarHBondContact O-N 3.28Å
403	I	96.4	Very high	90.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.6	164.5	-173.7	170.4	0	0	0	107.9	T447 C448 V450 I453 V472 K473 L531	I403-T447 WeakPolarHBondContact O-CA 3.4Å; I403-C448 HydrophobicContact CG2-CB 4.44Å; I403-C448 PolarHBondContact N-O 3.23Å; I403-C448 PolarHBondContact O-N 3.26Å; I403-V450 HydrophobicContact CB-CG1 4.21Å; I403-V450 HydrophobicContact CG2-CG1 4.41Å; I403-I453 HydrophobicContact CG2-CB 4.49Å; I403-I453 HydrophobicContact CG2-CD1 3.61Å; I403-V472 HydrophobicContact CD1-CG1 3.78Å; I403-V472 HydrophobicContact CG1-CG1 3.76Å; I403-K473 WeakPolarHBondContact CA-O 3.37Å; I403-L531 HydrophobicContact CD1-CD1 4Å
404	Q	95.6	Very high	89.5	Confident	73 Å²	73	58.8 Å²	58.8	34%	0.341	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	135.8	180	-177	176.1	17.2	0	0	109.7	F446 T447 V472 K473	Q404-F446 CarbonylContact C-O 3.43Å; Q404-F446 VanDerWaalsContact CA-O 3.25Å; Q404-F446 WeakPolarHBondContact CA-O 3.46Å; Q404-T447 WeakPolarHBondContact CG-OG1 3.4Å; Q404-V472 WeakPolarHBondContact O-CA 3.43Å; Q404-K473 PolarHBondContact N-O 3.47Å; Q404-K473 PolarHBondContact O-N 3.28Å
405	S	96.2	Very high	88.5	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	136.2	167.6	62.2	0	0	0	0	110.7	Y443 F446 T471	S405-Y443 PolarHBondContact OG-O 2.64Å; S405-F446 PolarHBondContact N-O 3.23Å; S405-F446 PolarHBondContact O-N 3.24Å; S405-F446 VanDerWaalsContact O-N 3.15Å; S405-T471 WeakPolarHBondContact CA-O 3.44Å
406	S	94.1	Very high	87.4	Confident	49 Å²	49	65.1 Å²	65.1	34%	0.343	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	160.4	174.4	68.7	0	0	0	0	111	S408 F444 L470 T471	S406-S408 PolarHBondContact O-N 2.66Å; S406-F444 VanDerWaalsContact CA-O 3.32Å; S406-F444 WeakPolarHBondContact CA-O 3.36Å; S406-L470 CarbonylContact O-C 3.53Å; S406-L470 VanDerWaalsContact O-CA 3.32Å; S406-L470 WeakPolarHBondContact O-CA 3.37Å; S406-T471 PolarHBondContact N-O 2.86Å; S406-T471 PolarHBondContact O-N 2.83Å
407	V	92.1	Very high	85.9	Confident	38 Å²	38	71.7 Å²	71.7	23%	0.23	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	135.8	170.1	-169.9	0	0	0	0	110.3	A411 L412 F444	V407-A411 HydrophobicContact CG1-CB 3.77Å; V407-L412 HydrophobicContact CB-CD2 4.32Å; V407-L412 HydrophobicContact CB-CG 4.43Å; V407-L412 HydrophobicContact CG1-CD2 3.87Å; V407-L412 HydrophobicContact CG1-CG 3.9Å; V407-F444 HydrophobicContact CG2-CB 3.63Å; V407-F444 HydrophobicContact CG2-CD1 3.76Å; V407-F444 HydrophobicContact CG2-CD2 4.18Å; V407-F444 HydrophobicContact CG2-CE1 4.43Å; V407-F444 HydrophobicContact CG2-CG 3.6Å; V407-F444 PolarHBondContact N-O 3.09Å
408	S	90.3	Very high	84.7	Confident	4 Å²	4	70.7 Å²	70.7	3%	0.028	34%	0.339	C	S	.	.			trans	-73.7	153.1	-179	83.8	0	0	0	0	112.1	S406 T410 A411 L412 K468 I469 T471	S406-S408 PolarHBondContact O-N 2.66Å; S408-T410 PolarHBondContact O-N 3.48Å; S408-T410 PolarHBondContact OG-N 3.26Å; S408-T410 PolarHBondContact OG-OG1 3.01Å; S408-A411 PolarHBondContact O-N 3.45Å; S408-A411 VanDerWaalsContact OG-CB 3.23Å; S408-A411 WeakPolarHBondContact OG-CB 3.35Å; S408-A411 PolarHBondContact OG-N 3.33Å; S408-L412 WeakPolarHBondContact O-CG 3.08Å; S408-L412 PolarHBondContact O-N 3.16Å; S408-L412 VanDerWaalsContact O-N 3.09Å; S408-K468 WeakPolarHBondContact CB-O 3.39Å; S408-K468 PolarHBondContact OG-O 2.84Å; S408-I469 WeakPolarHBondContact CB-O 3.33Å; S408-I469 PolarHBondContact N-O 3.27Å; S408-I469 PolarHBondContact OG-O 3.49Å; S408-T471 WeakPolarHBondContact CB-OG1 3.21Å
409	K	86.9	Confident	83.3	Confident	178 Å²	178	68.9 Å²	68.9	77%	0.774	33%	0.331	S	S	*	.	H	α-helix	trans	-63.5	-23	174.9	-65.8	-173.2	178.4	-174	0	113.2	K413	K409-K413 WeakPolarHBondContact O-CG 3.36Å
410	T	82.6	Confident	81.8	Confident	70 Å²	70	72.1 Å²	72.1	43%	0.429	35%	0.35	S	S	.	.	H	α-helix	trans	-78.1	-42.6	174.4	42.9	0	0	0	0	111.3	S408 L412 K413 E414 K468	S408-T410 PolarHBondContact O-N 3.48Å; S408-T410 PolarHBondContact OG-N 3.26Å; S408-T410 PolarHBondContact OG-OG1 3.01Å; T410-L412 PolarHBondContact O-N 2.91Å; T410-K413 PolarHBondContact O-N 3.48Å; T410-E414 WeakPolarHBondContact O-CG 3.4Å; T410-E414 PolarHBondContact O-N 3.44Å; T410-K468 PolarHBondContact OG1-O 3.21Å
411	A	80.9	Confident	80.1	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.008	34%	0.339	C	S	.	.	H	α-helix	trans	-61.5	-41	176.6	0	0	0	0	0	112.9	V407 S408 E414 K415 F437	V407-A411 HydrophobicContact CG1-CB 3.77Å; S408-A411 PolarHBondContact O-N 3.45Å; S408-A411 VanDerWaalsContact OG-CB 3.23Å; S408-A411 WeakPolarHBondContact OG-CB 3.35Å; S408-A411 PolarHBondContact OG-N 3.33Å; A411-E414 PolarHBondContact O-N 2.8Å; A411-K415 WeakPolarHBondContact O-CB 3.08Å; A411-K415 PolarHBondContact O-N 3.22Å; A411-F437 HydrophobicContact CB-CE1 3.64Å; A411-F437 HydrophobicContact CB-CZ 4.32Å
412	L	81	Confident	78.1	Confident	83 Å²	83	75 Å²	75	44%	0.435	37%	0.372	S	S	.	.	H	α-helix	trans	-59.6	-46.8	175.9	-68.6	170.6	0	0	0	111.4	V407 S408 T410 K415 E416	V407-L412 HydrophobicContact CB-CD2 4.32Å; V407-L412 HydrophobicContact CB-CG 4.43Å; V407-L412 HydrophobicContact CG1-CD2 3.87Å; V407-L412 HydrophobicContact CG1-CG 3.9Å; S408-L412 WeakPolarHBondContact O-CG 3.08Å; S408-L412 PolarHBondContact O-N 3.16Å; S408-L412 VanDerWaalsContact O-N 3.09Å; T410-L412 PolarHBondContact O-N 2.91Å; L412-K415 PolarHBondContact O-N 2.95Å; L412-E416 WeakPolarHBondContact O-CG 3.31Å; L412-E416 PolarHBondContact O-N 3.47Å
413	K	79.3	Confident	76	Confident	136 Å²	136	81.7 Å²	81.7	59%	0.591	40%	0.403	S	S	*	.	H	α-helix	trans	-65.4	-41.6	177.4	-69.6	-178	177.7	-165.3	0	113.2	K409 T410 K415 E416 Q417	K409-K413 WeakPolarHBondContact O-CG 3.36Å; T410-K413 PolarHBondContact O-N 3.48Å; K413-K415 VanDerWaalsContact C-N 3.32Å; K413-E416 PolarHBondContact O-N 3.11Å; K413-Q417 WeakPolarHBondContact O-CB 3.43Å; K413-Q417 VanDerWaalsContact O-CG 3.29Å; K413-Q417 WeakPolarHBondContact O-CG 2.9Å; K413-Q417 PolarHBondContact O-N 2.87Å
414	E	76	Confident	73.8	Confident	66 Å²	66	89.6 Å²	89.6	31%	0.308	44%	0.439	S	S	.	.	H	α-helix	trans	-59.8	-44.4	174.5	-73.6	174.3	179.8	0	0	110.4	T410 A411 Q417 E418 K435 F437	T410-E414 WeakPolarHBondContact O-CG 3.4Å; T410-E414 PolarHBondContact O-N 3.44Å; A411-E414 PolarHBondContact O-N 2.8Å; E414-Q417 PolarHBondContact O-N 2.83Å; E414-E418 WeakPolarHBondContact O-CG 3.49Å; E414-E418 PolarHBondContact O-N 3.48Å; E414-K435 IonicContact OE1-NZ 3.41Å; E414-K435 PolarHBondContact OE1-NZ 3.19Å; E414-K435 IonicContact OE2-NZ 3.39Å; E414-K435 PolarHBondContact OE2-NZ 2.69Å; E414-F437 HydrophobicContact CB-CZ 4.49Å
415	K	71.4	Confident	71.2	Confident	87 Å²	87	93.1 Å²	93.1	38%	0.378	45%	0.453	S	S	.	.	H	α-helix	trans	-70.3	-32.4	-180	-165.1	169.3	-171.1	168.7	0	113.7	A411 L412 K413 K419	A411-K415 WeakPolarHBondContact O-CB 3.08Å; A411-K415 PolarHBondContact O-N 3.22Å; L412-K415 PolarHBondContact O-N 2.95Å; K413-K415 VanDerWaalsContact C-N 3.32Å; K415-K419 WeakPolarHBondContact O-CG 3.49Å; K415-K419 PolarHBondContact O-N 3.48Å
416	E	69.1	Low	68.6	Low	123 Å²	123	102.3 Å²	102.3	58%	0.575	49%	0.493	S	S	*	.	H	α-helix	trans	-66.9	-44.3	170.8	-75	165.5	178.8	0	0	111.2	L412 K413 K419 V420	L412-E416 WeakPolarHBondContact O-CG 3.31Å; L412-E416 PolarHBondContact O-N 3.47Å; K413-E416 PolarHBondContact O-N 3.11Å; E416-K419 PolarHBondContact O-N 3.13Å; E416-V420 WeakPolarHBondContact O-CG2 3.4Å; E416-V420 PolarHBondContact O-N 3.29Å
417	Q	62.9	Low	65.9	Low	138 Å²	138	106.5 Å²	106.5	65%	0.645	52%	0.519	S	S	*	.	H	α-helix	trans	-66.5	-37.4	177	-71.9	175.1	0.6	0	0	112.7	K413 E414 V420 A421	K413-Q417 WeakPolarHBondContact O-CB 3.43Å; K413-Q417 VanDerWaalsContact O-CG 3.29Å; K413-Q417 WeakPolarHBondContact O-CG 2.9Å; K413-Q417 PolarHBondContact O-N 2.87Å; E414-Q417 PolarHBondContact O-N 2.83Å; Q417-V420 PolarHBondContact O-N 2.91Å; Q417-A421 VanDerWaalsContact O-CB 3.29Å; Q417-A421 WeakPolarHBondContact O-CB 3.25Å; Q417-A421 PolarHBondContact O-N 3.45Å
418	E	62.8	Low	63.5	Low	90 Å²	90	108.5 Å²	108.5	42%	0.421	55%	0.548	S	S	.	.	H	α-helix	trans	-63.8	-38	174.9	-79	-172.3	156.7	0	0	112.8	E414 A421 Q422	E414-E418 WeakPolarHBondContact O-CG 3.49Å; E414-E418 PolarHBondContact O-N 3.48Å; E418-A421 CarbonylContact O-C 3.59Å; E418-A421 PolarHBondContact O-N 2.94Å; E418-Q422 WeakPolarHBondContact O-CG 3.34Å; E418-Q422 PolarHBondContact O-N 2.65Å
419	K	60.7	Low	60.8	Low	136 Å²	136	111.8 Å²	111.8	59%	0.591	58%	0.575	S	S	*	*	H	α-helix	trans	-63.1	-49.5	174.8	-77	-179.8	168.3	-168.5	0	111.9	K415 E416 A421 Q422 E423	K415-K419 WeakPolarHBondContact O-CG 3.49Å; K415-K419 PolarHBondContact O-N 3.48Å; E416-K419 PolarHBondContact O-N 3.13Å; K419-A421 PolarHBondContact O-N 3.17Å; K419-Q422 PolarHBondContact O-N 3.35Å; K419-E423 PolarHBondContact O-N 3.22Å
420	V	57.9	Low	58.5	Low	91 Å²	91	112.3 Å²	112.3	55%	0.552	58%	0.58	S	S	*	*	H	α-helix	trans	-61.5	-34.7	176.4	177.4	0	0	0	0	111.3	E416 Q417	E416-V420 WeakPolarHBondContact O-CG2 3.4Å; E416-V420 PolarHBondContact O-N 3.29Å; Q417-V420 PolarHBondContact O-N 2.91Å
421	A	55.9	Low	56.4	Low	43 Å²	43	117.7 Å²	117.7	36%	0.355	60%	0.6	S	S	.	*	H	α-helix	trans	-75.9	-18	175.1	0	0	0	0	0	114.3	Q417 E418 K419 K425	Q417-A421 VanDerWaalsContact O-CB 3.29Å; Q417-A421 WeakPolarHBondContact O-CB 3.25Å; Q417-A421 PolarHBondContact O-N 3.45Å; E418-A421 CarbonylContact O-C 3.59Å; E418-A421 PolarHBondContact O-N 2.94Å; K419-A421 PolarHBondContact O-N 3.17Å; A421-K425 WeakPolarHBondContact O-CD 3.48Å; A421-K425 VanDerWaalsContact O-CG 3.27Å; A421-K425 WeakPolarHBondContact O-CG 3.37Å
422	Q	52.8	Low	54.4	Low	151 Å²	151	126.4 Å²	126.4	71%	0.706	64%	0.641	S	S	*	*	H	α-helix	trans	-80.1	-33.6	171.9	-81.3	-177	-36.8	0	0	112	E418 K419 H424	E418-Q422 WeakPolarHBondContact O-CG 3.34Å; E418-Q422 PolarHBondContact O-N 2.65Å; K419-Q422 PolarHBondContact O-N 3.35Å; Q422-H424 PolarHBondContact O-N 3.16Å
423	E	51.3	Low	52.6	Low	159 Å²	159	130.5 Å²	130.5	74%	0.743	66%	0.655	S	S	*	*	H	α-helix	trans	-68.5	-19.8	173.5	-68.3	175.6	167.9	0	0	112.8	K419	K419-E423 PolarHBondContact O-N 3.22Å
424	H	49.3	Very low	51.1	Low	166 Å²	166	130.9 Å²	130.9	77%	0.769	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.3	49.1	-179.4	-72.7	-41.9	0	0	0	114.6	Q422	Q422-H424 PolarHBondContact O-N 3.16Å
425	K	41.5	Very low	50.3	Low	147 Å²	147	131.2 Å²	131.2	64%	0.639	66%	0.657	S	S	*	*			trans	-110.4	112.1	173.5	-103.3	172.7	-176.2	178.5	0	114.6	A421	A421-K425 WeakPolarHBondContact O-CD 3.48Å; A421-K425 VanDerWaalsContact O-CG 3.27Å; A421-K425 WeakPolarHBondContact O-CG 3.37Å
426	K	41.9	Very low	50.1	Low	193 Å²	193	130.3 Å²	130.3	84%	0.839	66%	0.656	S	S	*	*			trans	-65.6	145.1	153.8	-73.9	-179.9	176.6	176.8	0	109.4	G428	K426-G428 PolarHBondContact O-N 2.89Å
427	P	38.1	Very low	50.5	Low	136 Å²	136	125.1 Å²	125.1	88%	0.883	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	124.6	177	28.6	-33.6	0	0	0	110.7
428	G	40.2	Very low	51.3	Low	81 Å²	81	123.6 Å²	123.6	84%	0.835	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	145.3	-2.8	169.8	0	0	0	0	0	118.6	K426	K426-G428 PolarHBondContact O-N 2.89Å
429	A	35.1	Very low	52.3	Low	72 Å²	72	125.5 Å²	125.5	60%	0.595	64%	0.635	S	S	*	*			trans	-87.3	131.9	178.3	0	0	0	0	0	112.6
430	E	37.8	Very low	53.6	Low	190 Å²	190	119.8 Å²	119.8	89%	0.888	61%	0.61	S	S	*	*			trans	-59.9	145.4	-179.2	-65.2	177.6	145.5	0	0	112.7	Q432	E430-Q432 PolarHBondContact O-N 3.14Å
431	H	37.9	Very low	55	Low	182 Å²	182	121.7 Å²	121.7	84%	0.843	61%	0.613	S	S	*	*			trans	-76.6	104	178.8	-76	36.8	0	0	0	110.7
432	Q	40.3	Very low	56.5	Low	185 Å²	185	126.6 Å²	126.6	86%	0.864	63%	0.633	S	S	*	*			trans	-62.4	144.2	160.2	-72.6	-178	-14.2	0	0	109.7	E430 K434	E430-Q432 PolarHBondContact O-N 3.14Å; Q432-K434 PolarHBondContact O-N 3.27Å
433	K	41.8	Very low	58.5	Low	168 Å²	168	120.6 Å²	120.6	73%	0.73	60%	0.604	S	S	*	*			trans	-43.1	101.3	-175.6	-81.5	-170.5	171.8	-171.9	0	111.2	D38 K435	D38-K433 IonicContact OD1-NZ 3.27Å; D38-K433 PolarHBondContact OD1-NZ 2.96Å; K433-K435 PolarHBondContact O-N 2.76Å
434	K	49.2	Very low	60.4	Low	145 Å²	145	115.1 Å²	115.1	63%	0.63	58%	0.577	S	S	*	*			trans	-65.1	114.1	179.5	-168.7	-177.5	-177.5	-169.2	0	108.1	Q432 D436	Q432-K434 PolarHBondContact O-N 3.27Å; K434-D436 PolarHBondContact O-N 3.42Å
435	K	59	Low	62.5	Low	72 Å²	72	113.3 Å²	113.3	31%	0.313	57%	0.574	S	S	.	*			trans	-65.9	116.7	168.5	-66.5	-179	-164.7	166.4	0	106.8	E414 K433 F437 I469	E414-K435 IonicContact OE1-NZ 3.41Å; E414-K435 PolarHBondContact OE1-NZ 3.19Å; E414-K435 IonicContact OE2-NZ 3.39Å; E414-K435 PolarHBondContact OE2-NZ 2.69Å; K433-K435 PolarHBondContact O-N 2.76Å; K435-F437 HydrophobicContact CB-CD2 4.31Å; K435-F437 HydrophobicContact CB-CE2 4.03Å; K435-F437 HydrophobicContact CB-CZ 4.42Å; K435-F437 HydrophobicContact CD-CZ 4.35Å; K435-F437 VanDerWaalsContact O-CD2 3.26Å; K435-F437 WeakPolarHBondContact O-CD2 3.19Å; K435-F437 PolarHBondContact O-N 2.87Å; K435-I469 HydrophobicContact CB-CD1 4.46Å; K435-I469 HydrophobicContact CD-CG1 4.44Å
436	D	67.4	Low	65	Low	68 Å²	68	107.9 Å²	107.9	36%	0.364	55%	0.55	S	S	.	*			trans	-70.5	79.5	175.8	-81.5	-33.1	0	0	0	110.7	K434 D438 K439	K434-D436 PolarHBondContact O-N 3.42Å; D436-D438 PolarHBondContact O-N 2.86Å; D436-K439 HydrophobicContact CB-CB 4.35Å; D436-K439 HydrophobicContact CB-CD 3.63Å; D436-K439 HydrophobicContact CB-CG 3.87Å; D436-K439 WeakPolarHBondContact O-CB 3.44Å; D436-K439 PolarHBondContact O-N 3.29Å; D436-K439 WeakPolarHBondContact OD2-CE 3.44Å; D436-K439 IonicContact OD2-NZ 2.7Å; D436-K439 PolarHBondContact OD2-NZ 3.27Å
437	F	76.9	Confident	67.6	Low	14 Å²	14	102.3 Å²	102.3	6%	0.061	53%	0.532	C	S	.	.	G	3₁₀ helix	trans	-54.2	-38.1	175.5	-78.7	-75.2	0	0	0	111.8	A411 E414 K435 K439 F440 F444 I469	A411-F437 HydrophobicContact CB-CE1 3.64Å; A411-F437 HydrophobicContact CB-CZ 4.32Å; E414-F437 HydrophobicContact CB-CZ 4.49Å; K435-F437 HydrophobicContact CB-CD2 4.31Å; K435-F437 HydrophobicContact CB-CE2 4.03Å; K435-F437 HydrophobicContact CB-CZ 4.42Å; K435-F437 HydrophobicContact CD-CZ 4.35Å; K435-F437 VanDerWaalsContact O-CD2 3.26Å; K435-F437 WeakPolarHBondContact O-CD2 3.19Å; K435-F437 PolarHBondContact O-N 2.87Å; F437-K439 PolarHBondContact O-N 2.89Å; F437-F440 PolarHBondContact O-N 3.4Å; F437-F444 HydrophobicContact CB-CZ 4.43Å; F437-F444 VanDerWaalsContact O-CZ 3.25Å; F437-F444 WeakPolarHBondContact O-CZ 3.36Å; F437-I469 HydrophobicContact CD1-CG1 4.34Å; F437-I469 HydrophobicContact CD1-CG2 3.85Å; F437-I469 HydrophobicContact CE1-CB 4.48Å; F437-I469 HydrophobicContact CE1-CG1 4.01Å; F437-I469 HydrophobicContact CE1-CG2 4.05Å
438	D	79.7	Confident	70.3	Confident	106 Å²	106	97.1 Å²	97.1	57%	0.567	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-65.1	-24.8	-175.7	-55.5	-31.6	0	0	0	112.7	D436 F440 Q441	D436-D438 PolarHBondContact O-N 2.86Å; D438-F440 PolarHBondContact O-N 2.83Å; D438-Q441 WeakPolarHBondContact O-CB 3.33Å; D438-Q441 PolarHBondContact O-N 3.46Å
439	K	82.8	Confident	72.9	Confident	131 Å²	131	93.7 Å²	93.7	57%	0.57	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-62.9	-22.4	173	-73.6	176.4	179.7	157.7	0	112.9	D436 F437	D436-K439 HydrophobicContact CB-CB 4.35Å; D436-K439 HydrophobicContact CB-CD 3.63Å; D436-K439 HydrophobicContact CB-CG 3.87Å; D436-K439 WeakPolarHBondContact O-CB 3.44Å; D436-K439 PolarHBondContact O-N 3.29Å; D436-K439 WeakPolarHBondContact OD2-CE 3.44Å; D436-K439 IonicContact OD2-NZ 2.7Å; D436-K439 PolarHBondContact OD2-NZ 3.27Å; F437-K439 PolarHBondContact O-N 2.89Å
440	F	87.9	Confident	75.7	Confident	15 Å²	15	91 Å²	91	7%	0.066	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-105.8	7.2	-178.2	-61.4	-82.4	0	0	0	113.8	F437 D438 L442 Y443 F444 A460 R463 L467 I469 L470	F437-F440 PolarHBondContact O-N 3.4Å; D438-F440 PolarHBondContact O-N 2.83Å; F440-L442 PolarHBondContact O-N 2.97Å; F440-L442 VanDerWaalsContact O-N 3.14Å; F440-Y443 WeakPolarHBondContact O-CA 3.26Å; F440-Y443 PolarHBondContact O-N 2.94Å; F440-F444 HydrophobicContact CB-CD1 4.43Å; F440-F444 HydrophobicContact CB-CE1 3.86Å; F440-F444 VanDerWaalsContact O-CD1 3.25Å; F440-F444 WeakPolarHBondContact O-CD1 3.48Å; F440-F444 PolarHBondContact O-N 3.36Å; F440-A460 WeakPolarHBondContact CE1-O 3.4Å; F440-R463 HydrophobicContact CE1-CB 4.41Å; F440-R463 HydrophobicContact CE1-CG 4.37Å; F440-R463 HydrophobicContact CZ-CG 4.11Å; F440-L467 HydrophobicContact CE2-CD1 4Å; F440-L467 HydrophobicContact CZ-CD1 3.83Å; F440-I469 HydrophobicContact CB-CG2 4.21Å; F440-I469 HydrophobicContact CD2-CD1 3.67Å; F440-I469 HydrophobicContact CD2-CG2 4.27Å; F440-I469 HydrophobicContact CE2-CD1 3.65Å; F440-I469 HydrophobicContact CG-CG2 4.34Å; F440-L470 HydrophobicContact CD1-CD1 4.43Å
441	Q	87.4	Confident	78.1	Confident	132 Å²	132	88.3 Å²	88.3	62%	0.617	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-54.9	-36.7	-174.8	-171	180	13	0	0	113.6	D438 Y443 F444	D438-Q441 WeakPolarHBondContact O-CB 3.33Å; D438-Q441 PolarHBondContact O-N 3.46Å; Q441-Y443 PolarHBondContact O-N 3.36Å; Q441-Y443 VanDerWaalsContact O-N 3.16Å; Q441-F444 HydrophobicContact CB-CD2 4.43Å; Q441-F444 HydrophobicContact CB-CE2 4.24Å; Q441-F444 HydrophobicContact CG-CD2 4.26Å; Q441-F444 HydrophobicContact CG-CE2 4.29Å; Q441-F444 PolarHBondContact O-N 3.41Å
442	L	88.7	Confident	80.7	Confident	146 Å²	146	88.5 Å²	88.5	76%	0.764	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-64.8	-13.5	176.7	-64.1	175.4	0	0	0	114.3	F440	F440-L442 PolarHBondContact O-N 2.97Å; F440-L442 VanDerWaalsContact O-N 3.14Å
443	Y	93.6	Very high	83.2	Confident	24 Å²	24	80.4 Å²	80.4	9%	0.094	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-117.3	6.2	-174.6	-56.1	-69.9	0	0	0	113.4	S405 F440 Q441 F446 Q457 A460 I461	S405-Y443 PolarHBondContact OG-O 2.64Å; F440-Y443 WeakPolarHBondContact O-CA 3.26Å; F440-Y443 PolarHBondContact O-N 2.94Å; Q441-Y443 PolarHBondContact O-N 3.36Å; Q441-Y443 VanDerWaalsContact O-N 3.16Å; Y443-F446 HydrophobicContact CD1-CB 4.3Å; Y443-F446 HydrophobicContact CD1-CD1 4.36Å; Y443-F446 HydrophobicContact CD1-CD2 4.2Å; Y443-F446 HydrophobicContact CD1-CG 4.05Å; Y443-F446 HydrophobicContact CE1-CD2 4.47Å; Y443-F446 HydrophobicContact CE1-CE2 4.49Å; Y443-Q457 HydrophobicContact CE1-CB 4.16Å; Y443-Q457 HydrophobicContact CE1-CG 4.25Å; Y443-A460 HydrophobicContact CD2-CB 4.28Å; Y443-A460 HydrophobicContact CE2-CB 3.54Å; Y443-I461 HydrophobicContact CD1-CD1 3.86Å; Y443-I461 HydrophobicContact CD1-CG1 3.58Å; Y443-I461 HydrophobicContact CE1-CD1 4.21Å; Y443-I461 HydrophobicContact CE1-CG1 4.06Å; Y443-I461 HydrophobicContact CG-CG1 4.02Å
444	F	91.9	Very high	85.5	Confident	44 Å²	44	75.2 Å²	75.2	19%	0.193	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-29	179.8	-74	-7.3	0	0	0	114.3	S406 V407 F437 F440 Q441 I469 L470	S406-F444 VanDerWaalsContact CA-O 3.32Å; S406-F444 WeakPolarHBondContact CA-O 3.36Å; V407-F444 HydrophobicContact CG2-CB 3.63Å; V407-F444 HydrophobicContact CG2-CD1 3.76Å; V407-F444 HydrophobicContact CG2-CD2 4.18Å; V407-F444 HydrophobicContact CG2-CE1 4.43Å; V407-F444 HydrophobicContact CG2-CG 3.6Å; V407-F444 PolarHBondContact N-O 3.09Å; F437-F444 HydrophobicContact CB-CZ 4.43Å; F437-F444 VanDerWaalsContact O-CZ 3.25Å; F437-F444 WeakPolarHBondContact O-CZ 3.36Å; F440-F444 HydrophobicContact CB-CD1 4.43Å; F440-F444 HydrophobicContact CB-CE1 3.86Å; F440-F444 VanDerWaalsContact O-CD1 3.25Å; F440-F444 WeakPolarHBondContact O-CD1 3.48Å; F440-F444 PolarHBondContact O-N 3.36Å; Q441-F444 HydrophobicContact CB-CD2 4.43Å; Q441-F444 HydrophobicContact CB-CE2 4.24Å; Q441-F444 HydrophobicContact CG-CD2 4.26Å; Q441-F444 HydrophobicContact CG-CE2 4.29Å; Q441-F444 PolarHBondContact O-N 3.41Å; F444-I469 HydrophobicContact CE1-CG2 4.19Å; F444-L470 HydrophobicContact CD1-CD2 3.92Å; F444-L470 HydrophobicContact CE1-CD2 4.43Å
445	D	93.1	Very high	87.5	Confident	129 Å²	129	69.9 Å²	69.9	69%	0.69	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.2	79.9	166.1	-175.6	23.9	0	0	0	108.2
446	F	95.3	Very high	89	Confident	33 Å²	33	68 Å²	68	15%	0.145	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	128.4	-176.9	171.5	-87.6	0	0	0	109.6	Q404 S405 Y443 C448 I453 I461	Q404-F446 CarbonylContact C-O 3.43Å; Q404-F446 VanDerWaalsContact CA-O 3.25Å; Q404-F446 WeakPolarHBondContact CA-O 3.46Å; S405-F446 PolarHBondContact N-O 3.23Å; S405-F446 PolarHBondContact O-N 3.24Å; S405-F446 VanDerWaalsContact O-N 3.15Å; Y443-F446 HydrophobicContact CD1-CB 4.3Å; Y443-F446 HydrophobicContact CD1-CD1 4.36Å; Y443-F446 HydrophobicContact CD1-CD2 4.2Å; Y443-F446 HydrophobicContact CD1-CG 4.05Å; Y443-F446 HydrophobicContact CE1-CD2 4.47Å; Y443-F446 HydrophobicContact CE1-CE2 4.49Å; F446-C448 HydrophobicContact CE1-CB 3.57Å; F446-C448 HydrophobicContact CE2-CB 4.47Å; F446-C448 HydrophobicContact CZ-CB 3.54Å; F446-I453 HydrophobicContact CE1-CD1 4.18Å; F446-I461 HydrophobicContact CD1-CD1 3.59Å; F446-I461 HydrophobicContact CE1-CD1 3.56Å; F446-I461 HydrophobicContact CZ-CD1 4.49Å
447	T	95.8	Very high	90.3	Very high	76 Å²	76	66.5 Å²	66.5	47%	0.466	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	129.7	173.6	-60.8	0	0	0	0	109.4	T402 I403 Q404	T402-T447 HydrophobicContact CG2-CG2 4.28Å; I403-T447 WeakPolarHBondContact O-CA 3.4Å; Q404-T447 WeakPolarHBondContact CG-OG1 3.4Å
448	C	94.8	Very high	91.1	Very high	26 Å²	26	66 Å²	66	18%	0.176	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	154.4	177.8	-162.4	0	0	0	0	111.4	T402 I403 F446 I453	T402-C448 CarbonylContact C-O 3.56Å; T402-C448 WeakPolarHBondContact CA-O 3.14Å; T402-C448 VanDerWaalsContact CB-O 3.31Å; T402-C448 WeakPolarHBondContact CB-O 3.4Å; I403-C448 HydrophobicContact CG2-CB 4.44Å; I403-C448 PolarHBondContact N-O 3.23Å; I403-C448 PolarHBondContact O-N 3.26Å; F446-C448 HydrophobicContact CE1-CB 3.57Å; F446-C448 HydrophobicContact CE2-CB 4.47Å; F446-C448 HydrophobicContact CZ-CB 3.54Å; C448-I453 HydrophobicContact CB-CB 4.3Å
449	N	94.7	Very high	91.9	Very high	10 Å²	10	61 Å²	61	5%	0.053	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	136.6	170.2	-179.5	-69.2	0	0	0	110	F400 V401 Q451 R452 I453	F400-N449 WeakPolarHBondContact CD2-ND2 3.35Å; F400-N449 HydrophobicContact CE1-CB 3.98Å; F400-N449 HydrophobicContact CE2-CB 3.96Å; F400-N449 VanDerWaalsContact CE2-ND2 3.26Å; F400-N449 WeakPolarHBondContact CE2-ND2 3.48Å; F400-N449 WeakPolarHBondContact CG-ND2 3.37Å; F400-N449 HydrophobicContact CZ-CB 3.64Å; V401-N449 WeakPolarHBondContact O-CA 3.49Å; N449-Q451 PolarHBondContact O-N 3.25Å; N449-Q451 VanDerWaalsContact O-N 3.17Å; N449-Q451 WeakPolarHBondContact OD1-CA 3.31Å; N449-Q451 VanDerWaalsContact OD1-CB 3.24Å; N449-Q451 WeakPolarHBondContact OD1-CB 3.38Å; N449-Q451 PolarHBondContact OD1-N 3.34Å; N449-R452 HydrophobicContact CB-CB 4.35Å; N449-R452 HydrophobicContact CB-CG 4.45Å; N449-R452 PolarHBondContact O-N 3.14Å; N449-I453 PolarHBondContact O-N 3.42Å
450	V	93.4	Very high	92.4	Very high	16 Å²	16	54.8 Å²	54.8	10%	0.097	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-20.6	-176.3	-59.1	0	0	0	0	114.3	V401 I403 Y527 L531	V401-V450 HydrophobicContact CB-CG2 3.84Å; V401-V450 HydrophobicContact CG1-CG1 3.92Å; V401-V450 HydrophobicContact CG1-CG2 3.99Å; V401-V450 PolarHBondContact O-N 2.88Å; I403-V450 HydrophobicContact CB-CG1 4.21Å; I403-V450 HydrophobicContact CG2-CG1 4.41Å; V450-Y527 HydrophobicContact CB-CD1 4.48Å; V450-Y527 HydrophobicContact CG2-CD1 4.09Å; V450-Y527 HydrophobicContact CG2-CE1 3.89Å; V450-L531 HydrophobicContact CB-CD1 4.28Å; V450-L531 HydrophobicContact CG1-CD1 4.14Å; V450-L531 WeakPolarHBondContact O-CD2 3.38Å
451	Q	89.2	Confident	92.7	Very high	132 Å²	132	54.1 Å²	54.1	62%	0.617	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-13.3	174	-55.9	171.9	-16.5	0	0	112.6	E397 N449	E397-Q451 PolarHBondContact O-NE2 3.08Å; E397-Q451 VanDerWaalsContact O-NE2 3.16Å; N449-Q451 PolarHBondContact O-N 3.25Å; N449-Q451 VanDerWaalsContact O-N 3.17Å; N449-Q451 WeakPolarHBondContact OD1-CA 3.31Å; N449-Q451 VanDerWaalsContact OD1-CB 3.24Å; N449-Q451 WeakPolarHBondContact OD1-CB 3.38Å; N449-Q451 PolarHBondContact OD1-N 3.34Å
452	R	90.9	Very high	93.1	Very high	186 Å²	186	49.2 Å²	49.2	70%	0.702	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.9	-17.5	-175.4	-64.8	-173.5	65.4	-175.9	-0.7	114.4	N449 Q454	N449-R452 HydrophobicContact CB-CB 4.35Å; N449-R452 HydrophobicContact CB-CG 4.45Å; N449-R452 PolarHBondContact O-N 3.14Å; R452-Q454 PolarHBondContact O-N 2.92Å; R452-Q454 PolarHBondContact O-NE2 3.36Å
453	I	93.6	Very high	93.3	Very high	15 Å²	15	46.3 Å²	46.3	8%	0.077	22%	0.221	C	C	.	.			trans	-57.5	136.8	175.9	-172.9	169	0	0	0	110.4	I403 F446 C448 N449 Q457 I461 L531	I403-I453 HydrophobicContact CG2-CB 4.49Å; I403-I453 HydrophobicContact CG2-CD1 3.61Å; F446-I453 HydrophobicContact CE1-CD1 4.18Å; C448-I453 HydrophobicContact CB-CB 4.3Å; N449-I453 PolarHBondContact O-N 3.42Å; I453-Q457 HydrophobicContact CD1-CB 4.26Å; I453-Q457 HydrophobicContact CG1-CB 3.9Å; I453-I461 HydrophobicContact CD1-CD1 4.15Å; I453-L531 HydrophobicContact CG2-CD1 4.41Å; I453-L531 HydrophobicContact CG2-CD2 3.6Å
454	Q	90.6	Very high	93.3	Very high	59 Å²	59	45.1 Å²	45.1	28%	0.276	22%	0.216	S	C	.	.			trans	-86.4	145.4	-178.7	-55.3	-63.6	-77.5	0	0	110.6	R452 H456 Q457 T458	R452-Q454 PolarHBondContact O-N 2.92Å; R452-Q454 PolarHBondContact O-NE2 3.36Å; Q454-H456 VanDerWaalsContact C-N 3.32Å; Q454-H456 VanDerWaalsContact CB-CE1 3.47Å; Q454-H456 WeakPolarHBondContact CB-CE1 3.37Å; Q454-H456 PolarHBondContact O-N 2.93Å; Q454-Q457 HydrophobicContact CB-CG 4.09Å; Q454-Q457 WeakPolarHBondContact O-CA 3.48Å; Q454-Q457 WeakPolarHBondContact O-CB 3.49Å; Q454-Q457 PolarHBondContact O-N 3.13Å; Q454-T458 PolarHBondContact O-N 3.16Å; Q454-T458 VanDerWaalsContact O-N 3.13Å
455	P	91.9	Very high	93.4	Very high	33 Å²	33	46.3 Å²	46.3	21%	0.214	22%	0.222	C	C	.	.	H	α-helix	trans	-44.3	-49.4	176.3	-36.9	39.6	0	0	0	115.2	Q457 T458 L459 A535 E538 L937	P455-Q457 VanDerWaalsContact C-N 3.27Å; P455-Q457 PolarHBondContact O-N 2.94Å; P455-T458 WeakPolarHBondContact O-CB 3.39Å; P455-T458 PolarHBondContact O-N 3.05Å; P455-T458 VanDerWaalsContact O-N 3.12Å; P455-L459 PolarHBondContact O-N 3.45Å; P455-A535 HydrophobicContact CB-CB 4.07Å; P455-A535 WeakPolarHBondContact O-CB 3.37Å; P455-E538 HydrophobicContact CB-CB 4.41Å; P455-E538 HydrophobicContact CB-CG 4.44Å; P455-E538 HydrophobicContact CG-CB 4.19Å; P455-E538 HydrophobicContact CG-CG 4.01Å; P455-L937 HydrophobicContact CB-CD1 3.55Å; P455-L937 HydrophobicContact CG-CD1 4.27Å
456	H	89.8	Confident	93.4	Very high	32 Å²	32	44.2 Å²	44.2	15%	0.148	22%	0.218	C	C	.	.	H	α-helix	trans	-65.9	-27.9	-179.5	66	-96.9	0	0	0	113.2	Q454 A460	Q454-H456 VanDerWaalsContact C-N 3.32Å; Q454-H456 VanDerWaalsContact CB-CE1 3.47Å; Q454-H456 WeakPolarHBondContact CB-CE1 3.37Å; Q454-H456 PolarHBondContact O-N 2.93Å; H456-A460 WeakPolarHBondContact O-CB 3.2Å; H456-A460 PolarHBondContact O-N 2.94Å
457	Q	93.7	Very high	93.2	Very high	38 Å²	38	46.3 Å²	46.3	18%	0.178	23%	0.23	C	C	.	.	H	α-helix	trans	-71.2	-41.6	173.3	-62.4	174.3	-46.5	0	0	110.1	Y443 I453 Q454 P455 L459 A460 I461	Y443-Q457 HydrophobicContact CE1-CB 4.16Å; Y443-Q457 HydrophobicContact CE1-CG 4.25Å; I453-Q457 HydrophobicContact CD1-CB 4.26Å; I453-Q457 HydrophobicContact CG1-CB 3.9Å; Q454-Q457 HydrophobicContact CB-CG 4.09Å; Q454-Q457 WeakPolarHBondContact O-CA 3.48Å; Q454-Q457 WeakPolarHBondContact O-CB 3.49Å; Q454-Q457 PolarHBondContact O-N 3.13Å; P455-Q457 VanDerWaalsContact C-N 3.27Å; P455-Q457 PolarHBondContact O-N 2.94Å; Q457-L459 PolarHBondContact O-N 3.25Å; Q457-A460 PolarHBondContact O-N 3.41Å; Q457-I461 VanDerWaalsContact O-CB 3.31Å; Q457-I461 WeakPolarHBondContact O-CB 3.43Å; Q457-I461 WeakPolarHBondContact O-CD1 3.41Å; Q457-I461 WeakPolarHBondContact O-CG1 3.44Å; Q457-I461 PolarHBondContact O-N 2.89Å
458	T	95.4	Very high	93	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.012	24%	0.236	C	C	.	.	H	α-helix	trans	-58.9	-46.6	174.3	-54.9	0	0	0	0	111.4	Q454 P455 I461 N462 L531 A535	Q454-T458 PolarHBondContact O-N 3.16Å; Q454-T458 VanDerWaalsContact O-N 3.13Å; P455-T458 WeakPolarHBondContact O-CB 3.39Å; P455-T458 PolarHBondContact O-N 3.05Å; P455-T458 VanDerWaalsContact O-N 3.12Å; T458-I461 PolarHBondContact O-N 3.43Å; T458-N462 WeakPolarHBondContact O-CB 3.42Å; T458-N462 PolarHBondContact O-N 2.95Å; T458-N462 PolarHBondContact O-OD1 3.34Å; T458-L531 HydrophobicContact CG2-CB 4.05Å; T458-A535 HydrophobicContact CG2-CB 4.04Å
459	L	94.5	Very high	92.9	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-64.3	-44.3	176.8	-65.2	-174.9	0	0	0	112.4	P455 Q457 I461 N462 R463 A535 E536 S539 Y704 V708	P455-L459 PolarHBondContact O-N 3.45Å; Q457-L459 PolarHBondContact O-N 3.25Å; L459-I461 VanDerWaalsContact C-N 3.34Å; L459-I461 PolarHBondContact O-N 3.13Å; L459-N462 PolarHBondContact O-N 3.3Å; L459-R463 WeakPolarHBondContact O-CB 3.19Å; L459-R463 PolarHBondContact O-N 3.01Å; L459-A535 HydrophobicContact CD2-CB 4.14Å; L459-A535 HydrophobicContact CG-CB 4.15Å; L459-E536 HydrophobicContact CD2-CG 4.39Å; L459-S539 VanDerWaalsContact CD1-OG 3.26Å; L459-S539 WeakPolarHBondContact CD1-OG 3.33Å; L459-Y704 HydrophobicContact CB-CD1 4.27Å; L459-Y704 HydrophobicContact CB-CG 4.28Å; L459-Y704 HydrophobicContact CD1-CG 4.45Å; L459-V708 HydrophobicContact CD1-CG1 4.01Å; L459-V708 HydrophobicContact CD2-CG1 4.37Å
460	A	93.3	Very high	92.9	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.008	23%	0.227	C	C	.	.	H	α-helix	trans	-61.1	-41.3	177.1	0	0	0	0	0	112.6	F440 Y443 H456 Q457 R463 G464 Y704	F440-A460 WeakPolarHBondContact CE1-O 3.4Å; Y443-A460 HydrophobicContact CD2-CB 4.28Å; Y443-A460 HydrophobicContact CE2-CB 3.54Å; H456-A460 WeakPolarHBondContact O-CB 3.2Å; H456-A460 PolarHBondContact O-N 2.94Å; Q457-A460 PolarHBondContact O-N 3.41Å; A460-R463 PolarHBondContact O-N 3.34Å; A460-G464 PolarHBondContact O-N 3.37Å; A460-Y704 HydrophobicContact CB-CE1 4.2Å
461	I	95.1	Very high	93	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-67.9	-43	176.8	-70.9	169	0	0	0	110.9	Y443 F446 I453 Q457 T458 L459 R463 G464 E465 V472	Y443-I461 HydrophobicContact CD1-CD1 3.86Å; Y443-I461 HydrophobicContact CD1-CG1 3.58Å; Y443-I461 HydrophobicContact CE1-CD1 4.21Å; Y443-I461 HydrophobicContact CE1-CG1 4.06Å; Y443-I461 HydrophobicContact CG-CG1 4.02Å; F446-I461 HydrophobicContact CD1-CD1 3.59Å; F446-I461 HydrophobicContact CE1-CD1 3.56Å; F446-I461 HydrophobicContact CZ-CD1 4.49Å; I453-I461 HydrophobicContact CD1-CD1 4.15Å; Q457-I461 VanDerWaalsContact O-CB 3.31Å; Q457-I461 WeakPolarHBondContact O-CB 3.43Å; Q457-I461 WeakPolarHBondContact O-CD1 3.41Å; Q457-I461 WeakPolarHBondContact O-CG1 3.44Å; Q457-I461 PolarHBondContact O-N 2.89Å; T458-I461 PolarHBondContact O-N 3.43Å; L459-I461 VanDerWaalsContact C-N 3.34Å; L459-I461 PolarHBondContact O-N 3.13Å; I461-R463 PolarHBondContact O-N 3.07Å; I461-G464 PolarHBondContact O-N 3.06Å; I461-E465 WeakPolarHBondContact O-CB 3.12Å; I461-E465 PolarHBondContact O-N 3.44Å; I461-V472 HydrophobicContact CG2-CB 4.24Å; I461-V472 HydrophobicContact CG2-CG1 3.79Å; I461-V472 HydrophobicContact CG2-CG2 3.33Å
462	N	95.3	Very high	93.3	Very high	30 Å²	30	44.1 Å²	44.1	16%	0.16	21%	0.213	C	C	.	.	H	α-helix	trans	-60.5	-42.7	174.9	-74	0.3	0	0	0	111.9	T458 L459 E465 S466 R528 T532	T458-N462 WeakPolarHBondContact O-CB 3.42Å; T458-N462 PolarHBondContact O-N 2.95Å; T458-N462 PolarHBondContact O-OD1 3.34Å; L459-N462 PolarHBondContact O-N 3.3Å; N462-E465 PolarHBondContact O-N 3.44Å; N462-S466 PolarHBondContact O-N 3.34Å; N462-R528 VanDerWaalsContact OD1-CZ 3.25Å; N462-R528 PolarHBondContact OD1-NH1 3.3Å; N462-R528 PolarHBondContact OD1-NH2 3.41Å; N462-T532 WeakPolarHBondContact ND2-CG2 3.34Å; N462-T532 PolarHBondContact ND2-OG1 2.97Å
463	R	93.9	Very high	93.5	Very high	84 Å²	84	42 Å²	42	32%	0.317	21%	0.209	S	C	.	.	H	α-helix	trans	-65.3	-41	174.9	-175.5	-179.6	-179.1	147.1	-8.4	112.3	F440 L459 A460 I461 E465 S466 L467 D707	F440-R463 HydrophobicContact CE1-CB 4.41Å; F440-R463 HydrophobicContact CE1-CG 4.37Å; F440-R463 HydrophobicContact CZ-CG 4.11Å; L459-R463 WeakPolarHBondContact O-CB 3.19Å; L459-R463 PolarHBondContact O-N 3.01Å; A460-R463 PolarHBondContact O-N 3.34Å; I461-R463 PolarHBondContact O-N 3.07Å; R463-E465 VanDerWaalsContact C-N 3.3Å; R463-E465 PolarHBondContact O-N 3.49Å; R463-S466 PolarHBondContact O-N 3.19Å; R463-S466 PolarHBondContact O-OG 2.86Å; R463-S466 VanDerWaalsContact O-OG 3.05Å; R463-L467 HydrophobicContact CG-CD1 4.08Å; R463-L467 WeakPolarHBondContact O-CB 3.35Å; R463-L467 VanDerWaalsContact O-CG 3.27Å; R463-L467 WeakPolarHBondContact O-CG 3.44Å; R463-L467 PolarHBondContact O-N 3.03Å; R463-D707 VanDerWaalsContact CD-OD1 3.23Å; R463-D707 WeakPolarHBondContact CD-OD1 3.42Å; R463-D707 VanDerWaalsContact CG-OD1 3.22Å; R463-D707 WeakPolarHBondContact CG-OD1 3.31Å; R463-D707 IonicContact CZ-OD2 3.76Å; R463-D707 IonicContact NE-OD1 3.65Å; R463-D707 IonicContact NE-OD2 3.03Å; R463-D707 IonicContact NH1-OD1 2.86Å; R463-D707 IonicContact NH1-OD2 2.92Å; R463-D707 PolarHBondContact NH1-OD2 3.1Å
464	G	93.3	Very high	93.6	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.2	-36.4	174.3	0	0	0	0	0	112.5	A460 I461 K468 I469 L470	A460-G464 PolarHBondContact O-N 3.37Å; I461-G464 PolarHBondContact O-N 3.06Å; G464-K468 PolarHBondContact O-N 2.96Å; G464-I469 WeakPolarHBondContact O-CA 3.48Å; G464-I469 WeakPolarHBondContact O-CB 3.44Å; G464-I469 PolarHBondContact O-N 3.24Å; G464-L470 PolarHBondContact O-N 3.12Å
465	E	94.1	Very high	93.8	Very high	68 Å²	68	43.5 Å²	43.5	32%	0.318	22%	0.22	S	C	.	.	H	α-helix	trans	-70	-44.7	174.7	-175.6	159.7	-114.3	0	0	112.3	I461 N462 R463 L467 K468 V472 R528	I461-E465 WeakPolarHBondContact O-CB 3.12Å; I461-E465 PolarHBondContact O-N 3.44Å; N462-E465 PolarHBondContact O-N 3.44Å; R463-E465 VanDerWaalsContact C-N 3.3Å; R463-E465 PolarHBondContact O-N 3.49Å; E465-L467 VanDerWaalsContact C-N 3.35Å; E465-L467 PolarHBondContact O-N 3.01Å; E465-K468 WeakPolarHBondContact O-CA 3.36Å; E465-K468 PolarHBondContact O-N 3.46Å; E465-V472 HydrophobicContact CB-CG2 3.91Å; E465-V472 VanDerWaalsContact CD-CG2 3.5Å; E465-V472 HydrophobicContact CG-CG2 4.22Å; E465-V472 VanDerWaalsContact OE1-CB 3.27Å; E465-V472 WeakPolarHBondContact OE1-CB 3.4Å; E465-V472 WeakPolarHBondContact OE1-CG2 3.29Å; E465-V472 PolarHBondContact OE1-N 2.96Å; E465-R528 IonicContact OE2-CZ 3.07Å; E465-R528 IonicContact OE2-NH2 3.76Å; E465-R528 PolarHBondContact OE2-NH2 2.88Å
466	S	92.4	Very high	93.9	Very high	85 Å²	85	42.3 Å²	42.3	59%	0.594	21%	0.212	S	C	*	.	H	α-helix	trans	-64.9	-36.6	179.4	70.8	0	0	0	0	112.8	N462 R463 K468	N462-S466 PolarHBondContact O-N 3.34Å; R463-S466 PolarHBondContact O-N 3.19Å; R463-S466 PolarHBondContact O-OG 2.86Å; R463-S466 VanDerWaalsContact O-OG 3.05Å; S466-K468 PolarHBondContact O-N 3.48Å
467	L	91.4	Very high	94.1	Very high	77 Å²	77	42.8 Å²	42.8	40%	0.403	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-0.5	171.8	-65.2	174.9	0	0	0	113.7	F440 R463 E465 I469	F440-L467 HydrophobicContact CE2-CD1 4Å; F440-L467 HydrophobicContact CZ-CD1 3.83Å; R463-L467 HydrophobicContact CG-CD1 4.08Å; R463-L467 WeakPolarHBondContact O-CB 3.35Å; R463-L467 VanDerWaalsContact O-CG 3.27Å; R463-L467 WeakPolarHBondContact O-CG 3.44Å; R463-L467 PolarHBondContact O-N 3.03Å; E465-L467 VanDerWaalsContact C-N 3.35Å; E465-L467 PolarHBondContact O-N 3.01Å; L467-I469 HydrophobicContact CB-CD1 3.91Å; L467-I469 HydrophobicContact CB-CG1 4.04Å; L467-I469 HydrophobicContact CD1-CD1 4.19Å; L467-I469 PolarHBondContact O-N 3.29Å
468	K	92.1	Very high	94.1	Very high	138 Å²	138	47 Å²	47	60%	0.6	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	60	25.1	-176.3	-49.7	178.1	-175.4	174.1	0	113.6	S408 T410 G464 E465 S466	S408-K468 WeakPolarHBondContact CB-O 3.39Å; S408-K468 PolarHBondContact OG-O 2.84Å; T410-K468 PolarHBondContact OG1-O 3.21Å; G464-K468 PolarHBondContact O-N 2.96Å; E465-K468 WeakPolarHBondContact O-CA 3.36Å; E465-K468 PolarHBondContact O-N 3.46Å; S466-K468 PolarHBondContact O-N 3.48Å
469	I	92.3	Very high	94	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.01	27%	0.274	C	S	.	.	S	Bend	trans	-85	-41.1	176.5	-63.9	171.7	0	0	0	110.3	S408 K435 F437 F440 F444 G464 L467	S408-I469 WeakPolarHBondContact CB-O 3.33Å; S408-I469 PolarHBondContact N-O 3.27Å; S408-I469 PolarHBondContact OG-O 3.49Å; K435-I469 HydrophobicContact CB-CD1 4.46Å; K435-I469 HydrophobicContact CD-CG1 4.44Å; F437-I469 HydrophobicContact CD1-CG1 4.34Å; F437-I469 HydrophobicContact CD1-CG2 3.85Å; F437-I469 HydrophobicContact CE1-CB 4.48Å; F437-I469 HydrophobicContact CE1-CG1 4.01Å; F437-I469 HydrophobicContact CE1-CG2 4.05Å; F440-I469 HydrophobicContact CB-CG2 4.21Å; F440-I469 HydrophobicContact CD2-CD1 3.67Å; F440-I469 HydrophobicContact CD2-CG2 4.27Å; F440-I469 HydrophobicContact CE2-CD1 3.65Å; F440-I469 HydrophobicContact CG-CG2 4.34Å; F444-I469 HydrophobicContact CE1-CG2 4.19Å; G464-I469 WeakPolarHBondContact O-CA 3.48Å; G464-I469 WeakPolarHBondContact O-CB 3.44Å; G464-I469 PolarHBondContact O-N 3.24Å; L467-I469 HydrophobicContact CB-CD1 3.91Å; L467-I469 HydrophobicContact CB-CG1 4.04Å; L467-I469 HydrophobicContact CD1-CD1 4.19Å; L467-I469 PolarHBondContact O-N 3.29Å
470	L	94.8	Very high	94	Very high	3 Å²	3	56 Å²	56	2%	0.016	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	166.9	179.9	-56.9	179.7	0	0	0	111.9	S406 F440 F444 G464	S406-L470 CarbonylContact O-C 3.53Å; S406-L470 VanDerWaalsContact O-CA 3.32Å; S406-L470 WeakPolarHBondContact O-CA 3.37Å; F440-L470 HydrophobicContact CD1-CD1 4.43Å; F444-L470 HydrophobicContact CD1-CD2 3.92Å; F444-L470 HydrophobicContact CE1-CD2 4.43Å; G464-L470 PolarHBondContact O-N 3.12Å
471	T	95	Very high	94.1	Very high	55 Å²	55	58.1 Å²	58.1	34%	0.337	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	129.3	166.3	-64.1	0	0	0	0	107.7	S405 S406 S408	S405-T471 WeakPolarHBondContact CA-O 3.44Å; S406-T471 PolarHBondContact N-O 2.86Å; S406-T471 PolarHBondContact O-N 2.83Å; S408-T471 WeakPolarHBondContact CB-OG1 3.21Å
472	V	95.6	Very high	94.1	Very high	16 Å²	16	61 Å²	61	10%	0.097	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	138.3	-169.8	-169	0	0	0	0	110.6	I403 Q404 I461 E465	I403-V472 HydrophobicContact CD1-CG1 3.78Å; I403-V472 HydrophobicContact CG1-CG1 3.76Å; Q404-V472 WeakPolarHBondContact O-CA 3.43Å; I461-V472 HydrophobicContact CG2-CB 4.24Å; I461-V472 HydrophobicContact CG2-CG1 3.79Å; I461-V472 HydrophobicContact CG2-CG2 3.33Å; E465-V472 HydrophobicContact CB-CG2 3.91Å; E465-V472 VanDerWaalsContact CD-CG2 3.5Å; E465-V472 HydrophobicContact CG-CG2 4.22Å; E465-V472 VanDerWaalsContact OE1-CB 3.27Å; E465-V472 WeakPolarHBondContact OE1-CB 3.4Å; E465-V472 WeakPolarHBondContact OE1-CG2 3.29Å; E465-V472 PolarHBondContact OE1-N 2.96Å
473	K	95.1	Very high	94.1	Very high	143 Å²	143	61.3 Å²	61.3	62%	0.622	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.7	143	177.3	-64.2	-176.7	-178.4	177.8	0	110.7	I403 Q404	I403-K473 WeakPolarHBondContact CA-O 3.37Å; Q404-K473 PolarHBondContact N-O 3.47Å; Q404-K473 PolarHBondContact O-N 3.28Å
474	V	96	Very high	94.2	Very high	14 Å²	14	57.3 Å²	57.3	9%	0.085	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	131.1	162.9	-176.3	0	0	0	0	107.2	V401 T402 T524 Y527 R528	V401-V474 HydrophobicContact CG1-CG1 3.6Å; T402-V474 CarbonylContact O-C 3.56Å; T402-V474 WeakPolarHBondContact O-CA 3.47Å; V474-T524 HydrophobicContact CB-CG2 4.17Å; V474-T524 HydrophobicContact CG2-CG2 4.41Å; V474-Y527 HydrophobicContact CG1-CD2 4.25Å; V474-Y527 HydrophobicContact CG1-CG 4.36Å; V474-R528 HydrophobicContact CG2-CG 3.89Å
475	N	95.1	Very high	94.3	Very high	91 Å²	91	58.5 Å²	58.5	49%	0.487	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	121.3	178.2	-168.8	13.2	0	0	0	109.6	T402	T402-N475 PolarHBondContact N-O 3.16Å; T402-N475 VanDerWaalsContact N-O 3.08Å; T402-N475 PolarHBondContact O-N 3.28Å
476	I	94.9	Very high	94.4	Very high	8 Å²	8	61.6 Å²	61.6	4%	0.041	31%	0.307	C	S	.	.			trans	-104.3	122.8	176.6	-57.7	-174.8	0	0	0	107.1	V401 V480 L520 L523 Y527	V401-I476 HydrophobicContact CG1-CG1 4.26Å; I476-V480 HydrophobicContact CG2-CB 3.86Å; I476-V480 HydrophobicContact CG2-CG1 3.94Å; I476-V480 HydrophobicContact CG2-CG2 3.99Å; I476-L520 HydrophobicContact CB-CD1 4.27Å; I476-L520 HydrophobicContact CD1-CD1 3.84Å; I476-L520 HydrophobicContact CG1-CD1 4.17Å; I476-L523 HydrophobicContact CD1-CB 3.71Å; I476-L523 HydrophobicContact CD1-CD1 3.92Å; I476-L523 HydrophobicContact CD1-CG 4.48Å; I476-Y527 HydrophobicContact CD1-CE2 4.49Å
477	P	93.6	Very high	94.6	Very high	42 Å²	42	59.6 Å²	59.6	27%	0.273	29%	0.287	S	S	.	.			trans	-58.6	140.4	-174.7	-25.7	34	0	0	0	113.7	R479 V480	P477-R479 PolarHBondContact O-N 3.27Å; P477-V480 WeakPolarHBondContact O-CB 2.93Å; P477-V480 PolarHBondContact O-N 3.49Å
478	D	92.6	Very high	94.8	Very high	126 Å²	126	56 Å²	56	67%	0.674	27%	0.268	S	S	*	.	H	α-helix	trans	-56.6	-24.4	179.3	-73	-49.1	0	0	0	114	V480 K481 S482	D478-V480 VanDerWaalsContact C-N 3.29Å; D478-V480 PolarHBondContact O-N 2.84Å; D478-K481 WeakPolarHBondContact O-CB 3.44Å; D478-K481 PolarHBondContact O-N 3.02Å; D478-S482 PolarHBondContact O-N 3.2Å; D478-S482 PolarHBondContact O-OG 3.41Å
479	R	93.9	Very high	94.9	Very high	188 Å²	188	50.3 Å²	50.3	71%	0.709	24%	0.244	S	C	*	.	H	α-helix	trans	-58.8	-39.5	171.9	-178.9	175.5	176	174.8	3.3	112.4	P477 K481 S482 D483	P477-R479 PolarHBondContact O-N 3.27Å; R479-K481 VanDerWaalsContact C-N 3.29Å; R479-K481 PolarHBondContact O-N 2.88Å; R479-S482 PolarHBondContact O-N 2.76Å; R479-D483 VanDerWaalsContact CG-OD2 3.31Å; R479-D483 WeakPolarHBondContact CG-OD2 3.25Å; R479-D483 IonicContact CZ-OD2 3.78Å; R479-D483 IonicContact NE-OD2 3.02Å; R479-D483 PolarHBondContact NE-OD2 2.66Å; R479-D483 VanDerWaalsContact NE-OD2 3.09Å; R479-D483 IonicContact NH2-OD2 3.47Å; R479-D483 WeakPolarHBondContact O-CB 3.5Å; R479-D483 PolarHBondContact O-N 3.12Å
480	V	94.5	Very high	94.9	Very high	6 Å²	6	54.4 Å²	54.4	4%	0.036	27%	0.266	C	S	.	.	H	α-helix	trans	-59.7	-44.9	177.2	176.3	0	0	0	0	109.9	I392 L395 S399 I476 P477 D478 F484	I392-V480 HydrophobicContact CG1-CG1 4.36Å; L395-V480 HydrophobicContact CB-CG1 4.07Å; S399-V480 WeakPolarHBondContact OG-CG2 3.25Å; I476-V480 HydrophobicContact CG2-CB 3.86Å; I476-V480 HydrophobicContact CG2-CG1 3.94Å; I476-V480 HydrophobicContact CG2-CG2 3.99Å; P477-V480 WeakPolarHBondContact O-CB 2.93Å; P477-V480 PolarHBondContact O-N 3.49Å; D478-V480 VanDerWaalsContact C-N 3.29Å; D478-V480 PolarHBondContact O-N 2.84Å; V480-F484 WeakPolarHBondContact O-CB 3.41Å; V480-F484 PolarHBondContact O-N 2.7Å
481	K	95.1	Very high	94.8	Very high	44 Å²	44	59.1 Å²	59.1	19%	0.191	29%	0.291	C	S	.	.	H	α-helix	trans	-60.1	-50.1	174.9	-179.3	-174.2	175.5	-129.2	0	111.7	D478 R479 D483 F484 T485 E512 Y515	D478-K481 WeakPolarHBondContact O-CB 3.44Å; D478-K481 PolarHBondContact O-N 3.02Å; R479-K481 VanDerWaalsContact C-N 3.29Å; R479-K481 PolarHBondContact O-N 2.88Å; K481-D483 PolarHBondContact O-N 2.69Å; K481-F484 PolarHBondContact O-N 2.91Å; K481-T485 WeakPolarHBondContact O-CB 3.32Å; K481-T485 PolarHBondContact O-N 3.49Å; K481-T485 PolarHBondContact O-OG1 2.91Å; K481-T485 VanDerWaalsContact O-OG1 3.1Å; K481-E512 VanDerWaalsContact CE-CD 3.42Å; K481-E512 VanDerWaalsContact CE-OE1 3.25Å; K481-E512 WeakPolarHBondContact CE-OE1 3.4Å; K481-E512 WeakPolarHBondContact CE-OE2 3.42Å; K481-E512 VanDerWaalsContact NZ-CD 3.32Å; K481-E512 IonicContact NZ-OE1 3.51Å; K481-E512 PolarHBondContact NZ-OE1 3.44Å; K481-E512 IonicContact NZ-OE2 2.73Å; K481-E512 PolarHBondContact NZ-OE2 3.08Å; K481-E512 VanDerWaalsContact NZ-OE2 3.13Å; K481-Y515 HydrophobicContact CB-CD1 4.18Å; K481-Y515 HydrophobicContact CB-CE1 3.66Å; K481-Y515 HydrophobicContact CB-CE2 4.06Å; K481-Y515 HydrophobicContact CD-CD1 3.87Å; K481-Y515 HydrophobicContact CD-CE1 3.79Å; K481-Y515 HydrophobicContact CG-CD1 3.63Å; K481-Y515 HydrophobicContact CG-CD2 4.41Å; K481-Y515 HydrophobicContact CG-CE1 3.6Å; K481-Y515 HydrophobicContact CG-CE2 4.38Å; K481-Y515 HydrophobicContact CG-CG 4.05Å
482	S	95	Very high	94.7	Very high	62 Å²	62	60.9 Å²	60.9	43%	0.434	29%	0.292	S	S	.	.	H	α-helix	trans	-61.4	-43.1	-179.7	-65.4	0	0	0	0	112.9	D478 R479 R486	D478-S482 PolarHBondContact O-N 3.2Å; D478-S482 PolarHBondContact O-OG 3.41Å; R479-S482 PolarHBondContact O-N 2.76Å; S482-R486 WeakPolarHBondContact O-CB 3.34Å; S482-R486 PolarHBondContact O-N 3.37Å; S482-R486 VanDerWaalsContact O-N 3.09Å
483	D	95.3	Very high	94.6	Very high	35 Å²	35	61.3 Å²	61.3	19%	0.187	29%	0.291	C	S	.	.	H	α-helix	trans	-73.5	-36.3	-179.8	-67.3	-17.7	0	0	0	111.1	L395 R479 K481 R486 W487	L395-D483 HydrophobicContact CD1-CB 4.18Å; R479-D483 VanDerWaalsContact CG-OD2 3.31Å; R479-D483 WeakPolarHBondContact CG-OD2 3.25Å; R479-D483 IonicContact CZ-OD2 3.78Å; R479-D483 IonicContact NE-OD2 3.02Å; R479-D483 PolarHBondContact NE-OD2 2.66Å; R479-D483 VanDerWaalsContact NE-OD2 3.09Å; R479-D483 IonicContact NH2-OD2 3.47Å; R479-D483 WeakPolarHBondContact O-CB 3.5Å; R479-D483 PolarHBondContact O-N 3.12Å; K481-D483 PolarHBondContact O-N 2.69Å; D483-R486 IonicContact OD1-CZ 3.41Å; D483-R486 IonicContact OD1-NH1 3.74Å; D483-R486 PolarHBondContact OD1-NH1 3.12Å; D483-R486 IonicContact OD1-NH2 2.93Å; D483-W487 WeakPolarHBondContact O-CB 3.41Å; D483-W487 PolarHBondContact O-N 2.73Å
484	F	96.1	Very high	94.5	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.9	-54.1	169.9	171.4	-97.6	0	0	0	112.4	I382 T388 I392 L395 V480 K481 R486 W487 C488 V511 Y515 I519	I382-F484 HydrophobicContact CG2-CZ 4.24Å; T388-F484 HydrophobicContact CG2-CE2 3.49Å; T388-F484 VanDerWaalsContact CG2-CE2 3.49Å; T388-F484 HydrophobicContact CG2-CZ 3.73Å; I392-F484 HydrophobicContact CB-CD2 3.7Å; I392-F484 HydrophobicContact CB-CE2 3.95Å; I392-F484 HydrophobicContact CD1-CB 4.19Å; I392-F484 HydrophobicContact CD1-CD1 4.24Å; I392-F484 HydrophobicContact CD1-CD2 3.36Å; I392-F484 HydrophobicContact CD1-CE2 3.68Å; I392-F484 HydrophobicContact CD1-CG 3.66Å; I392-F484 HydrophobicContact CD1-CZ 4.27Å; I392-F484 HydrophobicContact CG1-CD2 3.79Å; I392-F484 HydrophobicContact CG1-CE2 4.3Å; I392-F484 HydrophobicContact CG1-CG 4.34Å; L395-F484 HydrophobicContact CD1-CB 4.09Å; V480-F484 WeakPolarHBondContact O-CB 3.41Å; V480-F484 PolarHBondContact O-N 2.7Å; K481-F484 PolarHBondContact O-N 2.91Å; F484-R486 VanDerWaalsContact C-N 3.33Å; F484-R486 PolarHBondContact O-N 2.91Å; F484-W487 PolarHBondContact O-N 3.14Å; F484-C488 VanDerWaalsContact CE2-SG 3.58Å; F484-C488 WeakPolarHBondContact CZ-SG 3.45Å; F484-C488 PolarHBondContact O-N 2.79Å; F484-C488 PolarHBondContact O-SG 3.39Å; F484-V511 HydrophobicContact CE1-CG1 4.14Å; F484-Y515 AromaticContact CD1-CD2 3.67Å; F484-Y515 HydrophobicContact CD1-CD2 3.67Å; F484-Y515 HydrophobicContact CD1-CG 4.33Å; F484-Y515 HydrophobicContact CE1-CD2 4.05Å; F484-Y515 HydrophobicContact CG-CD2 4.2Å; F484-I519 HydrophobicContact CE1-CD1 4.1Å; F484-I519 HydrophobicContact CE2-CD1 4.06Å; F484-I519 HydrophobicContact CZ-CD1 3.41Å; F484-I519 VanDerWaalsContact CZ-CD1 3.41Å
485	T	95.8	Very high	94.2	Very high	25 Å²	25	62.5 Å²	62.5	15%	0.153	29%	0.292	C	S	.	.	H	α-helix	trans	-61	-43.8	-177.4	-66.8	0	0	0	0	110.6	K481 W487 C488 I489 V511	K481-T485 WeakPolarHBondContact O-CB 3.32Å; K481-T485 PolarHBondContact O-N 3.49Å; K481-T485 PolarHBondContact O-OG1 2.91Å; K481-T485 VanDerWaalsContact O-OG1 3.1Å; T485-W487 PolarHBondContact O-N 3.5Å; T485-C488 PolarHBondContact O-N 3.01Å; T485-I489 HydrophobicContact CG2-CD1 3.57Å; T485-I489 WeakPolarHBondContact O-CD1 3.35Å; T485-I489 VanDerWaalsContact O-CG1 3.26Å; T485-I489 WeakPolarHBondContact O-CG1 3.36Å; T485-I489 PolarHBondContact O-N 2.87Å; T485-I489 VanDerWaalsContact O-N 3.08Å; T485-V511 HydrophobicContact CG2-CG1 3.83Å
486	R	95.7	Very high	93.9	Very high	134 Å²	134	65.8 Å²	65.8	51%	0.506	30%	0.302	S	S	.	.	H	α-helix	trans	-61.1	-43.9	175.7	-168.2	-175.7	-55.5	105.6	2.4	112.5	S482 D483 F484 N490	S482-R486 WeakPolarHBondContact O-CB 3.34Å; S482-R486 PolarHBondContact O-N 3.37Å; S482-R486 VanDerWaalsContact O-N 3.09Å; D483-R486 IonicContact OD1-CZ 3.41Å; D483-R486 IonicContact OD1-NH1 3.74Å; D483-R486 PolarHBondContact OD1-NH1 3.12Å; D483-R486 IonicContact OD1-NH2 2.93Å; F484-R486 VanDerWaalsContact C-N 3.33Å; F484-R486 PolarHBondContact O-N 2.91Å; R486-N490 VanDerWaalsContact O-CB 3.29Å; R486-N490 WeakPolarHBondContact O-CB 3.13Å; R486-N490 PolarHBondContact O-N 3.01Å
487	W	96.5	Very high	93.5	Very high	43 Å²	43	68.3 Å²	68.3	16%	0.163	32%	0.318	C	S	.	.	H	α-helix	trans	-66.9	-39.9	178.8	176	94	0	0	0	112.5	E387 T388 Y391 D483 F484 T485 N491 R492	E387-W487 HydrophobicContact CB-CH2 4.5Å; T388-W487 HydrophobicContact CG2-CZ3 4.42Å; Y391-W487 HydrophobicContact CD1-CB 4.15Å; Y391-W487 AromaticContact CD1-CD2 3.41Å; Y391-W487 HydrophobicContact CD1-CD2 3.41Å; Y391-W487 VanDerWaalsContact CD1-CD2 3.41Å; Y391-W487 AromaticContact CD1-CE2 3.92Å; Y391-W487 AromaticContact CD1-CE3 3.48Å; Y391-W487 HydrophobicContact CD1-CE3 3.48Å; Y391-W487 VanDerWaalsContact CD1-CE3 3.48Å; Y391-W487 AromaticContact CD1-CG 3.73Å; Y391-W487 HydrophobicContact CD1-CG 3.73Å; Y391-W487 HydrophobicContact CD1-CH2 4.47Å; Y391-W487 HydrophobicContact CD1-CZ2 4.42Å; Y391-W487 HydrophobicContact CD1-CZ3 4.04Å; Y391-W487 HydrophobicContact CD2-CD2 4.13Å; Y391-W487 AromaticContact CD2-CE2 3.8Å; Y391-W487 HydrophobicContact CD2-CG 4.32Å; Y391-W487 HydrophobicContact CD2-CZ2 4.2Å; Y391-W487 AromaticContact CD2-NE1 3.8Å; Y391-W487 HydrophobicContact CE1-CB 3.34Å; Y391-W487 AromaticContact CE1-CD1 3.78Å; Y391-W487 AromaticContact CE1-CD2 3.53Å; Y391-W487 HydrophobicContact CE1-CD2 3.53Å; Y391-W487 AromaticContact CE1-CE3 3.94Å; Y391-W487 HydrophobicContact CE1-CE3 3.94Å; Y391-W487 AromaticContact CE1-CG 3.26Å; Y391-W487 HydrophobicContact CE1-CG 3.26Å; Y391-W487 AromaticContact CE2-CD1 3.56Å; Y391-W487 HydrophobicContact CE2-CD2 4.23Å; Y391-W487 AromaticContact CE2-CG 3.93Å; Y391-W487 HydrophobicContact CE2-CG 3.93Å; Y391-W487 AromaticContact CE2-NE1 3.7Å; Y391-W487 AromaticContact CG-CD2 3.73Å; Y391-W487 HydrophobicContact CG-CD2 3.73Å; Y391-W487 AromaticContact CG-CE2 3.7Å; Y391-W487 AromaticContact CG-CE3 3.97Å; Y391-W487 HydrophobicContact CG-CE3 3.97Å; Y391-W487 HydrophobicContact CG-CG 4.23Å; Y391-W487 HydrophobicContact CG-CH2 4.16Å; Y391-W487 AromaticContact CG-CZ2 3.94Å; Y391-W487 HydrophobicContact CG-CZ2 3.94Å; Y391-W487 HydrophobicContact CG-CZ3 4.19Å; Y391-W487 AromaticContact CZ-CD1 3.39Å; Y391-W487 AromaticContact CZ-CD2 3.95Å; Y391-W487 AromaticContact CZ-CG 3.38Å; Y391-W487 AromaticContact CZ-NE1 3.98Å; D483-W487 WeakPolarHBondContact O-CB 3.41Å; D483-W487 PolarHBondContact O-N 2.73Å; F484-W487 PolarHBondContact O-N 3.14Å; T485-W487 PolarHBondContact O-N 3.5Å; W487-N491 WeakPolarHBondContact O-CA 3.4Å; W487-N491 VanDerWaalsContact O-CB 3.3Å; W487-N491 WeakPolarHBondContact O-CB 3.31Å; W487-N491 PolarHBondContact O-N 3.43Å; W487-R492 HydrophobicContact CE3-CB 4.16Å; W487-R492 HydrophobicContact CH2-CB 3.44Å; W487-R492 VanDerWaalsContact CH2-CB 3.44Å; W487-R492 HydrophobicContact CH2-CG 3.79Å; W487-R492 HydrophobicContact CZ2-CB 3.96Å; W487-R492 HydrophobicContact CZ3-CB 3.54Å; W487-R492 HydrophobicContact CZ3-CG 4.02Å; W487-R492 PolarHBondContact O-N 3.16Å
488	C	95.8	Very high	93.2	Very high	0 Å²	0	74.7 Å²	74.7	0%	0	34%	0.342	C	S	.	.	I	π-helix	trans	-60	-53	176.1	-68.3	0	0	0	0	110.7	F484 T485 N490 W493 V511	F484-C488 VanDerWaalsContact CE2-SG 3.58Å; F484-C488 WeakPolarHBondContact CZ-SG 3.45Å; F484-C488 PolarHBondContact O-N 2.79Å; F484-C488 PolarHBondContact O-SG 3.39Å; T485-C488 PolarHBondContact O-N 3.01Å; C488-N490 PolarHBondContact O-N 3.22Å; C488-W493 WeakPolarHBondContact O-CA 3.1Å; C488-W493 WeakPolarHBondContact O-CB 3.35Å; C488-W493 PolarHBondContact O-N 3Å; C488-V511 HydrophobicContact CB-CG1 3.79Å; C488-V511 HydrophobicContact CB-CG2 3.94Å
489	I	93.8	Very high	92.8	Very high	19 Å²	19	69.4 Å²	69.4	10%	0.097	32%	0.316	C	S	.	.	I	π-helix	trans	-65.7	-40.4	-175.4	-63.3	160.6	0	0	0	112	T485 R494 R508 V511	T485-I489 HydrophobicContact CG2-CD1 3.57Å; T485-I489 WeakPolarHBondContact O-CD1 3.35Å; T485-I489 VanDerWaalsContact O-CG1 3.26Å; T485-I489 WeakPolarHBondContact O-CG1 3.36Å; T485-I489 PolarHBondContact O-N 2.87Å; T485-I489 VanDerWaalsContact O-N 3.08Å; I489-R494 WeakPolarHBondContact O-CA 3.32Å; I489-R494 WeakPolarHBondContact O-CB 3.28Å; I489-R508 HydrophobicContact CD1-CG 3.87Å; I489-R508 HydrophobicContact CG1-CG 4.47Å; I489-V511 HydrophobicContact CG1-CG2 4.19Å
490	N	92.6	Very high	92.5	Very high	88 Å²	88	67.9 Å²	67.9	47%	0.471	31%	0.31	S	S	.	.	I	π-helix	trans	-90.8	-23.3	-171.7	-66.5	-5.2	0	0	0	114.1	R486 C488 R494	R486-N490 VanDerWaalsContact O-CB 3.29Å; R486-N490 WeakPolarHBondContact O-CB 3.13Å; R486-N490 PolarHBondContact O-N 3.01Å; C488-N490 PolarHBondContact O-N 3.22Å; N490-R494 VanDerWaalsContact O-CD 3.28Å; N490-R494 WeakPolarHBondContact O-CD 3.25Å
491	N	92.5	Very high	92.2	Very high	102 Å²	102	73.3 Å²	73.3	55%	0.545	34%	0.335	S	S	.	.	I	π-helix	trans	-120.2	-78.8	-174.5	-50.8	-47.3	0	0	0	111.9	W487	W487-N491 WeakPolarHBondContact O-CA 3.4Å; W487-N491 VanDerWaalsContact O-CB 3.3Å; W487-N491 WeakPolarHBondContact O-CB 3.31Å; W487-N491 PolarHBondContact O-N 3.43Å
492	R	93.2	Very high	91.8	Very high	93 Å²	93	77.6 Å²	77.6	35%	0.351	36%	0.356	S	S	.	.	I	π-helix	trans	-69.8	-40.2	-165.6	179.2	62.5	-177.8	164.9	6.9	114.2	D385 E387 W487	D385-R492 IonicContact OD1-CZ 3.37Å; D385-R492 IonicContact OD1-NE 3.76Å; D385-R492 PolarHBondContact OD1-NE 3.41Å; D385-R492 IonicContact OD1-NH2 2.57Å; D385-R492 PolarHBondContact OD1-NH2 3.4Å; D385-R492 IonicContact OD2-CZ 2.77Å; D385-R492 IonicContact OD2-NE 3.17Å; D385-R492 PolarHBondContact OD2-NE 3.46Å; D385-R492 IonicContact OD2-NH2 3.68Å; E387-R492 IonicContact OE1-CZ 2.87Å; E387-R492 IonicContact OE1-NH1 2.77Å; E387-R492 PolarHBondContact OE1-NH1 3.32Å; E387-R492 IonicContact OE1-NH2 2.7Å; E387-R492 VanDerWaalsContact OE2-CD 3.28Å; E387-R492 WeakPolarHBondContact OE2-CD 3.39Å; E387-R492 IonicContact OE2-CZ 3.79Å; E387-R492 VanDerWaalsContact OE2-CZ 3.27Å; E387-R492 IonicContact OE2-NE 2.75Å; E387-R492 PolarHBondContact OE2-NE 3.37Å; E387-R492 IonicContact OE2-NH1 3.79Å; E387-R492 PolarHBondContact OE2-NH1 3.24Å; W487-R492 HydrophobicContact CE3-CB 4.16Å; W487-R492 HydrophobicContact CH2-CB 3.44Å; W487-R492 VanDerWaalsContact CH2-CB 3.44Å; W487-R492 HydrophobicContact CH2-CG 3.79Å; W487-R492 HydrophobicContact CZ2-CB 3.96Å; W487-R492 HydrophobicContact CZ3-CB 3.54Å; W487-R492 HydrophobicContact CZ3-CG 4.02Å; W487-R492 PolarHBondContact O-N 3.16Å
493	W	94.1	Very high	91.6	Very high	24 Å²	24	74.9 Å²	74.9	9%	0.091	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	14.4	-174.7	-63.6	96.6	0	0	0	112.6	L345 M381 I382 D385 T388 C488 L507	L345-W493 HydrophobicContact CD1-CE3 3.93Å; L345-W493 HydrophobicContact CD1-CZ3 3.88Å; L345-W493 HydrophobicContact CD2-CE3 4.31Å; M381-W493 HydrophobicContact CB-CH2 3.73Å; M381-W493 HydrophobicContact CB-CZ3 4.04Å; M381-W493 HydrophobicContact CE-CZ3 4.22Å; I382-W493 VanDerWaalsContact CA-CZ2 3.47Å; I382-W493 HydrophobicContact CB-CZ2 4.27Å; I382-W493 HydrophobicContact CG1-CD2 3.56Å; I382-W493 HydrophobicContact CG1-CE3 4.03Å; I382-W493 HydrophobicContact CG1-CG 3.89Å; I382-W493 HydrophobicContact CG1-CH2 4.41Å; I382-W493 HydrophobicContact CG1-CZ2 3.97Å; I382-W493 HydrophobicContact CG1-CZ3 4.42Å; D385-W493 HydrophobicContact CB-CH2 4.39Å; D385-W493 HydrophobicContact CB-CZ2 3.59Å; T388-W493 PolarHBondContact OG1-NE1 3.03Å; C488-W493 WeakPolarHBondContact O-CA 3.1Å; C488-W493 WeakPolarHBondContact O-CB 3.35Å; C488-W493 PolarHBondContact O-N 3Å; W493-L507 HydrophobicContact CB-CD1 4.29Å; W493-L507 WeakPolarHBondContact O-CD2 3.21Å
494	R	92.1	Very high	91.3	Very high	170 Å²	170	75.7 Å²	75.7	64%	0.642	34%	0.338	S	S	*	.			trans	-63.7	129.6	175.5	-176	176.5	168.3	177.3	-1.2	109.6	I489 N490	I489-R494 WeakPolarHBondContact O-CA 3.32Å; I489-R494 WeakPolarHBondContact O-CB 3.28Å; N490-R494 VanDerWaalsContact O-CD 3.28Å; N490-R494 WeakPolarHBondContact O-CD 3.25Å
495	P	91.1	Very high	91.2	Very high	13 Å²	13	77 Å²	77	8%	0.084	35%	0.349	C	S	.	.			trans	-59.6	142.5	173.3	-23.7	34.9	0	0	0	111.5	L345 P348 T497 A499 L507	L345-P495 WeakPolarHBondContact O-CA 3.21Å; P348-P495 HydrophobicContact CG-CB 3.92Å; P495-T497 PolarHBondContact O-N 3.28Å; P495-A499 HydrophobicContact CB-CB 4.41Å; P495-A499 HydrophobicContact CG-CB 4.19Å; P495-L507 HydrophobicContact CG-CD2 4.04Å
496	K	88	Confident	91.1	Very high	160 Å²	160	76.2 Å²	76.2	70%	0.696	34%	0.344	S	S	*	.	S	Bend	trans	-63.6	-25.9	-176.2	-70.2	179.8	178.8	166	0	113.6	L345 N346	L345-K496 PolarHBondContact O-N 2.91Å; N346-K496 WeakPolarHBondContact OD1-CE 3.08Å; N346-K496 PolarHBondContact OD1-NZ 2.94Å
497	T	87.2	Confident	91	Very high	61 Å²	61	69.8 Å²	69.8	37%	0.374	32%	0.32	S	S	.	.	S	Bend	trans	-130	177.3	-178.9	55.6	0	0	0	0	110.2	P348 Q349 P495 A499	P348-T497 VanDerWaalsContact CD-OG1 3.22Å; P348-T497 WeakPolarHBondContact CD-OG1 3.15Å; P348-T497 WeakPolarHBondContact CG-OG1 3.46Å; Q349-T497 PolarHBondContact OE1-OG1 3.01Å; P495-T497 PolarHBondContact O-N 3.28Å; T497-A499 PolarHBondContact O-N 3.03Å
498	F	86.4	Confident	90.9	Very high	176 Å²	176	71.8 Å²	71.8	77%	0.772	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-63.9	123.6	178.7	-178.1	-96.9	0	0	0	111.9
499	A	84.7	Confident	91	Very high	15 Å²	15	75.6 Å²	75.6	12%	0.124	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-101.6	140.5	173.1	0	0	0	0	0	110.6	P348 P495 T497 L503	P348-A499 HydrophobicContact CB-CB 3.72Å; P348-A499 HydrophobicContact CG-CB 3.92Å; P495-A499 HydrophobicContact CB-CB 4.41Å; P495-A499 HydrophobicContact CG-CB 4.19Å; T497-A499 PolarHBondContact O-N 3.03Å; A499-L503 HydrophobicContact CB-CB 4.4Å
500	R	87.3	Confident	91.1	Very high	155 Å²	155	74.7 Å²	74.7	59%	0.585	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-65	154.7	171.6	-61.8	-177.9	-176.2	-178.9	2.1	110.5	E502 L503 H504	R500-E502 VanDerWaalsContact C-N 3.25Å; R500-E502 PolarHBondContact O-N 3.45Å; R500-L503 PolarHBondContact O-N 2.7Å; R500-H504 PolarHBondContact O-N 3.03Å
501	E	87.9	Confident	91.3	Very high	120 Å²	120	70.5 Å²	70.5	56%	0.561	32%	0.321	S	S	*	.	H	α-helix	trans	-57.4	-36.1	-175.2	-171	54.9	-148.1	0	0	113.3	H504 A505 R508	E501-H504 PolarHBondContact O-N 3.13Å; E501-A505 WeakPolarHBondContact O-CB 3.2Å; E501-A505 PolarHBondContact O-N 3.25Å; E501-R508 IonicContact OE1-CZ 3.4Å; E501-R508 IonicContact OE1-NH1 2.69Å; E501-R508 PolarHBondContact OE1-NH1 2.97Å; E501-R508 IonicContact OE1-NH2 2.95Å; E501-R508 PolarHBondContact OE1-NH2 2.75Å; E501-R508 IonicContact OE2-NH1 3.22Å
502	E	87.8	Confident	91.4	Very high	135 Å²	135	68 Å²	68	63%	0.631	31%	0.306	S	S	*	.	H	α-helix	trans	-59.3	-49.5	173.2	-65.2	163.2	-164.2	0	0	112.5	R500 H504 A505 I506	R500-E502 VanDerWaalsContact C-N 3.25Å; R500-E502 PolarHBondContact O-N 3.45Å; E502-H504 VanDerWaalsContact C-N 3.28Å; E502-H504 PolarHBondContact O-N 2.95Å; E502-A505 WeakPolarHBondContact O-CB 3.39Å; E502-A505 PolarHBondContact O-N 3.26Å; E502-I506 PolarHBondContact O-N 3.19Å
503	L	89.2	Confident	91.5	Very high	4 Å²	4	64.9 Å²	64.9	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-68	-32	176.9	-60.4	-179.1	0	0	0	111.3	L344 P348 L351 L353 A499 R500 I506 L507	L344-L503 HydrophobicContact CD1-CB 4.25Å; L344-L503 HydrophobicContact CD1-CD2 4.35Å; L344-L503 HydrophobicContact CG-CB 4.49Å; P348-L503 HydrophobicContact CB-CD1 3.98Å; P348-L503 VanDerWaalsContact O-CD1 3.26Å; P348-L503 WeakPolarHBondContact O-CD1 3.3Å; L351-L503 HydrophobicContact CB-CD1 4.25Å; L351-L503 HydrophobicContact CD2-CD1 4.43Å; L351-L503 HydrophobicContact CD2-CD2 4.02Å; L351-L503 HydrophobicContact CG-CD2 4.38Å; L353-L503 HydrophobicContact CD1-CD2 4.08Å; L353-L503 HydrophobicContact CD2-CD2 3.81Å; L353-L503 HydrophobicContact CG-CD2 3.91Å; A499-L503 HydrophobicContact CB-CB 4.4Å; R500-L503 PolarHBondContact O-N 2.7Å; L503-I506 HydrophobicContact CD2-CD1 4.31Å; L503-I506 PolarHBondContact O-N 3.17Å; L503-L507 PolarHBondContact O-N 3.34Å
504	H	90.1	Very high	91.6	Very high	52 Å²	52	63.8 Å²	63.8	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-70.8	-35	175.5	-158.2	29.5	0	0	0	111.7	R500 E501 E502 L507 R508	R500-H504 PolarHBondContact O-N 3.03Å; E501-H504 PolarHBondContact O-N 3.13Å; E502-H504 VanDerWaalsContact C-N 3.28Å; E502-H504 PolarHBondContact O-N 2.95Å; H504-L507 PolarHBondContact O-N 2.92Å; H504-R508 PolarHBondContact CD2-NH1 2.94Å; H504-R508 WeakPolarHBondContact O-CG 3.32Å; H504-R508 PolarHBondContact O-N 3.49Å
505	A	93	Very high	91.7	Very high	28 Å²	28	56 Å²	56	23%	0.231	26%	0.263	C	S	.	.	H	α-helix	trans	-61.2	-44.5	172.2	0	0	0	0	0	112	E501 E502 L507 R508 N509	E501-A505 WeakPolarHBondContact O-CB 3.2Å; E501-A505 PolarHBondContact O-N 3.25Å; E502-A505 WeakPolarHBondContact O-CB 3.39Å; E502-A505 PolarHBondContact O-N 3.26Å; A505-L507 VanDerWaalsContact C-N 3.31Å; A505-L507 PolarHBondContact O-N 3.25Å; A505-R508 PolarHBondContact O-N 3.46Å; A505-R508 VanDerWaalsContact O-N 3.15Å; A505-N509 WeakPolarHBondContact O-CB 3.32Å; A505-N509 VanDerWaalsContact O-CG 3.25Å; A505-N509 PolarHBondContact O-N 2.73Å
506	I	93.9	Very high	91.9	Very high	8 Å²	8	60.8 Å²	60.8	4%	0.041	28%	0.282	C	S	.	.	H	α-helix	trans	-53.7	-47.6	172.7	-68.1	173.5	0	0	0	110.8	L344 L353 A371 M374 E375 L378 E502 L503 R508 N509 A510	L344-I506 HydrophobicContact CD1-CB 4.08Å; L344-I506 HydrophobicContact CD1-CG2 3.72Å; L353-I506 HydrophobicContact CD1-CD1 3.87Å; L353-I506 HydrophobicContact CD2-CD1 4.01Å; A371-I506 HydrophobicContact CB-CD1 3.69Å; A371-I506 HydrophobicContact CB-CG1 3.95Å; M374-I506 HydrophobicContact CB-CG2 4.23Å; M374-I506 HydrophobicContact CE-CD1 4.25Å; M374-I506 HydrophobicContact CE-CG2 4.42Å; E375-I506 HydrophobicContact CG-CB 4.48Å; E375-I506 HydrophobicContact CG-CG2 3.91Å; L378-I506 HydrophobicContact CD1-CG2 4.15Å; E502-I506 PolarHBondContact O-N 3.19Å; L503-I506 HydrophobicContact CD2-CD1 4.31Å; L503-I506 PolarHBondContact O-N 3.17Å; I506-R508 PolarHBondContact O-N 3.39Å; I506-N509 PolarHBondContact O-N 3.03Å; I506-A510 WeakPolarHBondContact O-CB 3.32Å; I506-A510 PolarHBondContact O-N 3.35Å
507	L	94.1	Very high	92.1	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-43.6	177.6	-179.4	63.8	0	0	0	112.5	L344 L345 W493 P495 L503 H504 A505 N509 A510 V511	L344-L507 HydrophobicContact CD2-CB 4.27Å; L345-L507 HydrophobicContact CD2-CD1 4.34Å; W493-L507 HydrophobicContact CB-CD1 4.29Å; W493-L507 WeakPolarHBondContact O-CD2 3.21Å; P495-L507 HydrophobicContact CG-CD2 4.04Å; L503-L507 PolarHBondContact O-N 3.34Å; H504-L507 PolarHBondContact O-N 2.92Å; A505-L507 VanDerWaalsContact C-N 3.31Å; A505-L507 PolarHBondContact O-N 3.25Å; L507-N509 PolarHBondContact O-N 3.32Å; L507-A510 PolarHBondContact O-N 2.93Å; L507-V511 HydrophobicContact CD1-CG2 4.46Å; L507-V511 WeakPolarHBondContact O-CG2 3.3Å; L507-V511 PolarHBondContact O-N 2.86Å
508	R	95	Very high	92.2	Very high	84 Å²	84	55.9 Å²	55.9	32%	0.317	26%	0.255	S	S	.	.	H	α-helix	trans	-62.5	-42.7	178.3	-68.3	-174	-58.5	-118.2	5.4	111.6	I489 E501 H504 A505 I506 V511 E512	I489-R508 HydrophobicContact CD1-CG 3.87Å; I489-R508 HydrophobicContact CG1-CG 4.47Å; E501-R508 IonicContact OE1-CZ 3.4Å; E501-R508 IonicContact OE1-NH1 2.69Å; E501-R508 PolarHBondContact OE1-NH1 2.97Å; E501-R508 IonicContact OE1-NH2 2.95Å; E501-R508 PolarHBondContact OE1-NH2 2.75Å; E501-R508 IonicContact OE2-NH1 3.22Å; H504-R508 PolarHBondContact CD2-NH1 2.94Å; H504-R508 WeakPolarHBondContact O-CG 3.32Å; H504-R508 PolarHBondContact O-N 3.49Å; A505-R508 PolarHBondContact O-N 3.46Å; A505-R508 VanDerWaalsContact O-N 3.15Å; I506-R508 PolarHBondContact O-N 3.39Å; R508-V511 PolarHBondContact O-N 2.86Å; R508-E512 WeakPolarHBondContact O-CB 3.45Å; R508-E512 PolarHBondContact O-N 3.46Å; R508-E512 VanDerWaalsContact O-N 3.07Å
509	N	96.2	Very high	92.5	Very high	80 Å²	80	47.5 Å²	47.5	43%	0.428	22%	0.219	S	C	.	.	H	α-helix	trans	-65.2	-42	176.6	-68.2	-10.1	0	0	0	111.7	E375 A505 I506 L507 V511 E512 D513	E375-N509 HydrophobicContact CG-CB 3.99Å; E375-N509 WeakPolarHBondContact OE1-CB 3.32Å; E375-N509 PolarHBondContact OE1-ND2 3.2Å; A505-N509 WeakPolarHBondContact O-CB 3.32Å; A505-N509 VanDerWaalsContact O-CG 3.25Å; A505-N509 PolarHBondContact O-N 2.73Å; I506-N509 PolarHBondContact O-N 3.03Å; L507-N509 PolarHBondContact O-N 3.32Å; N509-V511 PolarHBondContact O-N 2.92Å; N509-E512 PolarHBondContact O-N 3.46Å; N509-D513 WeakPolarHBondContact O-CB 3.28Å; N509-D513 PolarHBondContact O-N 3.48Å
510	A	96.5	Very high	92.9	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.6	-43.7	175.8	0	0	0	0	0	112.7	E375 L378 A379 I382 I506 L507 S514	E375-A510 HydrophobicContact CB-CB 4.42Å; L378-A510 HydrophobicContact CB-CB 3.58Å; L378-A510 HydrophobicContact CD1-CB 4.3Å; A379-A510 WeakPolarHBondContact CB-O 3.43Å; I382-A510 HydrophobicContact CD1-CB 4.25Å; I506-A510 WeakPolarHBondContact O-CB 3.32Å; I506-A510 PolarHBondContact O-N 3.35Å; L507-A510 PolarHBondContact O-N 2.93Å; A510-S514 WeakPolarHBondContact O-CB 3.41Å; A510-S514 PolarHBondContact O-N 2.79Å; A510-S514 PolarHBondContact O-OG 3.31Å
511	V	96.5	Very high	93	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65.6	-39.4	176.2	174.7	0	0	0	0	111.5	I382 F484 T485 C488 I489 L507 R508 N509 S514 Y515	I382-V511 HydrophobicContact CD1-CB 4.49Å; I382-V511 HydrophobicContact CD1-CG2 3.7Å; F484-V511 HydrophobicContact CE1-CG1 4.14Å; T485-V511 HydrophobicContact CG2-CG1 3.83Å; C488-V511 HydrophobicContact CB-CG1 3.79Å; C488-V511 HydrophobicContact CB-CG2 3.94Å; I489-V511 HydrophobicContact CG1-CG2 4.19Å; L507-V511 HydrophobicContact CD1-CG2 4.46Å; L507-V511 WeakPolarHBondContact O-CG2 3.3Å; L507-V511 PolarHBondContact O-N 2.86Å; R508-V511 PolarHBondContact O-N 2.86Å; N509-V511 PolarHBondContact O-N 2.92Å; V511-S514 WeakPolarHBondContact CA-OG 3.48Å; V511-S514 PolarHBondContact O-OG 2.83Å; V511-Y515 PolarHBondContact O-N 3.4Å
512	E	95.6	Very high	93	Very high	49 Å²	49	40.2 Å²	40.2	23%	0.229	20%	0.195	C	C	.	.	H	α-helix	trans	-67.8	-41.7	177.6	-177.8	74.1	170	0	0	112.2	K481 R508 N509 K516	K481-E512 VanDerWaalsContact CE-CD 3.42Å; K481-E512 VanDerWaalsContact CE-OE1 3.25Å; K481-E512 WeakPolarHBondContact CE-OE1 3.4Å; K481-E512 WeakPolarHBondContact CE-OE2 3.42Å; K481-E512 VanDerWaalsContact NZ-CD 3.32Å; K481-E512 IonicContact NZ-OE1 3.51Å; K481-E512 PolarHBondContact NZ-OE1 3.44Å; K481-E512 IonicContact NZ-OE2 2.73Å; K481-E512 PolarHBondContact NZ-OE2 3.08Å; K481-E512 VanDerWaalsContact NZ-OE2 3.13Å; R508-E512 WeakPolarHBondContact O-CB 3.45Å; R508-E512 PolarHBondContact O-N 3.46Å; R508-E512 VanDerWaalsContact O-N 3.07Å; N509-E512 PolarHBondContact O-N 3.46Å; E512-K516 HydrophobicContact CG-CD 4.23Å; E512-K516 WeakPolarHBondContact O-CB 3.03Å; E512-K516 WeakPolarHBondContact O-CG 3.49Å; E512-K516 PolarHBondContact O-N 3.31Å; E512-K516 WeakPolarHBondContact OE1-CE 3.22Å; E512-K516 IonicContact OE1-NZ 2.65Å; E512-K516 PolarHBondContact OE1-NZ 3.11Å
513	D	95.3	Very high	93.2	Very high	29 Å²	29	34.1 Å²	34.1	16%	0.155	17%	0.167	C	C	.	.	H	α-helix	trans	-68.8	-40.5	174.1	-178.5	57.2	0	0	0	111.5	H376 A379 N509 Y515 K516 R517	H376-D513 IonicContact CD2-OD2 3.63Å; A379-D513 HydrophobicContact CB-CB 4.39Å; N509-D513 WeakPolarHBondContact O-CB 3.28Å; N509-D513 PolarHBondContact O-N 3.48Å; D513-Y515 VanDerWaalsContact C-N 3.32Å; D513-Y515 PolarHBondContact O-N 3.49Å; D513-K516 PolarHBondContact O-N 3.01Å; D513-R517 VanDerWaalsContact CG-NE 3.27Å; D513-R517 WeakPolarHBondContact O-CB 3.24Å; D513-R517 PolarHBondContact O-N 3.29Å; D513-R517 WeakPolarHBondContact OD1-CB 3.48Å; D513-R517 WeakPolarHBondContact OD1-CD 3.41Å; D513-R517 IonicContact OD1-CZ 2.67Å; D513-R517 IonicContact OD1-NE 3.08Å; D513-R517 PolarHBondContact OD1-NE 3.23Å; D513-R517 IonicContact OD2-CZ 2.73Å; D513-R517 IonicContact OD2-NE 2.67Å; D513-R517 PolarHBondContact OD2-NE 2.9Å; D513-R517 IonicContact OD2-NH2 2.66Å; D513-R517 PolarHBondContact OD2-NH2 3.26Å
514	S	95.3	Very high	93.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.177	C	C	.	.	I	π-helix	trans	-59.4	-44.3	175.4	72.1	0	0	0	0	111.4	A379 I382 A510 V511 L518 I519	A379-S514 VanDerWaalsContact O-CB 3.27Å; A379-S514 WeakPolarHBondContact O-CB 3.08Å; I382-S514 VanDerWaalsContact CG2-OG 3.26Å; I382-S514 WeakPolarHBondContact CG2-OG 3.44Å; A510-S514 WeakPolarHBondContact O-CB 3.41Å; A510-S514 PolarHBondContact O-N 2.79Å; A510-S514 PolarHBondContact O-OG 3.31Å; V511-S514 WeakPolarHBondContact CA-OG 3.48Å; V511-S514 PolarHBondContact O-OG 2.83Å; S514-L518 WeakPolarHBondContact O-CB 3.22Å; S514-L518 PolarHBondContact O-N 3.06Å; S514-I519 WeakPolarHBondContact O-CG1 3.43Å; S514-I519 PolarHBondContact O-N 3.49Å
515	Y	95.4	Very high	93.3	Very high	7 Å²	7	40.1 Å²	40.1	3%	0.027	19%	0.191	C	C	.	.	I	π-helix	trans	-63.5	-56.6	176	-175.4	-89.9	0	0	0	111.4	I392 K481 F484 V511 D513 L520	I392-Y515 HydrophobicContact CD1-CD2 3.67Å; I392-Y515 HydrophobicContact CD1-CE2 3.55Å; K481-Y515 HydrophobicContact CB-CD1 4.18Å; K481-Y515 HydrophobicContact CB-CE1 3.66Å; K481-Y515 HydrophobicContact CB-CE2 4.06Å; K481-Y515 HydrophobicContact CD-CD1 3.87Å; K481-Y515 HydrophobicContact CD-CE1 3.79Å; K481-Y515 HydrophobicContact CG-CD1 3.63Å; K481-Y515 HydrophobicContact CG-CD2 4.41Å; K481-Y515 HydrophobicContact CG-CE1 3.6Å; K481-Y515 HydrophobicContact CG-CE2 4.38Å; K481-Y515 HydrophobicContact CG-CG 4.05Å; F484-Y515 AromaticContact CD1-CD2 3.67Å; F484-Y515 HydrophobicContact CD1-CD2 3.67Å; F484-Y515 HydrophobicContact CD1-CG 4.33Å; F484-Y515 HydrophobicContact CE1-CD2 4.05Å; F484-Y515 HydrophobicContact CG-CD2 4.2Å; V511-Y515 PolarHBondContact O-N 3.4Å; D513-Y515 VanDerWaalsContact C-N 3.32Å; D513-Y515 PolarHBondContact O-N 3.49Å; Y515-L520 HydrophobicContact CD1-CB 4.42Å; Y515-L520 HydrophobicContact CE1-CB 4.14Å; Y515-L520 HydrophobicContact CE1-CD2 4.21Å; Y515-L520 WeakPolarHBondContact O-CB 3.41Å; Y515-L520 PolarHBondContact O-N 2.87Å
516	K	94.4	Very high	93.1	Very high	114 Å²	114	40.6 Å²	40.6	50%	0.496	19%	0.193	S	C	.	.	I	π-helix	trans	-65.5	-45.1	-173	-75.8	174.6	179.3	158.9	0	113.7	E512 D513 P521	E512-K516 HydrophobicContact CG-CD 4.23Å; E512-K516 WeakPolarHBondContact O-CB 3.03Å; E512-K516 WeakPolarHBondContact O-CG 3.49Å; E512-K516 PolarHBondContact O-N 3.31Å; E512-K516 WeakPolarHBondContact OE1-CE 3.22Å; E512-K516 IonicContact OE1-NZ 2.65Å; E512-K516 PolarHBondContact OE1-NZ 3.11Å; D513-K516 PolarHBondContact O-N 3.01Å; K516-P521 WeakPolarHBondContact O-CD 3.21Å
517	R	92.8	Very high	93	Very high	76 Å²	76	42 Å²	42	29%	0.287	20%	0.198	S	C	.	.	I	π-helix	trans	-93.9	-28.3	-166.8	-174.9	174.5	56.6	73.8	-0.7	113.4	D513	D513-R517 VanDerWaalsContact CG-NE 3.27Å; D513-R517 WeakPolarHBondContact O-CB 3.24Å; D513-R517 PolarHBondContact O-N 3.29Å; D513-R517 WeakPolarHBondContact OD1-CB 3.48Å; D513-R517 WeakPolarHBondContact OD1-CD 3.41Å; D513-R517 IonicContact OD1-CZ 2.67Å; D513-R517 IonicContact OD1-NE 3.08Å; D513-R517 PolarHBondContact OD1-NE 3.23Å; D513-R517 IonicContact OD2-CZ 2.73Å; D513-R517 IonicContact OD2-NE 2.67Å; D513-R517 PolarHBondContact OD2-NE 2.9Å; D513-R517 IonicContact OD2-NH2 2.66Å; D513-R517 PolarHBondContact OD2-NH2 3.26Å
518	L	89.6	Confident	92.9	Very high	41 Å²	41	44 Å²	44	22%	0.215	21%	0.206	C	C	.	.	I	π-helix	trans	-116.3	-57.1	-172.2	-61.8	175.7	0	0	0	111.9	A379 A383 S514 F522	A379-L518 WeakPolarHBondContact O-CD1 3.29Å; A383-L518 HydrophobicContact CB-CB 3.62Å; A383-L518 HydrophobicContact CB-CD1 3.54Å; A383-L518 HydrophobicContact CB-CG 4.22Å; S514-L518 WeakPolarHBondContact O-CB 3.22Å; S514-L518 PolarHBondContact O-N 3.06Å; L518-F522 WeakPolarHBondContact O-CB 3.3Å; L518-F522 PolarHBondContact O-N 2.94Å
519	I	91.8	Very high	92.8	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	21%	0.205	C	C	.	.	I	π-helix	trans	-76.5	-46.7	-170.6	-57.7	167.8	0	0	0	112	A383 I392 F484 S514 F522 L523	A383-I519 HydrophobicContact CB-CD1 4.44Å; A383-I519 HydrophobicContact CB-CG1 3.98Å; I392-I519 HydrophobicContact CD1-CG2 3.62Å; I392-I519 HydrophobicContact CG2-CG2 4.09Å; F484-I519 HydrophobicContact CE1-CD1 4.1Å; F484-I519 HydrophobicContact CE2-CD1 4.06Å; F484-I519 HydrophobicContact CZ-CD1 3.41Å; F484-I519 VanDerWaalsContact CZ-CD1 3.41Å; S514-I519 WeakPolarHBondContact O-CG1 3.43Å; S514-I519 PolarHBondContact O-N 3.49Å; I519-F522 WeakPolarHBondContact O-CB 3.23Å; I519-F522 PolarHBondContact O-N 3.04Å; I519-F522 VanDerWaalsContact O-N 3.16Å; I519-L523 HydrophobicContact CG2-CD1 3.69Å; I519-L523 HydrophobicContact CG2-CG 3.97Å; I519-L523 WeakPolarHBondContact O-CG 3.37Å; I519-L523 PolarHBondContact O-N 2.7Å
520	L	92.9	Very high	92.5	Very high	53 Å²	53	45.5 Å²	45.5	28%	0.277	22%	0.215	S	C	.	.	H	α-helix	trans	-60.1	-45.3	-179.7	173.5	64.1	0	0	0	112.7	I476 Y515 F522 L523 T524	I476-L520 HydrophobicContact CB-CD1 4.27Å; I476-L520 HydrophobicContact CD1-CD1 3.84Å; I476-L520 HydrophobicContact CG1-CD1 4.17Å; Y515-L520 HydrophobicContact CD1-CB 4.42Å; Y515-L520 HydrophobicContact CE1-CB 4.14Å; Y515-L520 HydrophobicContact CE1-CD2 4.21Å; Y515-L520 WeakPolarHBondContact O-CB 3.41Å; Y515-L520 PolarHBondContact O-N 2.87Å; L520-F522 PolarHBondContact O-N 3.49Å; L520-L523 PolarHBondContact O-N 2.97Å; L520-T524 VanDerWaalsContact O-CB 3.29Å; L520-T524 WeakPolarHBondContact O-CB 3.33Å; L520-T524 PolarHBondContact O-N 3.49Å; L520-T524 PolarHBondContact O-OG1 3.41Å
521	P	90.5	Very high	92.3	Very high	62 Å²	62	46.5 Å²	46.5	40%	0.403	22%	0.22	S	C	.	.	H	α-helix	trans	-63.3	-37	172.8	-25	36.5	0	0	0	113.6	K516 R525	K516-P521 WeakPolarHBondContact O-CD 3.21Å; P521-R525 WeakPolarHBondContact O-CB 3.36Å; P521-R525 PolarHBondContact O-N 2.97Å
522	F	87.8	Confident	92.2	Very high	22 Å²	22	48 Å²	48	10%	0.096	23%	0.229	C	C	.	.	H	α-helix	trans	-63.9	-50.5	175.3	167.4	-106.2	0	0	0	111.8	H315 L389 L518 I519 L520 T524 R525 S526	H315-F522 HydrophobicContact CB-CD2 4.35Å; H315-F522 HydrophobicContact CB-CE2 4.09Å; H315-F522 AromaticContact ND1-CD2 3.51Å; H315-F522 AromaticContact ND1-CE2 3.92Å; H315-F522 AromaticContact ND1-CG 3.94Å; L389-F522 HydrophobicContact CD2-CD1 4.46Å; L389-F522 HydrophobicContact CD2-CE1 4.23Å; L518-F522 WeakPolarHBondContact O-CB 3.3Å; L518-F522 PolarHBondContact O-N 2.94Å; I519-F522 WeakPolarHBondContact O-CB 3.23Å; I519-F522 PolarHBondContact O-N 3.04Å; I519-F522 VanDerWaalsContact O-N 3.16Å; L520-F522 PolarHBondContact O-N 3.49Å; F522-T524 PolarHBondContact O-N 3.4Å; F522-R525 PolarHBondContact O-N 2.88Å; F522-S526 WeakPolarHBondContact O-CB 3.24Å; F522-S526 PolarHBondContact O-N 3.35Å
523	L	90.7	Very high	92	Very high	6 Å²	6	48.6 Å²	48.6	3%	0.031	24%	0.239	C	C	.	.	H	α-helix	trans	-60.8	-44.6	176.6	-68.2	173.5	0	0	0	111.4	I392 K393 I476 I519 L520 R525 S526 Y527	I392-L523 HydrophobicContact CD1-CD1 4.03Å; I392-L523 HydrophobicContact CG1-CD1 4.06Å; I392-L523 HydrophobicContact CG2-CD1 4.49Å; K393-L523 HydrophobicContact CG-CD2 4.39Å; I476-L523 HydrophobicContact CD1-CB 3.71Å; I476-L523 HydrophobicContact CD1-CD1 3.92Å; I476-L523 HydrophobicContact CD1-CG 4.48Å; I519-L523 HydrophobicContact CG2-CD1 3.69Å; I519-L523 HydrophobicContact CG2-CG 3.97Å; I519-L523 WeakPolarHBondContact O-CG 3.37Å; I519-L523 PolarHBondContact O-N 2.7Å; L520-L523 PolarHBondContact O-N 2.97Å; L523-R525 VanDerWaalsContact C-N 3.33Å; L523-R525 PolarHBondContact O-N 3.22Å; L523-S526 PolarHBondContact O-N 3.05Å; L523-Y527 WeakPolarHBondContact O-CD2 3.34Å; L523-Y527 PolarHBondContact O-N 2.86Å
524	T	91.9	Very high	91.8	Very high	40 Å²	40	50 Å²	50	25%	0.245	25%	0.254	C	S	.	.	H	α-helix	trans	-56.8	-46.7	176.7	-63	0	0	0	0	111.5	V474 L520 F522 R528	V474-T524 HydrophobicContact CB-CG2 4.17Å; V474-T524 HydrophobicContact CG2-CG2 4.41Å; L520-T524 VanDerWaalsContact O-CB 3.29Å; L520-T524 WeakPolarHBondContact O-CB 3.33Å; L520-T524 PolarHBondContact O-N 3.49Å; L520-T524 PolarHBondContact O-OG1 3.41Å; F522-T524 PolarHBondContact O-N 3.4Å; T524-R528 WeakPolarHBondContact O-CG 3.46Å; T524-R528 PolarHBondContact O-N 2.98Å; T524-R528 VanDerWaalsContact O-N 3.14Å
525	R	90.1	Very high	91.7	Very high	142 Å²	142	50 Å²	50	54%	0.536	26%	0.255	S	S	.	.	H	α-helix	trans	-63.5	-50.8	176	-171.9	-173.5	-58.9	178.5	2.9	111	D314 P521 F522 L523 Y527 R528 T529	D314-R525 IonicContact OD2-NH1 2.92Å; D314-R525 PolarHBondContact OD2-NH1 2.85Å; P521-R525 WeakPolarHBondContact O-CB 3.36Å; P521-R525 PolarHBondContact O-N 2.97Å; F522-R525 PolarHBondContact O-N 2.88Å; L523-R525 VanDerWaalsContact C-N 3.33Å; L523-R525 PolarHBondContact O-N 3.22Å; R525-Y527 VanDerWaalsContact C-N 3.29Å; R525-Y527 PolarHBondContact O-N 3.48Å; R525-R528 CarbonylContact O-C 3.44Å; R525-R528 WeakPolarHBondContact O-CA 3.49Å; R525-R528 PolarHBondContact O-N 3.14Å; R525-T529 PolarHBondContact O-N 3.26Å; R525-T529 PolarHBondContact O-OG1 2.92Å; R525-T529 VanDerWaalsContact O-OG1 3.11Å
526	S	88.8	Confident	91.5	Very high	38 Å²	38	51.7 Å²	51.7	27%	0.266	26%	0.263	S	S	.	.	H	α-helix	trans	-57.9	-39.7	-178.8	-172.7	0	0	0	0	112.3	F522 L523 T529 K530	F522-S526 WeakPolarHBondContact O-CB 3.24Å; F522-S526 PolarHBondContact O-N 3.35Å; L523-S526 PolarHBondContact O-N 3.05Å; S526-T529 PolarHBondContact O-N 3.41Å; S526-K530 VanDerWaalsContact O-CB 3.24Å; S526-K530 WeakPolarHBondContact O-CB 3.26Å; S526-K530 PolarHBondContact O-N 2.77Å
527	Y	92.1	Very high	91.2	Very high	39 Å²	39	50.9 Å²	50.9	15%	0.153	26%	0.259	C	S	.	.	H	α-helix	trans	-63.8	-43.8	171.6	-83.4	-64.5	0	0	0	112.7	C396 V401 V450 V474 I476 L523 R525 L531	C396-Y527 HydrophobicContact CB-CE2 4.4Å; C396-Y527 VanDerWaalsContact CB-OH 3.25Å; C396-Y527 WeakPolarHBondContact CB-OH 3.41Å; V401-Y527 HydrophobicContact CG1-CD2 4.33Å; V401-Y527 HydrophobicContact CG1-CE2 4.15Å; V401-Y527 HydrophobicContact CG2-CE2 4.4Å; V450-Y527 HydrophobicContact CB-CD1 4.48Å; V450-Y527 HydrophobicContact CG2-CD1 4.09Å; V450-Y527 HydrophobicContact CG2-CE1 3.89Å; V474-Y527 HydrophobicContact CG1-CD2 4.25Å; V474-Y527 HydrophobicContact CG1-CG 4.36Å; I476-Y527 HydrophobicContact CD1-CE2 4.49Å; L523-Y527 WeakPolarHBondContact O-CD2 3.34Å; L523-Y527 PolarHBondContact O-N 2.86Å; R525-Y527 VanDerWaalsContact C-N 3.29Å; R525-Y527 PolarHBondContact O-N 3.48Å; Y527-L531 VanDerWaalsContact O-CB 3.3Å; Y527-L531 WeakPolarHBondContact O-CB 3.09Å; Y527-L531 WeakPolarHBondContact O-CG 3.36Å; Y527-L531 PolarHBondContact O-N 2.83Å
528	R	92.7	Very high	91.1	Very high	40 Å²	40	50.5 Å²	50.5	15%	0.151	26%	0.261	C	S	.	.	H	α-helix	trans	-64.4	-41.6	176.2	-67.5	-71.2	-74.4	127.2	-5.1	111.8	N462 E465 V474 T524 R525 T532	N462-R528 VanDerWaalsContact OD1-CZ 3.25Å; N462-R528 PolarHBondContact OD1-NH1 3.3Å; N462-R528 PolarHBondContact OD1-NH2 3.41Å; E465-R528 IonicContact OE2-CZ 3.07Å; E465-R528 IonicContact OE2-NH2 3.76Å; E465-R528 PolarHBondContact OE2-NH2 2.88Å; V474-R528 HydrophobicContact CG2-CG 3.89Å; T524-R528 WeakPolarHBondContact O-CG 3.46Å; T524-R528 PolarHBondContact O-N 2.98Å; T524-R528 VanDerWaalsContact O-N 3.14Å; R525-R528 CarbonylContact O-C 3.44Å; R525-R528 WeakPolarHBondContact O-CA 3.49Å; R525-R528 PolarHBondContact O-N 3.14Å; R528-T532 WeakPolarHBondContact O-CB 3.47Å; R528-T532 PolarHBondContact O-N 3.29Å; R528-T532 PolarHBondContact O-OG1 3.42Å
529	T	91	Very high	91.1	Very high	49 Å²	49	48.8 Å²	48.8	30%	0.301	25%	0.252	S	S	.	.	H	α-helix	trans	-59.8	-58.1	173.8	-50.9	0	0	0	0	110	D311 R525 S526 L531 T532 S533	D311-T529 PolarHBondContact OD2-OG1 2.91Å; R525-T529 PolarHBondContact O-N 3.26Å; R525-T529 PolarHBondContact O-OG1 2.92Å; R525-T529 VanDerWaalsContact O-OG1 3.11Å; S526-T529 PolarHBondContact O-N 3.41Å; T529-L531 VanDerWaalsContact C-N 3.34Å; T529-L531 PolarHBondContact O-N 3.01Å; T529-T532 PolarHBondContact O-N 2.94Å; T529-S533 PolarHBondContact O-N 3.19Å; T529-S533 PolarHBondContact O-OG 3.46Å
530	K	90.2	Very high	91	Very high	147 Å²	147	49.5 Å²	49.5	64%	0.639	26%	0.256	S	S	*	.	H	α-helix	trans	-57.1	-43.2	-176.9	-174.2	173.8	-177.1	174.3	0	112.8	S526 A534	S526-K530 VanDerWaalsContact O-CB 3.24Å; S526-K530 WeakPolarHBondContact O-CB 3.26Å; S526-K530 PolarHBondContact O-N 2.77Å; K530-A534 VanDerWaalsContact O-CB 3.22Å; K530-A534 WeakPolarHBondContact O-CB 3.3Å; K530-A534 PolarHBondContact O-N 3.3Å
531	L	93.9	Very high	90.8	Very high	21 Å²	21	49.2 Å²	49.2	11%	0.11	26%	0.261	C	S	.	.	H	α-helix	trans	-64.5	-41.3	175.6	-73.2	175.2	0	0	0	112.1	I403 V450 I453 T458 Y527 T529 A535	I403-L531 HydrophobicContact CD1-CD1 4Å; V450-L531 HydrophobicContact CB-CD1 4.28Å; V450-L531 HydrophobicContact CG1-CD1 4.14Å; V450-L531 WeakPolarHBondContact O-CD2 3.38Å; I453-L531 HydrophobicContact CG2-CD1 4.41Å; I453-L531 HydrophobicContact CG2-CD2 3.6Å; T458-L531 HydrophobicContact CG2-CB 4.05Å; Y527-L531 VanDerWaalsContact O-CB 3.3Å; Y527-L531 WeakPolarHBondContact O-CB 3.09Å; Y527-L531 WeakPolarHBondContact O-CG 3.36Å; Y527-L531 PolarHBondContact O-N 2.83Å; T529-L531 VanDerWaalsContact C-N 3.34Å; T529-L531 PolarHBondContact O-N 3.01Å; L531-A535 VanDerWaalsContact O-CB 3.24Å; L531-A535 WeakPolarHBondContact O-CB 3.31Å; L531-A535 PolarHBondContact O-N 3.21Å
532	T	94.3	Very high	90.5	Very high	32 Å²	32	46.6 Å²	46.6	20%	0.196	24%	0.244	C	C	.	.	H	α-helix	trans	-68.6	-51.2	-179.8	-57	0	0	0	0	110.7	N462 R528 T529 A534 A535 E536	N462-T532 WeakPolarHBondContact ND2-CG2 3.34Å; N462-T532 PolarHBondContact ND2-OG1 2.97Å; R528-T532 WeakPolarHBondContact O-CB 3.47Å; R528-T532 PolarHBondContact O-N 3.29Å; R528-T532 PolarHBondContact O-OG1 3.42Å; T529-T532 PolarHBondContact O-N 2.94Å; T532-A534 VanDerWaalsContact C-N 3.33Å; T532-A534 PolarHBondContact O-N 2.88Å; T532-A535 PolarHBondContact O-N 3.49Å; T532-E536 HydrophobicContact CG2-CG 4.27Å; T532-E536 WeakPolarHBondContact O-CG 3.43Å; T532-E536 PolarHBondContact O-N 3.08Å
533	S	90.6	Very high	90.6	Very high	61 Å²	61	45.9 Å²	45.9	43%	0.427	24%	0.24	S	C	.	.	H	α-helix	trans	-60.2	-39.7	178.5	-55.1	0	0	0	0	112.6	T529 K537	T529-S533 PolarHBondContact O-N 3.19Å; T529-S533 PolarHBondContact O-OG 3.46Å; S533-K537 WeakPolarHBondContact O-CB 3.15Å; S533-K537 PolarHBondContact O-N 3.47Å
534	A	90.6	Very high	90.5	Very high	58 Å²	58	46 Å²	46	48%	0.479	24%	0.241	S	C	.	.	H	α-helix	trans	-64.6	-39.7	173.6	0	0	0	0	0	112.2	K530 T532 E538	K530-A534 VanDerWaalsContact O-CB 3.22Å; K530-A534 WeakPolarHBondContact O-CB 3.3Å; K530-A534 PolarHBondContact O-N 3.3Å; T532-A534 VanDerWaalsContact C-N 3.33Å; T532-A534 PolarHBondContact O-N 2.88Å; A534-E538 WeakPolarHBondContact O-CB 3.03Å; A534-E538 PolarHBondContact O-N 3.08Å; A534-E538 VanDerWaalsContact O-N 3.15Å
535	A	93.1	Very high	90.2	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-71.2	-39.3	179.1	0	0	0	0	0	113.1	P455 T458 L459 L531 T532 S539	P455-A535 HydrophobicContact CB-CB 4.07Å; P455-A535 WeakPolarHBondContact O-CB 3.37Å; T458-A535 HydrophobicContact CG2-CB 4.04Å; L459-A535 HydrophobicContact CD2-CB 4.14Å; L459-A535 HydrophobicContact CG-CB 4.15Å; L531-A535 VanDerWaalsContact O-CB 3.24Å; L531-A535 WeakPolarHBondContact O-CB 3.31Å; L531-A535 PolarHBondContact O-N 3.21Å; T532-A535 PolarHBondContact O-N 3.49Å; A535-S539 VanDerWaalsContact O-CB 3.29Å; A535-S539 WeakPolarHBondContact O-CB 3.3Å; A535-S539 PolarHBondContact O-N 3.23Å; A535-S539 VanDerWaalsContact O-N 3.11Å; A535-S539 PolarHBondContact O-OG 3.06Å
536	E	92.2	Very high	90.1	Very high	43 Å²	43	38.9 Å²	38.9	20%	0.201	21%	0.21	C	C	.	.	H	α-helix	trans	-63	-50.4	172.6	-70.3	-174.7	125	0	0	110.9	L459 T532 E538 S539 I540 V708 S709	L459-E536 HydrophobicContact CD2-CG 4.39Å; T532-E536 HydrophobicContact CG2-CG 4.27Å; T532-E536 WeakPolarHBondContact O-CG 3.43Å; T532-E536 PolarHBondContact O-N 3.08Å; E536-E538 PolarHBondContact O-N 2.99Å; E536-S539 PolarHBondContact O-N 3.03Å; E536-I540 WeakPolarHBondContact O-CB 3.42Å; E536-I540 VanDerWaalsContact O-CG1 3.28Å; E536-I540 WeakPolarHBondContact O-CG1 3.45Å; E536-I540 PolarHBondContact O-N 2.94Å; E536-V708 HydrophobicContact CB-CB 4.47Å; E536-V708 HydrophobicContact CB-CG1 4.38Å; E536-V708 HydrophobicContact CG-CB 4.13Å; E536-V708 HydrophobicContact CG-CG1 4.1Å; E536-V708 WeakPolarHBondContact OE1-CA 3.35Å; E536-S709 PolarHBondContact OE1-N 3.45Å
537	K	88.3	Confident	90.2	Very high	96 Å²	96	37 Å²	37	42%	0.417	20%	0.197	S	C	.	.	H	α-helix	trans	-56.2	-51.8	180	-178.3	176.2	177.1	175.7	0	111.9	D268 S533 S539 I540 A541	D268-K537 WeakPolarHBondContact OD1-CE 3.48Å; D268-K537 IonicContact OD1-NZ 3.8Å; D268-K537 PolarHBondContact OD1-NZ 3.44Å; D268-K537 WeakPolarHBondContact OD2-CE 3.3Å; D268-K537 IonicContact OD2-NZ 3.64Å; D268-K537 PolarHBondContact OD2-NZ 3.49Å; S533-K537 WeakPolarHBondContact O-CB 3.15Å; S533-K537 PolarHBondContact O-N 3.47Å; K537-S539 VanDerWaalsContact C-N 3.29Å; K537-S539 PolarHBondContact O-N 3.17Å; K537-I540 PolarHBondContact O-N 2.79Å; K537-A541 WeakPolarHBondContact O-CB 3.19Å; K537-A541 PolarHBondContact O-N 3.04Å
538	E	89.3	Confident	90.1	Very high	68 Å²	68	36.8 Å²	36.8	32%	0.318	20%	0.196	S	C	.	.	H	α-helix	trans	-65.6	-32.3	-178.6	-175.2	62.1	-161.4	0	0	112.2	P455 A534 E536 M542 L937	P455-E538 HydrophobicContact CB-CB 4.41Å; P455-E538 HydrophobicContact CB-CG 4.44Å; P455-E538 HydrophobicContact CG-CB 4.19Å; P455-E538 HydrophobicContact CG-CG 4.01Å; A534-E538 WeakPolarHBondContact O-CB 3.03Å; A534-E538 PolarHBondContact O-N 3.08Å; A534-E538 VanDerWaalsContact O-N 3.15Å; E536-E538 PolarHBondContact O-N 2.99Å; E538-M542 PolarHBondContact O-N 2.75Å; E538-L937 HydrophobicContact CB-CD1 4.36Å; E538-L937 HydrophobicContact CG-CD1 3.81Å; E538-L937 HydrophobicContact CG-CD2 3.57Å; E538-L937 HydrophobicContact CG-CG 4.36Å; E538-L937 WeakPolarHBondContact OE1-CD2 3.29Å
539	S	90.5	Very high	89.8	Confident	6 Å²	6	36.3 Å²	36.3	4%	0.042	20%	0.196	C	C	.	.	H	α-helix	trans	-74.1	-42	175.4	-55.7	0	0	0	0	112.1	L459 A535 E536 K537 A541 M542 F543	L459-S539 VanDerWaalsContact CD1-OG 3.26Å; L459-S539 WeakPolarHBondContact CD1-OG 3.33Å; A535-S539 VanDerWaalsContact O-CB 3.29Å; A535-S539 WeakPolarHBondContact O-CB 3.3Å; A535-S539 PolarHBondContact O-N 3.23Å; A535-S539 VanDerWaalsContact O-N 3.11Å; A535-S539 PolarHBondContact O-OG 3.06Å; E536-S539 PolarHBondContact O-N 3.03Å; K537-S539 VanDerWaalsContact C-N 3.29Å; K537-S539 PolarHBondContact O-N 3.17Å; S539-A541 VanDerWaalsContact C-N 3.31Å; S539-A541 PolarHBondContact O-N 2.93Å; S539-M542 WeakPolarHBondContact O-CB 3.2Å; S539-M542 PolarHBondContact O-N 3.24Å; S539-M542 VanDerWaalsContact O-N 3.16Å; S539-F543 WeakPolarHBondContact O-CD1 3.4Å; S539-F543 WeakPolarHBondContact O-CD2 3.47Å; S539-F543 WeakPolarHBondContact O-CG 3.45Å; S539-F543 PolarHBondContact O-N 3.22Å
540	I	90.3	Very high	89.7	Confident	16 Å²	16	35.8 Å²	35.8	8%	0.082	19%	0.188	C	C	.	.	H	α-helix	trans	-60.8	-41.6	173.6	-69.3	167.7	0	0	0	110.3	E536 K537 M542 F543 V544 V708 A712 L713 A716	E536-I540 WeakPolarHBondContact O-CB 3.42Å; E536-I540 VanDerWaalsContact O-CG1 3.28Å; E536-I540 WeakPolarHBondContact O-CG1 3.45Å; E536-I540 PolarHBondContact O-N 2.94Å; K537-I540 PolarHBondContact O-N 2.79Å; I540-M542 VanDerWaalsContact C-N 3.33Å; I540-M542 PolarHBondContact O-N 3.31Å; I540-F543 HydrophobicContact CG1-CD2 4.5Å; I540-F543 PolarHBondContact O-N 2.95Å; I540-F543 VanDerWaalsContact O-N 3.14Å; I540-V544 HydrophobicContact CG2-CG2 4.34Å; I540-V544 WeakPolarHBondContact O-CB 3.44Å; I540-V544 WeakPolarHBondContact O-CG2 3.46Å; I540-V544 PolarHBondContact O-N 3.22Å; I540-V708 HydrophobicContact CG1-CG2 4.22Å; I540-A712 HydrophobicContact CD1-CB 3.96Å; I540-L713 HydrophobicContact CG1-CD1 4.22Å; I540-A716 HydrophobicContact CG2-CB 3.45Å; I540-A716 VanDerWaalsContact CG2-CB 3.45Å
541	A	87.2	Confident	89.8	Confident	46 Å²	46	28.8 Å²	28.8	38%	0.38	16%	0.158	S	C	.	.	H	α-helix	trans	-60.1	-38.7	174.5	0	0	0	0	0	112.8	K537 S539 R545	K537-A541 WeakPolarHBondContact O-CB 3.19Å; K537-A541 PolarHBondContact O-N 3.04Å; S539-A541 VanDerWaalsContact C-N 3.31Å; S539-A541 PolarHBondContact O-N 2.93Å; A541-R545 WeakPolarHBondContact O-CB 3.19Å; A541-R545 PolarHBondContact O-N 2.49Å
542	M	85.6	Confident	89.7	Confident	7 Å²	7	28.3 Å²	28.3	3%	0.034	16%	0.155	C	C	.	.	H	α-helix	trans	-64.9	-45.2	171.1	-74.8	-93.5	65.9	0	0	112.4	E538 S539 I540 V544 R545 N546 T935 L937	E538-M542 PolarHBondContact O-N 2.75Å; S539-M542 WeakPolarHBondContact O-CB 3.2Å; S539-M542 PolarHBondContact O-N 3.24Å; S539-M542 VanDerWaalsContact O-N 3.16Å; I540-M542 VanDerWaalsContact C-N 3.33Å; I540-M542 PolarHBondContact O-N 3.31Å; M542-V544 PolarHBondContact O-N 3.41Å; M542-R545 HydrophobicContact CE-CB 4.49Å; M542-R545 PolarHBondContact O-N 3.03Å; M542-N546 WeakPolarHBondContact O-CB 3.06Å; M542-N546 PolarHBondContact O-N 2.8Å; M542-N546 PolarHBondContact O-ND2 2.94Å; M542-T935 HydrophobicContact CE-CG2 3.81Å; M542-T935 HydrophobicContact SD-CG2 3.9Å; M542-L937 HydrophobicContact CG-CD2 3.31Å; M542-L937 HydrophobicContact CG-CG 3.88Å; M542-L937 HydrophobicContact SD-CD2 3.8Å; M542-L937 HydrophobicContact SD-CG 4.44Å
543	F	89.3	Confident	89.5	Confident	7 Å²	7	28.2 Å²	28.2	3%	0.031	16%	0.155	C	C	.	.	H	α-helix	trans	-62.8	-42.7	179.7	-55.7	-29.5	0	0	0	111.8	S539 I540 N546 L547 I701 T703 Q705 V708 L713 L717	S539-F543 WeakPolarHBondContact O-CD1 3.4Å; S539-F543 WeakPolarHBondContact O-CD2 3.47Å; S539-F543 WeakPolarHBondContact O-CG 3.45Å; S539-F543 PolarHBondContact O-N 3.22Å; I540-F543 HydrophobicContact CG1-CD2 4.5Å; I540-F543 PolarHBondContact O-N 2.95Å; I540-F543 VanDerWaalsContact O-N 3.14Å; F543-N546 PolarHBondContact O-N 3.03Å; F543-L547 WeakPolarHBondContact O-CB 3.26Å; F543-L547 PolarHBondContact O-N 2.97Å; F543-I701 HydrophobicContact CB-CB 4.44Å; F543-I701 HydrophobicContact CB-CD1 3.79Å; F543-I701 HydrophobicContact CB-CG1 3.92Å; F543-I701 HydrophobicContact CD1-CG1 4.4Å; F543-I701 HydrophobicContact CG-CD1 4.35Å; F543-I701 HydrophobicContact CG-CG1 4.18Å; F543-T703 VanDerWaalsContact CE1-O 3.3Å; F543-T703 WeakPolarHBondContact CE1-O 3.47Å; F543-T703 WeakPolarHBondContact CZ-O 3.39Å; F543-Q705 HydrophobicContact CE2-CB 4.21Å; F543-Q705 HydrophobicContact CZ-CB 4.22Å; F543-V708 HydrophobicContact CE2-CG1 4.31Å; F543-V708 HydrophobicContact CE2-CG2 4.11Å; F543-L713 HydrophobicContact CB-CD1 4.35Å; F543-L713 HydrophobicContact CD2-CD1 3.61Å; F543-L713 HydrophobicContact CE2-CD1 4.4Å; F543-L713 HydrophobicContact CG-CD1 4.43Å; F543-L717 HydrophobicContact CB-CD2 4.28Å
544	V	89.5	Confident	89.5	Confident	9 Å²	9	26.2 Å²	26.2	6%	0.055	14%	0.14	C	C	.	.	H	α-helix	trans	-52	-52.6	169.8	150.8	0	0	0	0	110.8	I540 M542 N546 L547 R548 A716 L717 V720	I540-V544 HydrophobicContact CG2-CG2 4.34Å; I540-V544 WeakPolarHBondContact O-CB 3.44Å; I540-V544 WeakPolarHBondContact O-CG2 3.46Å; I540-V544 PolarHBondContact O-N 3.22Å; M542-V544 PolarHBondContact O-N 3.41Å; V544-N546 PolarHBondContact O-N 3.39Å; V544-L547 PolarHBondContact O-N 2.72Å; V544-R548 WeakPolarHBondContact O-CB 3.24Å; V544-R548 PolarHBondContact O-N 2.8Å; V544-A716 HydrophobicContact CG2-CB 3.82Å; V544-L717 HydrophobicContact CG2-CD2 4.49Å; V544-V720 HydrophobicContact CB-CG2 3.92Å; V544-V720 HydrophobicContact CG1-CG2 3.48Å; V544-V720 VanDerWaalsContact CG1-CG2 3.48Å; V544-V720 HydrophobicContact CG2-CG2 3.75Å
545	R	85.5	Confident	89.6	Confident	32 Å²	32	24 Å²	24	12%	0.121	12%	0.121	C	C	.	.	H	α-helix	trans	-63.2	-43.3	179.2	178.4	174.5	176.6	168.9	-4.9	112.6	A541 M542 R548 Q549 L971 A972 L973	A541-R545 WeakPolarHBondContact O-CB 3.19Å; A541-R545 PolarHBondContact O-N 2.49Å; M542-R545 HydrophobicContact CE-CB 4.49Å; M542-R545 PolarHBondContact O-N 3.03Å; R545-R548 PolarHBondContact O-N 2.88Å; R545-Q549 WeakPolarHBondContact O-CG 3.25Å; R545-Q549 PolarHBondContact O-N 3.1Å; R545-Q549 VanDerWaalsContact O-N 3.1Å; R545-L971 PolarHBondContact NH1-O 3.35Å; R545-L971 PolarHBondContact NH2-O 3.23Å; R545-A972 PolarHBondContact NH2-O 3.45Å; R545-L973 PolarHBondContact NH2-O 3.13Å; R545-L973 VanDerWaalsContact NH2-O 3.14Å
546	N	87.3	Confident	89.5	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66	-39.7	-179.2	-68.5	-18.5	0	0	0	111.3	M542 F543 V544 R550 I701 N934 T935 P975	M542-N546 WeakPolarHBondContact O-CB 3.06Å; M542-N546 PolarHBondContact O-N 2.8Å; M542-N546 PolarHBondContact O-ND2 2.94Å; F543-N546 PolarHBondContact O-N 3.03Å; V544-N546 PolarHBondContact O-N 3.39Å; N546-R550 WeakPolarHBondContact O-CG 3.15Å; N546-R550 PolarHBondContact O-N 3.21Å; N546-I701 WeakPolarHBondContact CB-O 3.45Å; N546-I701 PolarHBondContact ND2-O 3.41Å; N546-N934 PolarHBondContact ND2-OD1 3.26Å; N546-T935 PolarHBondContact ND2-O 3.28Å; N546-P975 HydrophobicContact CB-CG 4.04Å; N546-P975 VanDerWaalsContact OD1-CD 3.28Å; N546-P975 WeakPolarHBondContact OD1-CD 3.39Å; N546-P975 VanDerWaalsContact OD1-CG 3.29Å; N546-P975 WeakPolarHBondContact OD1-CG 3.45Å
547	L	90.8	Very high	89.2	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65	-50.3	173.7	179.6	61.4	0	0	0	111.5	F543 V544 Q549 R550 L551 P696 I699 I701 L717 V720 V721	F543-L547 WeakPolarHBondContact O-CB 3.26Å; F543-L547 PolarHBondContact O-N 2.97Å; V544-L547 PolarHBondContact O-N 2.72Å; L547-Q549 VanDerWaalsContact C-N 3.28Å; L547-Q549 PolarHBondContact O-N 3.27Å; L547-R550 PolarHBondContact O-N 3.26Å; L547-L551 HydrophobicContact CD1-CD1 3.99Å; L547-L551 HydrophobicContact CD1-CD2 4.27Å; L547-L551 HydrophobicContact CD1-CG 3.92Å; L547-L551 HydrophobicContact CD2-CD1 4.4Å; L547-L551 HydrophobicContact CG-CD1 3.81Å; L547-L551 HydrophobicContact CG-CG 4.18Å; L547-L551 WeakPolarHBondContact O-CG 3.39Å; L547-L551 PolarHBondContact O-N 3.34Å; L547-P696 HydrophobicContact CD2-CB 3.88Å; L547-P696 HydrophobicContact CD2-CG 4.49Å; L547-I699 HydrophobicContact CD1-CD1 3.89Å; L547-I699 HydrophobicContact CD1-CG2 4.35Å; L547-I701 HydrophobicContact CB-CG2 4.2Å; L547-I701 HydrophobicContact CD1-CG2 4.31Å; L547-L717 HydrophobicContact CB-CD2 4.42Å; L547-L717 HydrophobicContact CD2-CB 3.89Å; L547-L717 HydrophobicContact CD2-CD2 3.78Å; L547-L717 HydrophobicContact CD2-CG 4.34Å; L547-V720 HydrophobicContact CD2-CB 4.47Å; L547-V720 HydrophobicContact CD2-CG1 4.31Å; L547-V720 HydrophobicContact CG-CG1 4.33Å; L547-V721 HydrophobicContact CD2-CG2 4.17Å
548	R	90.8	Very high	89.1	Confident	33 Å²	33	26.9 Å²	26.9	13%	0.125	15%	0.146	C	C	.	.	H	α-helix	trans	-51	-47.7	177.9	-179.4	-177.4	-72	119.9	1.7	111.6	D264 V544 R545 R550 L551 L552 V720 E723	D264-R548 VanDerWaalsContact CG-NH2 3.34Å; D264-R548 IonicContact OD1-CZ 3.38Å; D264-R548 IonicContact OD1-NH1 3.97Å; D264-R548 IonicContact OD1-NH2 3.23Å; D264-R548 PolarHBondContact OD1-NH2 3.38Å; D264-R548 IonicContact OD2-CZ 2.74Å; D264-R548 IonicContact OD2-NH1 2.86Å; D264-R548 PolarHBondContact OD2-NH1 2.73Å; D264-R548 IonicContact OD2-NH2 3.94Å; D264-R548 PolarHBondContact OD2-NH2 2.67Å; V544-R548 WeakPolarHBondContact O-CB 3.24Å; V544-R548 PolarHBondContact O-N 2.8Å; R545-R548 PolarHBondContact O-N 2.88Å; R548-R550 PolarHBondContact O-N 3.33Å; R548-L551 PolarHBondContact O-N 2.77Å; R548-L552 HydrophobicContact CG-CD1 3.77Å; R548-L552 WeakPolarHBondContact O-CB 3.29Å; R548-L552 WeakPolarHBondContact O-CG 3.18Å; R548-L552 PolarHBondContact O-N 2.98Å; R548-L552 VanDerWaalsContact O-N 3.08Å; R548-V720 HydrophobicContact CB-CG1 3.85Å; R548-E723 IonicContact CZ-OE1 2.81Å; R548-E723 IonicContact CZ-OE2 3.33Å; R548-E723 IonicContact NE-OE1 2.85Å; R548-E723 PolarHBondContact NE-OE1 2.78Å; R548-E723 IonicContact NE-OE2 3.66Å; R548-E723 IonicContact NH2-OE1 2.78Å; R548-E723 PolarHBondContact NH2-OE1 3.01Å; R548-E723 IonicContact NH2-OE2 2.73Å; R548-E723 PolarHBondContact NH2-OE2 2.87Å
549	Q	86.4	Confident	89.1	Confident	30 Å²	30	24.7 Å²	24.7	14%	0.14	14%	0.138	C	C	.	.	H	α-helix	trans	-61.9	-41.7	178.6	-73.1	-60.4	-24.4	0	0	112.9	R545 L547 L552 V553 P975	R545-Q549 WeakPolarHBondContact O-CG 3.25Å; R545-Q549 PolarHBondContact O-N 3.1Å; R545-Q549 VanDerWaalsContact O-N 3.1Å; L547-Q549 VanDerWaalsContact C-N 3.28Å; L547-Q549 PolarHBondContact O-N 3.27Å; Q549-L552 PolarHBondContact O-N 3.28Å; Q549-V553 WeakPolarHBondContact O-CG2 3.34Å; Q549-V553 PolarHBondContact O-N 2.76Å; Q549-P975 HydrophobicContact CB-CB 4.08Å; Q549-P975 VanDerWaalsContact CB-O 3.28Å; Q549-P975 WeakPolarHBondContact CB-O 3.24Å; Q549-P975 WeakPolarHBondContact CG-O 3.39Å; Q549-P975 PolarHBondContact OE1-O 3.11Å
550	R	88.4	Confident	89.3	Confident	38 Å²	38	25.5 Å²	25.5	14%	0.143	14%	0.143	C	C	.	.	H	α-helix	trans	-67.8	-38	178.5	-70.7	176.3	-178.9	176.4	7.5	113.2	N546 L547 R548 L552 N650 L691 I699 G700	N546-R550 WeakPolarHBondContact O-CG 3.15Å; N546-R550 PolarHBondContact O-N 3.21Å; L547-R550 PolarHBondContact O-N 3.26Å; R548-R550 PolarHBondContact O-N 3.33Å; R550-L552 VanDerWaalsContact C-N 3.33Å; R550-N650 PolarHBondContact NH1-ND2 2.71Å; R550-L691 HydrophobicContact CB-CD1 4.3Å; R550-I699 PolarHBondContact NH1-O 3.27Å; R550-G700 PolarHBondContact NH1-O 3.47Å; R550-G700 PolarHBondContact NH2-O 3.08Å; R550-G700 VanDerWaalsContact NH2-O 3.13Å
551	L	92.4	Very high	89.5	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-69.2	-31.4	177.1	-66.2	177.2	0	0	0	112.5	L547 R548 L688 L691 V692 V721 C724	L547-L551 HydrophobicContact CD1-CD1 3.99Å; L547-L551 HydrophobicContact CD1-CD2 4.27Å; L547-L551 HydrophobicContact CD1-CG 3.92Å; L547-L551 HydrophobicContact CD2-CD1 4.4Å; L547-L551 HydrophobicContact CG-CD1 3.81Å; L547-L551 HydrophobicContact CG-CG 4.18Å; L547-L551 WeakPolarHBondContact O-CG 3.39Å; L547-L551 PolarHBondContact O-N 3.34Å; R548-L551 PolarHBondContact O-N 2.77Å; L551-L688 HydrophobicContact CB-CD1 3.95Å; L551-L688 HydrophobicContact CD2-CD1 4.25Å; L551-L691 HydrophobicContact CD2-CB 3.76Å; L551-L691 HydrophobicContact CD2-CD1 4.18Å; L551-V692 HydrophobicContact CD2-CG1 4.48Å; L551-V721 HydrophobicContact CD1-CG2 3.9Å; L551-C724 HydrophobicContact CB-CB 4.11Å; L551-C724 HydrophobicContact CD1-CB 4.01Å
552	L	92.3	Very high	90	Very high	10 Å²	10	22.5 Å²	22.5	5%	0.052	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	5.2	-176.4	-61.5	178.3	0	0	0	114.5	R548 Q549 R550 C554 C724 V728 R904 F907	R548-L552 HydrophobicContact CG-CD1 3.77Å; R548-L552 WeakPolarHBondContact O-CB 3.29Å; R548-L552 WeakPolarHBondContact O-CG 3.18Å; R548-L552 PolarHBondContact O-N 2.98Å; R548-L552 VanDerWaalsContact O-N 3.08Å; Q549-L552 PolarHBondContact O-N 3.28Å; R550-L552 VanDerWaalsContact C-N 3.33Å; L552-C554 PolarHBondContact O-N 3.25Å; L552-C724 HydrophobicContact CD2-CB 4.03Å; L552-C724 HydrophobicContact CG-CB 4.44Å; L552-V728 HydrophobicContact CD2-CG2 3.65Å; L552-R904 HydrophobicContact CB-CG 4.36Å; L552-R904 HydrophobicContact CD2-CG 4.1Å; L552-R904 WeakPolarHBondContact O-CB 3.08Å; L552-R904 WeakPolarHBondContact O-CG 3.23Å; L552-F907 HydrophobicContact CB-CD1 3.7Å; L552-F907 HydrophobicContact CB-CD2 4.4Å; L552-F907 HydrophobicContact CB-CE1 3.55Å; L552-F907 HydrophobicContact CB-CE2 4.26Å; L552-F907 HydrophobicContact CB-CG 4.13Å; L552-F907 HydrophobicContact CB-CZ 3.85Å; L552-F907 HydrophobicContact CD1-CE1 3.74Å; L552-F907 HydrophobicContact CD1-CE2 4.35Å; L552-F907 HydrophobicContact CD1-CZ 3.53Å; L552-F907 HydrophobicContact CG-CE1 4.3Å; L552-F907 HydrophobicContact CG-CZ 4.29Å; L552-F907 WeakPolarHBondContact O-CB 3.37Å; L552-F907 VanDerWaalsContact O-CG 3.3Å; L552-F907 WeakPolarHBondContact O-CG 3.31Å
553	V	89.6	Confident	90.6	Very high	31 Å²	31	22.2 Å²	22.2	19%	0.188	12%	0.119	C	C	.	.	S	Bend	trans	-51.6	137.9	170.5	168.9	0	0	0	0	110.5	Q549 P687	Q549-V553 WeakPolarHBondContact O-CG2 3.34Å; Q549-V553 PolarHBondContact O-N 2.76Å; V553-P687 HydrophobicContact CB-CB 4.23Å; V553-P687 HydrophobicContact CB-CG 3.78Å; V553-P687 HydrophobicContact CG1-CG 3.8Å
554	C	90.4	Very high	91	Very high	19 Å²	19	21.9 Å²	21.9	13%	0.128	12%	0.118	C	C	.	.	B	Isolated β-bridge	trans	-67.2	125.2	-177	-173.8	0	0	0	0	111.4	L552 R904 F907 G908 Q909	L552-C554 PolarHBondContact O-N 3.25Å; C554-R904 VanDerWaalsContact CB-O 3.27Å; C554-R904 WeakPolarHBondContact CB-O 3.41Å; C554-F907 WeakPolarHBondContact CB-O 3.1Å; C554-G908 PolarHBondContact N-O 3.44Å; C554-Q909 HydrophobicContact CB-CB 4.02Å; C554-Q909 HydrophobicContact CB-CG 4.49Å
555	P	92.3	Very high	91.3	Very high	12 Å²	12	22.5 Å²	22.5	8%	0.078	12%	0.121	C	C	.	.	P	Polyproline II helix	trans	-68.1	146.3	-176.7	28.1	-36.4	0	0	0	113.2	R557 Q685 D686 Q909	P555-R557 HydrophobicContact CB-CG 4.19Å; P555-R557 HydrophobicContact CG-CG 4.45Å; P555-R557 PolarHBondContact O-N 2.72Å; P555-Q685 WeakPolarHBondContact CB-O 3.37Å; P555-D686 HydrophobicContact CB-CB 4.32Å; P555-Q909 PolarHBondContact O-NE2 3.15Å
556	V	91	Very high	91.7	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.012	12%	0.118	C	C	.	.			trans	-99.8	78.2	175.5	-172.1	0	0	0	0	110	I561 K614 V684 Q685 Q909 A910 F912	V556-I561 HydrophobicContact CB-CD1 4.46Å; V556-I561 HydrophobicContact CG1-CD1 4.27Å; V556-K614 HydrophobicContact CG1-CD 4.01Å; V556-K614 VanDerWaalsContact CG1-NZ 3.28Å; V556-V684 HydrophobicContact CB-CG1 3.96Å; V556-V684 WeakPolarHBondContact CB-O 3.42Å; V556-V684 HydrophobicContact CG2-CG1 3.59Å; V556-V684 WeakPolarHBondContact CG2-O 3.39Å; V556-V684 PolarHBondContact N-O 2.74Å; V556-Q685 PolarHBondContact N-O 3.45Å; V556-Q909 HydrophobicContact CG2-CG 3.78Å; V556-A910 HydrophobicContact CG2-CB 4.43Å; V556-F912 HydrophobicContact CG1-CE2 4.32Å; V556-F912 HydrophobicContact CG2-CE2 4.17Å
557	R	85.8	Confident	91.9	Very high	138 Å²	138	21.8 Å²	21.8	52%	0.521	12%	0.122	S	C	.	.			trans	-78	164.7	-178.3	-62.1	-173	179.3	147.7	9	113	P555 S559 D686 D902	P555-R557 HydrophobicContact CB-CG 4.19Å; P555-R557 HydrophobicContact CG-CG 4.45Å; P555-R557 PolarHBondContact O-N 2.72Å; R557-S559 PolarHBondContact O-N 2.64Å; R557-S559 VanDerWaalsContact O-N 3.16Å; R557-S559 PolarHBondContact O-OG 3.49Å; R557-D686 IonicContact NH2-OD2 3.99Å; R557-D686 PolarHBondContact NH2-OD2 2.98Å; R557-D902 IonicContact CZ-OD2 2.88Å; R557-D902 IonicContact NH1-OD2 3.9Å; R557-D902 IonicContact NH2-OD2 2.74Å; R557-D902 PolarHBondContact NH2-OD2 3.38Å
558	G	85.8	Confident	91.8	Very high	60 Å²	60	25.8 Å²	25.8	62%	0.619	14%	0.139	S	C	*	.	S	Bend	trans	70.8	9.7	167.4	0	0	0	0	0	116
559	S	89.4	Confident	91.6	Very high	21 Å²	21	35 Å²	35	15%	0.147	17%	0.174	C	C	.	.			trans	-120.8	141.3	-176.2	-52.3	0	0	0	0	111.6	R557 K614 Q685	R557-S559 PolarHBondContact O-N 2.64Å; R557-S559 VanDerWaalsContact O-N 3.16Å; R557-S559 PolarHBondContact O-OG 3.49Å; S559-K614 PolarHBondContact OG-NZ 3.49Å; S559-Q685 PolarHBondContact O-NE2 3.49Å
560	V	94.7	Very high	91.7	Very high	23 Å²	23	40.6 Å²	40.6	14%	0.139	20%	0.2	C	C	.	.			trans	-70.8	130.9	163.2	178.7	0	0	0	0	108.4	I576 L577 P579 C612	V560-I576 HydrophobicContact CG1-CG2 3.83Å; V560-L577 WeakPolarHBondContact CA-O 3.38Å; V560-L577 WeakPolarHBondContact CG1-O 2.8Å; V560-P579 HydrophobicContact CG2-CG 4.15Å; V560-C612 HydrophobicContact CG1-CB 3.79Å
561	I	96.1	Very high	91.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	134.8	-176	-62.9	-160.7	0	0	0	110.7	V556 L577 K614 V616 V684 Q685	V556-I561 HydrophobicContact CB-CD1 4.46Å; V556-I561 HydrophobicContact CG1-CD1 4.27Å; I561-L577 PolarHBondContact N-O 2.87Å; I561-L577 PolarHBondContact O-N 3.13Å; I561-K614 WeakPolarHBondContact CA-O 3.34Å; I561-K614 HydrophobicContact CD1-CB 4.5Å; I561-K614 HydrophobicContact CD1-CD 4.48Å; I561-K614 HydrophobicContact CG1-CB 4.07Å; I561-V616 HydrophobicContact CG2-CB 4.17Å; I561-V616 HydrophobicContact CG2-CG2 3.42Å; I561-V616 VanDerWaalsContact CG2-CG2 3.42Å; I561-V684 HydrophobicContact CD1-CG1 4.2Å; I561-Q685 HydrophobicContact CD1-CG 3.73Å; I561-Q685 HydrophobicContact CG1-CG 4.23Å
562	M	97.6	Very high	92	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	108	166.9	179.2	-178.5	-74.3	0	0	109.7	V564 L574 A575 I576 L603 M607 C612 K614 V615 V616 F630	M562-V564 HydrophobicContact CG-CG2 4.02Å; M562-V564 HydrophobicContact SD-CG2 4.3Å; M562-L574 HydrophobicContact SD-CD1 4.49Å; M562-L574 HydrophobicContact SD-CD2 4.17Å; M562-A575 CarbonylContact C-O 3.57Å; M562-A575 WeakPolarHBondContact CA-O 3.36Å; M562-I576 HydrophobicContact CB-CG1 4.41Å; M562-I576 HydrophobicContact CE-CD1 3.74Å; M562-I576 HydrophobicContact CE-CG1 3.87Å; M562-I576 HydrophobicContact CG-CG1 4.36Å; M562-L603 HydrophobicContact CE-CD2 4.14Å; M562-L603 HydrophobicContact SD-CD2 4.04Å; M562-M607 HydrophobicContact CE-CG 3.68Å; M562-M607 HydrophobicContact CE-SD 4.35Å; M562-C612 PolarHBondContact N-SG 2.86Å; M562-C612 VanDerWaalsContact N-SG 3.39Å; M562-K614 PolarHBondContact N-O 3.07Å; M562-V615 CarbonylContact O-C 3.53Å; M562-V615 WeakPolarHBondContact O-CA 3.45Å; M562-V616 PolarHBondContact O-N 3.05Å; M562-F630 HydrophobicContact SD-CE1 4.49Å; M562-F630 HydrophobicContact SD-CZ 4.24Å
563	G	97.2	Very high	92.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	135.2	165.8	0	0	0	0	0	110.9	L574 A575 V616	G563-L574 WeakPolarHBondContact O-CA 3.34Å; G563-A575 PolarHBondContact N-O 2.77Å; G563-A575 PolarHBondContact O-N 3.2Å; G563-V616 CarbonylContact C-O 3.37Å
564	V	97.1	Very high	92.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	114.5	-178.1	-173.7	0	0	0	0	109	M562 P566 C572 K573 L574 V615 V616 I617 G618 T626 F630	M562-V564 HydrophobicContact CG-CG2 4.02Å; M562-V564 HydrophobicContact SD-CG2 4.3Å; V564-P566 WeakPolarHBondContact O-CD 3.33Å; V564-C572 HydrophobicContact CG1-CB 4.25Å; V564-K573 CarbonylContact C-O 3.44Å; V564-K573 WeakPolarHBondContact CA-O 3.41Å; V564-L574 HydrophobicContact CB-CD2 4.28Å; V564-L574 HydrophobicContact CG1-CD2 3.95Å; V564-L574 HydrophobicContact CG2-CD2 3.79Å; V564-V615 HydrophobicContact CG2-CG1 3.65Å; V564-V616 PolarHBondContact N-O 2.91Å; V564-I617 HydrophobicContact CB-CG1 4.47Å; V564-G618 PolarHBondContact O-N 2.8Å; V564-T626 HydrophobicContact CG1-CG2 3.83Å; V564-F630 HydrophobicContact CG1-CE2 4.35Å; V564-F630 HydrophobicContact CG2-CE2 4.12Å; V564-F630 HydrophobicContact CG2-CZ 4.18Å
565	D	96.2	Very high	92.9	Very high	23 Å²	23	36.9 Å²	36.9	12%	0.123	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	105.9	169.8	-175.5	9.7	0	0	0	108.6	C572 K573 S676 A677 I680	D565-C572 CarbonylContact O-C 3.41Å; D565-C572 VanDerWaalsContact O-CA 3.23Å; D565-C572 WeakPolarHBondContact O-CA 3.36Å; D565-K573 HydrophobicContact CB-CB 4.16Å; D565-K573 HydrophobicContact CB-CD 4.4Å; D565-K573 PolarHBondContact N-O 2.72Å; D565-K573 PolarHBondContact O-N 2.91Å; D565-S676 VanDerWaalsContact OD2-CB 3.27Å; D565-S676 WeakPolarHBondContact OD2-CB 3.36Å; D565-S676 PolarHBondContact OD2-OG 3.4Å; D565-A677 HydrophobicContact CB-CB 3.97Å; D565-I680 HydrophobicContact CB-CD1 3.76Å
566	P	93.9	Very high	93.1	Very high	8 Å²	8	36.4 Å²	36.4	5%	0.052	18%	0.177	C	C	.	.			trans	-67.7	156.2	-172.1	-21.7	36.2	0	0	0	113.6	V564 I617 G618 T621 A622 C623	V564-P566 WeakPolarHBondContact O-CD 3.33Å; P566-I617 HydrophobicContact CG-CG2 3.74Å; P566-G618 VanDerWaalsContact CG-O 3.3Å; P566-G618 WeakPolarHBondContact CG-O 3.49Å; P566-T621 CarbonylContact C-O 3.52Å; P566-T621 WeakPolarHBondContact CB-O 3.41Å; P566-A622 HydrophobicContact CB-CB 4.3Å; P566-C623 HydrophobicContact CG-CB 4.35Å
567	G	91.7	Very high	93.4	Very high	8 Å²	8	36.3 Å²	36.3	8%	0.082	18%	0.176	C	C	.	.			trans	-179	146.9	171.6	0	0	0	0	0	114.5	G571 C572 H592	G567-G571 WeakPolarHBondContact CA-O 3.45Å; G567-G571 CarbonylContact O-C 3.32Å; G567-C572 PolarHBondContact N-SG 3.12Å; G567-C572 VanDerWaalsContact N-SG 3.36Å; G567-H592 PolarHBondContact O-CD2 3.35Å
568	F	88.9	Confident	93.8	Very high	85 Å²	85	30.1 Å²	30.1	37%	0.373	15%	0.154	S	C	.	.	S	Bend	trans	-78.6	-86.1	175.7	-60.3	-66.3	0	0	0	111.9	H570 G571 H592 T621 A622 E625	F568-H570 VanDerWaalsContact C-N 3.33Å; F568-H570 PolarHBondContact O-N 3.33Å; F568-G571 PolarHBondContact O-N 3.33Å; F568-H592 HydrophobicContact CD1-CB 4.18Å; F568-H592 AromaticContact CD1-CD2 3.79Å; F568-T621 HydrophobicContact CD2-CG2 3.83Å; F568-T621 HydrophobicContact CE2-CG2 3.8Å; F568-A622 HydrophobicContact CD1-CB 3.71Å; F568-A622 HydrophobicContact CD2-CB 3.82Å; F568-A622 HydrophobicContact CE1-CB 3.51Å; F568-A622 HydrophobicContact CE2-CB 3.63Å; F568-A622 HydrophobicContact CG-CB 3.86Å; F568-A622 HydrophobicContact CZ-CB 3.47Å; F568-A622 VanDerWaalsContact CZ-CB 3.47Å; F568-E625 HydrophobicContact CE1-CB 4.39Å; F568-E625 HydrophobicContact CE1-CG 3.96Å; F568-E625 HydrophobicContact CZ-CG 4.33Å
569	R	86.8	Confident	94.1	Very high	227 Å²	227	30.4 Å²	30.4	86%	0.857	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-34.3	-168.2	-65.1	-176	-178.6	179.8	2.2	114.2
570	H	88.1	Confident	94.1	Very high	147 Å²	147	34.1 Å²	34.1	68%	0.681	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.8	16	-177.6	-59.2	-70.8	0	0	0	112.9	F568 K573	F568-H570 VanDerWaalsContact C-N 3.33Å; F568-H570 PolarHBondContact O-N 3.33Å; H570-K573 WeakPolarHBondContact O-CE 3.24Å; H570-K573 PolarHBondContact O-NZ 2.75Å
571	G	91.7	Very high	93.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.172	C	C	.	.			trans	66.4	173.5	-176.2	0	0	0	0	0	113.9	G567 F568 K573 V589	G567-G571 WeakPolarHBondContact CA-O 3.45Å; G567-G571 CarbonylContact O-C 3.32Å; F568-G571 PolarHBondContact O-N 3.33Å; G571-K573 WeakPolarHBondContact O-CE 3.45Å; G571-K573 PolarHBondContact O-NZ 2.75Å; G571-V589 WeakPolarHBondContact CA-O 3.31Å
572	C	94.9	Very high	93.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	134.4	169.1	-57.5	0	0	0	0	108.5	V564 D565 G567 V588 V589 L591 T626	V564-C572 HydrophobicContact CG1-CB 4.25Å; D565-C572 CarbonylContact O-C 3.41Å; D565-C572 VanDerWaalsContact O-CA 3.23Å; D565-C572 WeakPolarHBondContact O-CA 3.36Å; G567-C572 PolarHBondContact N-SG 3.12Å; G567-C572 VanDerWaalsContact N-SG 3.36Å; C572-V588 WeakPolarHBondContact O-CA 3.43Å; C572-V589 HydrophobicContact CB-CG2 4.15Å; C572-V589 PolarHBondContact N-O 3.38Å; C572-V589 PolarHBondContact O-N 3.33Å; C572-L591 HydrophobicContact CB-CD1 4.21Å; C572-L591 HydrophobicContact CB-CG 4.39Å; C572-T626 PolarHBondContact SG-OG1 3.19Å; C572-T626 VanDerWaalsContact SG-OG1 3.36Å
573	K	96.4	Very high	93.6	Very high	19 Å²	19	43.9 Å²	43.9	8%	0.083	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	139.1	179.2	-61.1	94.6	-165	158.9	0	109.7	V564 D565 H570 G571 V588 N673 L674 A677	V564-K573 CarbonylContact C-O 3.44Å; V564-K573 WeakPolarHBondContact CA-O 3.41Å; D565-K573 HydrophobicContact CB-CB 4.16Å; D565-K573 HydrophobicContact CB-CD 4.4Å; D565-K573 PolarHBondContact N-O 2.72Å; D565-K573 PolarHBondContact O-N 2.91Å; H570-K573 WeakPolarHBondContact O-CE 3.24Å; H570-K573 PolarHBondContact O-NZ 2.75Å; G571-K573 WeakPolarHBondContact O-CE 3.45Å; G571-K573 PolarHBondContact O-NZ 2.75Å; K573-V588 HydrophobicContact CG-CG2 4.11Å; K573-N673 VanDerWaalsContact CB-O 3.25Å; K573-N673 WeakPolarHBondContact CB-O 3.33Å; K573-N673 HydrophobicContact CD-CB 4.05Å; K573-N673 WeakPolarHBondContact CD-O 3.24Å; K573-N673 HydrophobicContact CG-CB 4.15Å; K573-N673 WeakPolarHBondContact CG-O 3.41Å; K573-L674 HydrophobicContact CB-CD2 4.01Å; K573-L674 HydrophobicContact CG-CD2 4.18Å; K573-A677 HydrophobicContact CB-CB 4.05Å; K573-A677 WeakPolarHBondContact O-CB 3.23Å
574	L	97	Very high	93.5	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	141.2	-174.5	-54.6	-178.3	0	0	0	110.3	M562 G563 V564 T586 D587 V589 L603	M562-L574 HydrophobicContact SD-CD1 4.49Å; M562-L574 HydrophobicContact SD-CD2 4.17Å; G563-L574 WeakPolarHBondContact O-CA 3.34Å; V564-L574 HydrophobicContact CB-CD2 4.28Å; V564-L574 HydrophobicContact CG1-CD2 3.95Å; V564-L574 HydrophobicContact CG2-CD2 3.79Å; L574-T586 VanDerWaalsContact O-CA 3.23Å; L574-T586 WeakPolarHBondContact O-CA 3.45Å; L574-D587 HydrophobicContact CB-CB 4.41Å; L574-D587 HydrophobicContact CD1-CB 4.46Å; L574-D587 PolarHBondContact N-O 2.72Å; L574-D587 PolarHBondContact O-N 3.27Å; L574-V589 HydrophobicContact CD1-CB 4.37Å; L574-V589 HydrophobicContact CD1-CG1 3.63Å; L574-V589 HydrophobicContact CD1-CG2 3.75Å; L574-V589 HydrophobicContact CD2-CG2 4.03Å; L574-V589 HydrophobicContact CG-CG1 4.44Å; L574-V589 HydrophobicContact CG-CG2 3.9Å; L574-L603 HydrophobicContact CD1-CD2 3.6Å
575	A	97.4	Very high	93.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	119.3	166.5	0	0	0	0	0	109.9	M562 G563 L577 H585 T586 A677 V678	M562-A575 CarbonylContact C-O 3.57Å; M562-A575 WeakPolarHBondContact CA-O 3.36Å; G563-A575 PolarHBondContact N-O 2.77Å; G563-A575 PolarHBondContact O-N 3.2Å; A575-L577 HydrophobicContact CB-CD2 4.49Å; A575-H585 CarbonylContact C-O 3.5Å; A575-H585 WeakPolarHBondContact CA-O 3.37Å; A575-T586 HydrophobicContact CB-CG2 4.23Å; A575-A677 HydrophobicContact CB-CB 4.02Å; A575-V678 HydrophobicContact CB-CB 4.24Å; A575-V678 HydrophobicContact CB-CG2 3.55Å
576	I	97.7	Very high	93.5	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124	173.1	-57	179.1	0	0	0	108	V560 M562 L584 H585 L606 Y610	V560-I576 HydrophobicContact CG1-CG2 3.83Å; M562-I576 HydrophobicContact CB-CG1 4.41Å; M562-I576 HydrophobicContact CE-CD1 3.74Å; M562-I576 HydrophobicContact CE-CG1 3.87Å; M562-I576 HydrophobicContact CG-CG1 4.36Å; I576-L584 HydrophobicContact CG2-CB 4.34Å; I576-L584 HydrophobicContact CG2-CD1 4.34Å; I576-L584 PolarHBondContact O-N 2.73Å; I576-H585 HydrophobicContact CB-CB 4.21Å; I576-H585 HydrophobicContact CD1-CB 4.3Å; I576-H585 HydrophobicContact CG1-CB 4.45Å; I576-H585 PolarHBondContact N-O 3.07Å; I576-H585 PolarHBondContact O-N 3.44Å; I576-L606 HydrophobicContact CD1-CB 4.04Å; I576-Y610 HydrophobicContact CD1-CD2 3.53Å; I576-Y610 HydrophobicContact CD1-CE2 4.12Å; I576-Y610 HydrophobicContact CD1-CG 4.35Å; I576-Y610 HydrophobicContact CG2-CD2 4.29Å; I576-Y610 HydrophobicContact CG2-CG 4.11Å
577	L	96.9	Very high	93.6	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	136.1	-174.4	-55.2	178.4	0	0	0	110.4	V560 I561 A575 Q582 I583 V678 R682	V560-L577 WeakPolarHBondContact CA-O 3.38Å; V560-L577 WeakPolarHBondContact CG1-O 2.8Å; I561-L577 PolarHBondContact N-O 2.87Å; I561-L577 PolarHBondContact O-N 3.13Å; A575-L577 HydrophobicContact CB-CD2 4.49Å; L577-Q582 CarbonylContact C-O 3.48Å; L577-Q582 WeakPolarHBondContact CA-O 3.18Å; L577-I583 HydrophobicContact CD2-CG1 4.1Å; L577-V678 HydrophobicContact CD2-CG1 4.18Å; L577-R682 HydrophobicContact CD1-CG 3.75Å
578	S	95.2	Very high	93.8	Very high	8 Å²	8	53.8 Å²	53.8	6%	0.056	27%	0.268	C	S	.	.			trans	-65.9	168.2	172.7	78.3	0	0	0	0	111.8	T580 S581 Q582 Q685	S578-T580 PolarHBondContact O-N 3.35Å; S578-T580 PolarHBondContact OG-N 3.41Å; S578-T580 VanDerWaalsContact OG-N 3.17Å; S578-T580 PolarHBondContact OG-OG1 2.69Å; S578-S581 PolarHBondContact O-N 3.04Å; S578-S581 PolarHBondContact OG-N 2.97Å; S578-Q582 PolarHBondContact N-O 3.49Å; S578-Q582 WeakPolarHBondContact OG-CB 3.31Å; S578-Q582 PolarHBondContact OG-N 2.9Å; S578-Q685 PolarHBondContact O-NE2 3.15Å
579	P	91.8	Very high	94.1	Very high	65 Å²	65	49.8 Å²	49.8	42%	0.422	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-14.7	171.6	-25.9	37.6	0	0	0	114.9	V560	V560-P579 HydrophobicContact CG2-CG 4.15Å
580	T	88.1	Confident	94.4	Very high	99 Å²	99	42.6 Å²	42.6	61%	0.607	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.9	19.1	179	55	0	0	0	0	113	S578 Q582	S578-T580 PolarHBondContact O-N 3.35Å; S578-T580 PolarHBondContact OG-N 3.41Å; S578-T580 VanDerWaalsContact OG-N 3.17Å; S578-T580 PolarHBondContact OG-OG1 2.69Å; T580-Q582 PolarHBondContact O-N 3.36Å; T580-Q582 VanDerWaalsContact O-N 3.14Å
581	S	90.3	Very high	94.4	Very high	37 Å²	37	35.6 Å²	35.6	26%	0.259	19%	0.193	S	C	.	.	S	Bend	trans	62.4	14.4	179.1	-52.6	0	0	0	0	116.4	S578 R682 Q685	S578-S581 PolarHBondContact O-N 3.04Å; S578-S581 PolarHBondContact OG-N 2.97Å; S581-R682 PolarHBondContact O-NE 2.91Å; S581-R682 PolarHBondContact O-NH2 2.76Å; S581-R682 VanDerWaalsContact O-NH2 3.1Å; S581-Q685 VanDerWaalsContact CA-OE1 3.28Å; S581-Q685 VanDerWaalsContact CB-OE1 3.27Å; S581-Q685 PolarHBondContact OG-OE1 3.48Å
582	Q	92.6	Very high	94	Very high	128 Å²	128	37.8 Å²	37.8	60%	0.598	20%	0.203	S	C	*	.			trans	-73.2	143.5	168.7	-61.2	177.8	-17.8	0	0	109.7	L577 S578 T580 L584	L577-Q582 CarbonylContact C-O 3.48Å; L577-Q582 WeakPolarHBondContact CA-O 3.18Å; S578-Q582 PolarHBondContact N-O 3.49Å; S578-Q582 WeakPolarHBondContact OG-CB 3.31Å; S578-Q582 PolarHBondContact OG-N 2.9Å; T580-Q582 PolarHBondContact O-N 3.36Å; T580-Q582 VanDerWaalsContact O-N 3.14Å; Q582-L584 PolarHBondContact O-N 3.45Å
583	I	95.6	Very high	93.4	Very high	64 Å²	64	41.8 Å²	41.8	33%	0.328	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	119	179.6	-56.4	167.5	0	0	0	108.1	L577 T586 M667 L670 V678	L577-I583 HydrophobicContact CD2-CG1 4.1Å; I583-T586 HydrophobicContact CG2-CG2 3.66Å; I583-M667 HydrophobicContact CD1-CG 3.94Å; I583-M667 HydrophobicContact CD1-SD 3.76Å; I583-L670 HydrophobicContact CD1-CD2 4.31Å; I583-V678 HydrophobicContact CD1-CG1 4.14Å; I583-V678 HydrophobicContact CD1-CG2 3.84Å; I583-V678 HydrophobicContact CG1-CG1 4.19Å; I583-V678 HydrophobicContact CG1-CG2 4.08Å
584	L	95.9	Very high	92.3	Very high	70 Å²	70	47.4 Å²	47.4	37%	0.366	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-38.4	176.9	-62.1	178.4	0	0	0	111.6	I576 Q582 Y610	I576-L584 HydrophobicContact CG2-CB 4.34Å; I576-L584 HydrophobicContact CG2-CD1 4.34Å; I576-L584 PolarHBondContact O-N 2.73Å; Q582-L584 PolarHBondContact O-N 3.45Å; L584-Y610 HydrophobicContact CB-CD1 3.99Å; L584-Y610 HydrophobicContact CB-CE1 4.06Å; L584-Y610 HydrophobicContact CD1-CD1 4.13Å
585	H	96.5	Very high	91.4	Very high	53 Å²	53	48.8 Å²	48.8	25%	0.245	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	151.6	-178.9	-166.6	67.6	0	0	0	111.5	A575 I576 D587 L606 Y610	A575-H585 CarbonylContact C-O 3.5Å; A575-H585 WeakPolarHBondContact CA-O 3.37Å; I576-H585 HydrophobicContact CB-CB 4.21Å; I576-H585 HydrophobicContact CD1-CB 4.3Å; I576-H585 HydrophobicContact CG1-CB 4.45Å; I576-H585 PolarHBondContact N-O 3.07Å; I576-H585 PolarHBondContact O-N 3.44Å; H585-D587 IonicContact NE2-OD2 2.97Å; H585-L606 WeakPolarHBondContact NE2-CD2 3.3Å; H585-Y610 HydrophobicContact CB-CD2 4.4Å; H585-Y610 HydrophobicContact CB-CE2 3.64Å; H585-Y610 AromaticContact CG-CE2 3.95Å
586	T	97.1	Very high	90.8	Very high	40 Å²	40	52.6 Å²	52.6	25%	0.245	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	140.4	174	54.4	0	0	0	0	110.4	L574 A575 I583 L670 V678	L574-T586 VanDerWaalsContact O-CA 3.23Å; L574-T586 WeakPolarHBondContact O-CA 3.45Å; A575-T586 HydrophobicContact CB-CG2 4.23Å; I583-T586 HydrophobicContact CG2-CG2 3.66Å; T586-L670 HydrophobicContact CG2-CD1 4.06Å; T586-L670 HydrophobicContact CG2-CD2 4.29Å; T586-V678 HydrophobicContact CG2-CG2 4.46Å
587	D	95.9	Very high	90.3	Very high	37 Å²	37	58.5 Å²	58.5	20%	0.198	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	170.6	-173.4	-151.4	-26.9	0	0	0	111.9	L574 H585 K602 L674	L574-D587 HydrophobicContact CB-CB 4.41Å; L574-D587 HydrophobicContact CD1-CB 4.46Å; L574-D587 PolarHBondContact N-O 2.72Å; L574-D587 PolarHBondContact O-N 3.27Å; H585-D587 IonicContact NE2-OD2 2.97Å; D587-K602 IonicContact OD1-NZ 2.96Å; D587-K602 PolarHBondContact OD1-NZ 2.73Å; D587-K602 WeakPolarHBondContact OD2-CE 3.26Å; D587-K602 IonicContact OD2-NZ 3.06Å; D587-K602 PolarHBondContact OD2-NZ 3.14Å; D587-L674 WeakPolarHBondContact O-CD2 3.26Å
588	V	95.3	Very high	90	Very high	47 Å²	47	66.7 Å²	66.7	29%	0.285	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	132.8	171.5	-172.6	0	0	0	0	109.3	C572 K573 F590 K602 L674	C572-V588 WeakPolarHBondContact O-CA 3.43Å; K573-V588 HydrophobicContact CG-CG2 4.11Å; V588-F590 HydrophobicContact CG1-CE2 4.27Å; V588-F590 HydrophobicContact CG1-CZ 4.28Å; V588-K602 PolarHBondContact O-NZ 2.91Å; V588-L674 HydrophobicContact CG2-CD2 3.89Å
589	V	94.3	Very high	89.9	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	141.3	-177	-64.9	0	0	0	0	111.5	G571 C572 L574 L591 E599 K602	G571-V589 WeakPolarHBondContact CA-O 3.31Å; C572-V589 HydrophobicContact CB-CG2 4.15Å; C572-V589 PolarHBondContact N-O 3.38Å; C572-V589 PolarHBondContact O-N 3.33Å; L574-V589 HydrophobicContact CD1-CB 4.37Å; L574-V589 HydrophobicContact CD1-CG1 3.63Å; L574-V589 HydrophobicContact CD1-CG2 3.75Å; L574-V589 HydrophobicContact CD2-CG2 4.03Å; L574-V589 HydrophobicContact CG-CG1 4.44Å; L574-V589 HydrophobicContact CG-CG2 3.9Å; V589-L591 HydrophobicContact CB-CD2 3.97Å; V589-L591 HydrophobicContact CG2-CD1 4.37Å; V589-L591 HydrophobicContact CG2-CD2 3.6Å; V589-L591 HydrophobicContact CG2-CG 3.91Å; V589-L591 PolarHBondContact O-N 3.44Å; V589-E599 WeakPolarHBondContact CB-OE2 3.3Å; V589-E599 WeakPolarHBondContact CG1-OE2 3.31Å; V589-K602 HydrophobicContact CG1-CD 4.21Å
590	F	93.2	Very high	89.9	Confident	76 Å²	76	64.7 Å²	64.7	33%	0.333	35%	0.346	S	S	.	.			trans	-104.5	69.6	-174.2	-67.4	-88.1	0	0	0	112.4	V588 H592 N593 E599	V588-F590 HydrophobicContact CG1-CE2 4.27Å; V588-F590 HydrophobicContact CG1-CZ 4.28Å; F590-H592 PolarHBondContact O-N 3.15Å; F590-H592 VanDerWaalsContact O-N 3.17Å; F590-N593 HydrophobicContact CB-CB 4.45Å; F590-N593 PolarHBondContact O-N 2.95Å; F590-E599 PolarHBondContact N-OE1 3.04Å
591	L	88.6	Confident	90.3	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-23	-172.5	-50.8	-174.7	0	0	0	114.4	C572 V589 Q596 E599 L603 T626 F629 F630	C572-L591 HydrophobicContact CB-CD1 4.21Å; C572-L591 HydrophobicContact CB-CG 4.39Å; V589-L591 HydrophobicContact CB-CD2 3.97Å; V589-L591 HydrophobicContact CG2-CD1 4.37Å; V589-L591 HydrophobicContact CG2-CD2 3.6Å; V589-L591 HydrophobicContact CG2-CG 3.91Å; V589-L591 PolarHBondContact O-N 3.44Å; L591-Q596 WeakPolarHBondContact O-CG 3.34Å; L591-Q596 PolarHBondContact O-NE2 3.05Å; L591-E599 HydrophobicContact CD2-CB 4.02Å; L591-L603 HydrophobicContact CD2-CD1 4.01Å; L591-T626 HydrophobicContact CD1-CG2 4Å; L591-F629 HydrophobicContact CB-CD1 4.32Å; L591-F629 HydrophobicContact CB-CG 4.46Å; L591-F629 HydrophobicContact CD1-CD1 3.98Å; L591-F629 HydrophobicContact CD1-CE1 4.48Å; L591-F629 HydrophobicContact CD2-CD1 4.01Å; L591-F629 HydrophobicContact CD2-CE1 3.7Å; L591-F629 HydrophobicContact CD2-CZ 4.35Å; L591-F629 HydrophobicContact CG-CD1 4.31Å; L591-F629 HydrophobicContact CG-CE1 4.47Å; L591-F630 HydrophobicContact CD1-CE2 4.1Å
592	H	83.7	Confident	90.5	Very high	47 Å²	47	65.8 Å²	65.8	22%	0.218	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	6.4	-170.4	-53.6	-38.2	0	0	0	114	G567 F568 F590 E625 T626	G567-H592 PolarHBondContact O-CD2 3.35Å; F568-H592 HydrophobicContact CD1-CB 4.18Å; F568-H592 AromaticContact CD1-CD2 3.79Å; F590-H592 PolarHBondContact O-N 3.15Å; F590-H592 VanDerWaalsContact O-N 3.17Å; H592-E625 WeakPolarHBondContact CE1-CB 3.35Å; H592-T626 PolarHBondContact CE1-N 2.75Å; H592-T626 PolarHBondContact CE1-OG1 3.3Å; H592-T626 PolarHBondContact NE2-OG1 3.44Å
593	N	81.4	Confident	90.7	Very high	83 Å²	83	59.7 Å²	59.7	44%	0.444	32%	0.316	S	S	.	.	S	Bend	trans	-108.4	169.2	-178.7	-67.1	-14.3	0	0	0	111	F590 G595 Q596	F590-N593 HydrophobicContact CB-CB 4.45Å; F590-N593 PolarHBondContact O-N 2.95Å; N593-G595 PolarHBondContact O-N 2.85Å; N593-Q596 WeakPolarHBondContact O-CG 3.48Å; N593-Q596 PolarHBondContact O-N 2.82Å
594	S	73	Confident	90.6	Very high	138 Å²	138	62.3 Å²	62.3	97%	0.965	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-6.2	179.6	54.4	0	0	0	0	116.1
595	G	79.3	Confident	90.6	Very high	31 Å²	31	64.7 Å²	64.7	32%	0.32	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	3.5	177.1	0	0	0	0	0	116.2	N593 Q597 K598 E599	N593-G595 PolarHBondContact O-N 2.85Å; G595-Q597 VanDerWaalsContact C-N 3.26Å; G595-Q597 PolarHBondContact O-N 3.03Å; G595-K598 WeakPolarHBondContact O-CB 2.99Å; G595-K598 PolarHBondContact O-N 3.3Å; G595-E599 PolarHBondContact O-N 2.75Å
596	Q	83.9	Confident	90.6	Very high	80 Å²	80	62.8 Å²	62.8	37%	0.374	32%	0.323	S	S	.	.	H	α-helix	trans	-43.2	-42.8	-167.9	-50.9	-166.3	-52.2	0	0	115.6	L591 N593 K598 E599 A600 F629	L591-Q596 WeakPolarHBondContact O-CG 3.34Å; L591-Q596 PolarHBondContact O-NE2 3.05Å; N593-Q596 WeakPolarHBondContact O-CG 3.48Å; N593-Q596 PolarHBondContact O-N 2.82Å; Q596-K598 VanDerWaalsContact C-N 3.34Å; Q596-K598 PolarHBondContact O-N 3.01Å; Q596-E599 PolarHBondContact O-N 3.06Å; Q596-A600 PolarHBondContact O-N 3.48Å; Q596-F629 HydrophobicContact CB-CE2 3.94Å
597	Q	86.9	Confident	90.5	Very high	125 Å²	125	60.9 Å²	60.9	58%	0.584	31%	0.311	S	S	*	.	H	α-helix	trans	-66.2	-32.4	-178.5	-66.3	-60.8	-37.2	0	0	113.3	G595 V601	G595-Q597 VanDerWaalsContact C-N 3.26Å; G595-Q597 PolarHBondContact O-N 3.03Å; Q597-V601 WeakPolarHBondContact O-CG2 3.16Å; Q597-V601 PolarHBondContact O-N 3.21Å
598	K	91.1	Very high	90.5	Very high	173 Å²	173	61.9 Å²	61.9	75%	0.752	32%	0.324	S	S	*	.	H	α-helix	trans	-69.2	-41.2	174.7	-63.9	-175.3	178.2	-177.2	0	110.8	G595 Q596 V601 K602	G595-K598 WeakPolarHBondContact O-CB 2.99Å; G595-K598 PolarHBondContact O-N 3.3Å; Q596-K598 VanDerWaalsContact C-N 3.34Å; Q596-K598 PolarHBondContact O-N 3.01Å; K598-V601 PolarHBondContact O-N 3.36Å; K598-K602 WeakPolarHBondContact O-CB 3.35Å; K598-K602 PolarHBondContact O-N 3.27Å
599	E	93.3	Very high	90.5	Very high	31 Å²	31	63.3 Å²	63.3	15%	0.145	33%	0.333	C	S	.	.	H	α-helix	trans	-67.2	-36.5	176.1	-56.6	-64.4	179.7	0	0	111.7	V589 F590 L591 G595 Q596 K602 L603	V589-E599 WeakPolarHBondContact CB-OE2 3.3Å; V589-E599 WeakPolarHBondContact CG1-OE2 3.31Å; F590-E599 PolarHBondContact N-OE1 3.04Å; L591-E599 HydrophobicContact CD2-CB 4.02Å; G595-E599 PolarHBondContact O-N 2.75Å; Q596-E599 PolarHBondContact O-N 3.06Å; E599-K602 WeakPolarHBondContact O-CB 3.19Å; E599-K602 PolarHBondContact O-N 3.42Å; E599-L603 WeakPolarHBondContact O-CB 3.32Å; E599-L603 WeakPolarHBondContact O-CG 3.44Å; E599-L603 PolarHBondContact O-N 3.49Å
600	A	93	Very high	90.6	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-59.2	-48.4	173.1	0	0	0	0	0	111.9	Q596 K602 L603 R604 F629 L633 Y638	Q596-A600 PolarHBondContact O-N 3.48Å; A600-K602 VanDerWaalsContact C-N 3.33Å; A600-K602 PolarHBondContact O-N 3.44Å; A600-L603 PolarHBondContact O-N 3.05Å; A600-R604 PolarHBondContact O-N 2.85Å; A600-F629 HydrophobicContact CB-CZ 4.05Å; A600-L633 HydrophobicContact CB-CD1 4.1Å; A600-L633 HydrophobicContact CB-CD2 4.11Å; A600-Y638 HydrophobicContact CB-CE1 3.95Å; A600-Y638 WeakPolarHBondContact O-CE1 3.4Å
601	V	95.1	Very high	90.7	Very high	89 Å²	89	66.7 Å²	66.7	54%	0.539	36%	0.356	S	S	.	.	H	α-helix	trans	-60.1	-43.7	176.5	173.4	0	0	0	0	111	Q597 K598 R604 H605 Y638	Q597-V601 WeakPolarHBondContact O-CG2 3.16Å; Q597-V601 PolarHBondContact O-N 3.21Å; K598-V601 PolarHBondContact O-N 3.36Å; V601-R604 PolarHBondContact O-N 2.96Å; V601-H605 PolarHBondContact O-N 2.92Å; V601-Y638 VanDerWaalsContact CG2-OH 3.29Å; V601-Y638 WeakPolarHBondContact CG2-OH 3.32Å
602	K	95	Very high	91	Very high	69 Å²	69	66.7 Å²	66.7	30%	0.3	36%	0.356	S	S	.	.	H	α-helix	trans	-60.3	-48.5	177	-172.9	-176	176.8	-165.3	0	111.7	D587 V588 V589 K598 E599 A600 R604 H605 L606	D587-K602 IonicContact OD1-NZ 2.96Å; D587-K602 PolarHBondContact OD1-NZ 2.73Å; D587-K602 WeakPolarHBondContact OD2-CE 3.26Å; D587-K602 IonicContact OD2-NZ 3.06Å; D587-K602 PolarHBondContact OD2-NZ 3.14Å; V588-K602 PolarHBondContact O-NZ 2.91Å; V589-K602 HydrophobicContact CG1-CD 4.21Å; K598-K602 WeakPolarHBondContact O-CB 3.35Å; K598-K602 PolarHBondContact O-N 3.27Å; E599-K602 WeakPolarHBondContact O-CB 3.19Å; E599-K602 PolarHBondContact O-N 3.42Å; A600-K602 VanDerWaalsContact C-N 3.33Å; A600-K602 PolarHBondContact O-N 3.44Å; K602-R604 PolarHBondContact O-N 3Å; K602-H605 PolarHBondContact O-N 2.89Å; K602-L606 HydrophobicContact CG-CD1 4.47Å; K602-L606 WeakPolarHBondContact O-CG 3.31Å; K602-L606 PolarHBondContact O-N 3.36Å
603	L	95.6	Very high	91.4	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-58.5	-46.8	174.9	-76.3	169.1	0	0	0	111.8	M562 L574 L591 E599 A600 H605 L606 M607 F629 F630 F639	M562-L603 HydrophobicContact CE-CD2 4.14Å; M562-L603 HydrophobicContact SD-CD2 4.04Å; L574-L603 HydrophobicContact CD1-CD2 3.6Å; L591-L603 HydrophobicContact CD2-CD1 4.01Å; E599-L603 WeakPolarHBondContact O-CB 3.32Å; E599-L603 WeakPolarHBondContact O-CG 3.44Å; E599-L603 PolarHBondContact O-N 3.49Å; A600-L603 PolarHBondContact O-N 3.05Å; L603-H605 VanDerWaalsContact C-N 3.32Å; L603-H605 PolarHBondContact O-N 3.02Å; L603-L606 PolarHBondContact O-N 3.3Å; L603-M607 WeakPolarHBondContact O-CB 3.45Å; L603-M607 VanDerWaalsContact O-CG 3.27Å; L603-M607 WeakPolarHBondContact O-CG 3.31Å; L603-M607 PolarHBondContact O-N 3.35Å; L603-F629 HydrophobicContact CD1-CE1 3.84Å; L603-F630 HydrophobicContact CD1-CE1 4.24Å; L603-F630 HydrophobicContact CD1-CZ 4.06Å; L603-F630 HydrophobicContact CD2-CZ 4.15Å; L603-F639 HydrophobicContact CB-CE1 4.39Å
604	R	95.1	Very high	92.1	Very high	120 Å²	120	64.9 Å²	64.9	45%	0.453	35%	0.348	S	S	.	.	H	α-helix	trans	-59.3	-42.9	177.8	-178.2	-177	-179.5	-164.9	0.8	111.9	A600 V601 K602 A608 Y638 F639	A600-R604 PolarHBondContact O-N 2.85Å; V601-R604 PolarHBondContact O-N 2.96Å; K602-R604 PolarHBondContact O-N 3Å; R604-A608 WeakPolarHBondContact O-CB 3.37Å; R604-A608 PolarHBondContact O-N 2.83Å; R604-Y638 HydrophobicContact CB-CD1 4.08Å; R604-Y638 HydrophobicContact CB-CE1 3.73Å; R604-Y638 VanDerWaalsContact CD-O 3.24Å; R604-Y638 WeakPolarHBondContact CD-O 3.41Å; R604-Y638 HydrophobicContact CG-CD1 4.43Å; R604-Y638 HydrophobicContact CG-CE1 4.32Å; R604-Y638 PolarHBondContact NE-O 2.91Å; R604-Y638 VanDerWaalsContact NE-O 3.15Å; R604-F639 HydrophobicContact CB-CD1 4.26Å; R604-F639 HydrophobicContact CB-CE1 4.37Å; R604-F639 HydrophobicContact CG-CD1 4.47Å
605	H	95.8	Very high	93.2	Very high	120 Å²	120	58.3 Å²	58.3	56%	0.556	30%	0.302	S	S	*	.	H	α-helix	trans	-61.2	-51.1	175.4	176.9	69.7	0	0	0	111.4	V601 K602 L603 M607 A608 T609	V601-H605 PolarHBondContact O-N 2.92Å; K602-H605 PolarHBondContact O-N 2.89Å; L603-H605 VanDerWaalsContact C-N 3.32Å; L603-H605 PolarHBondContact O-N 3.02Å; H605-M607 PolarHBondContact O-N 2.82Å; H605-A608 PolarHBondContact O-N 2.81Å; H605-T609 PolarHBondContact CE1-OG1 3.48Å; H605-T609 WeakPolarHBondContact O-CB 3.4Å; H605-T609 PolarHBondContact O-N 3.38Å; H605-T609 PolarHBondContact O-OG1 3Å
606	L	95.9	Very high	94	Very high	13 Å²	13	56.8 Å²	56.8	7%	0.068	29%	0.287	C	S	.	.	H	α-helix	trans	-59.1	-45.9	178.8	-69.5	175.4	0	0	0	112.3	I576 H585 K602 L603 A608 T609 Y610	I576-L606 HydrophobicContact CD1-CB 4.04Å; H585-L606 WeakPolarHBondContact NE2-CD2 3.3Å; K602-L606 HydrophobicContact CG-CD1 4.47Å; K602-L606 WeakPolarHBondContact O-CG 3.31Å; K602-L606 PolarHBondContact O-N 3.36Å; L603-L606 PolarHBondContact O-N 3.3Å; L606-A608 PolarHBondContact O-N 3.14Å; L606-T609 PolarHBondContact O-N 3.29Å; L606-Y610 HydrophobicContact CD2-CE2 4.2Å; L606-Y610 VanDerWaalsContact O-CD2 3.25Å; L606-Y610 WeakPolarHBondContact O-CD2 3.26Å; L606-Y610 PolarHBondContact O-N 2.9Å; L606-Y610 VanDerWaalsContact O-N 3.15Å
607	M	94.9	Very high	94.5	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-65.2	-38.9	-179.4	-67.4	-175.3	77.1	0	0	112.2	M562 L603 H605 S611 C612 V615 F639 L642 V644	M562-M607 HydrophobicContact CE-CG 3.68Å; M562-M607 HydrophobicContact CE-SD 4.35Å; L603-M607 WeakPolarHBondContact O-CB 3.45Å; L603-M607 VanDerWaalsContact O-CG 3.27Å; L603-M607 WeakPolarHBondContact O-CG 3.31Å; L603-M607 PolarHBondContact O-N 3.35Å; H605-M607 PolarHBondContact O-N 2.82Å; M607-S611 WeakPolarHBondContact O-CA 3.28Å; M607-S611 PolarHBondContact O-N 3.18Å; M607-C612 HydrophobicContact CB-CB 4.42Å; M607-C612 VanDerWaalsContact CE-O 3.23Å; M607-C612 WeakPolarHBondContact CE-O 3.41Å; M607-C612 HydrophobicContact CG-CB 4.41Å; M607-C612 PolarHBondContact O-N 3.28Å; M607-V615 HydrophobicContact CE-CG2 3.72Å; M607-F639 HydrophobicContact SD-CD1 3.76Å; M607-F639 HydrophobicContact SD-CE1 3.49Å; M607-F639 WeakPolarHBondContact SD-CE1 3.26Å; M607-F639 HydrophobicContact SD-CE2 4.47Å; M607-F639 HydrophobicContact SD-CG 4.38Å; M607-F639 HydrophobicContact SD-CZ 3.88Å; M607-L642 HydrophobicContact CB-CD1 4.24Å; M607-L642 VanDerWaalsContact O-CD1 3.25Å; M607-L642 WeakPolarHBondContact O-CD1 3.38Å; M607-V644 HydrophobicContact CE-CB 4.3Å; M607-V644 HydrophobicContact CE-CG1 3.59Å; M607-V644 HydrophobicContact CE-CG2 3.62Å
608	A	95.4	Very high	94.8	Very high	58 Å²	58	47 Å²	47	48%	0.479	24%	0.241	S	C	.	.	H	α-helix	trans	-64	-50.2	173.3	0	0	0	0	0	112	R604 H605 L606 Y610 S611	R604-A608 WeakPolarHBondContact O-CB 3.37Å; R604-A608 PolarHBondContact O-N 2.83Å; H605-A608 PolarHBondContact O-N 2.81Å; L606-A608 PolarHBondContact O-N 3.14Å; A608-Y610 VanDerWaalsContact C-N 3.3Å; A608-Y610 PolarHBondContact O-N 2.92Å; A608-S611 PolarHBondContact O-N 3.07Å; A608-S611 VanDerWaalsContact O-N 3.15Å
609	T	96.9	Very high	94.6	Very high	77 Å²	77	42.5 Å²	42.5	47%	0.472	23%	0.225	S	C	.	.	H	α-helix	trans	-56.3	-40.5	-178.3	-64	0	0	0	0	112.8	H605 L606	H605-T609 PolarHBondContact CE1-OG1 3.48Å; H605-T609 WeakPolarHBondContact O-CB 3.4Å; H605-T609 PolarHBondContact O-N 3.38Å; H605-T609 PolarHBondContact O-OG1 3Å; L606-T609 PolarHBondContact O-N 3.29Å
610	Y	96	Very high	94.3	Very high	69 Å²	69	42.2 Å²	42.2	27%	0.271	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	7	-179.5	-59.6	-71.6	0	0	0	114.2	I576 L584 H585 L606 A608 C612	I576-Y610 HydrophobicContact CD1-CD2 3.53Å; I576-Y610 HydrophobicContact CD1-CE2 4.12Å; I576-Y610 HydrophobicContact CD1-CG 4.35Å; I576-Y610 HydrophobicContact CG2-CD2 4.29Å; I576-Y610 HydrophobicContact CG2-CG 4.11Å; L584-Y610 HydrophobicContact CB-CD1 3.99Å; L584-Y610 HydrophobicContact CB-CE1 4.06Å; L584-Y610 HydrophobicContact CD1-CD1 4.13Å; H585-Y610 HydrophobicContact CB-CD2 4.4Å; H585-Y610 HydrophobicContact CB-CE2 3.64Å; H585-Y610 AromaticContact CG-CE2 3.95Å; L606-Y610 HydrophobicContact CD2-CE2 4.2Å; L606-Y610 VanDerWaalsContact O-CD2 3.25Å; L606-Y610 WeakPolarHBondContact O-CD2 3.26Å; L606-Y610 PolarHBondContact O-N 2.9Å; L606-Y610 VanDerWaalsContact O-N 3.15Å; A608-Y610 VanDerWaalsContact C-N 3.3Å; A608-Y610 PolarHBondContact O-N 2.92Å; Y610-C612 PolarHBondContact O-N 3.33Å
611	S	94.6	Very high	94	Very high	77 Å²	77	46.9 Å²	46.9	54%	0.538	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	40.8	-175.5	-60.4	0	0	0	0	113.9	M607 A608 T613	M607-S611 WeakPolarHBondContact O-CA 3.28Å; M607-S611 PolarHBondContact O-N 3.18Å; A608-S611 PolarHBondContact O-N 3.07Å; A608-S611 VanDerWaalsContact O-N 3.15Å; S611-T613 PolarHBondContact O-N 3.35Å
612	C	94.9	Very high	93.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.235	C	C	.	.			trans	-82.7	114.7	-174.4	-175.6	0	0	0	0	111.8	V560 M562 M607 Y610 K614	V560-C612 HydrophobicContact CG1-CB 3.79Å; M562-C612 PolarHBondContact N-SG 2.86Å; M562-C612 VanDerWaalsContact N-SG 3.39Å; M607-C612 HydrophobicContact CB-CB 4.42Å; M607-C612 VanDerWaalsContact CE-O 3.23Å; M607-C612 WeakPolarHBondContact CE-O 3.41Å; M607-C612 HydrophobicContact CG-CB 4.41Å; M607-C612 PolarHBondContact O-N 3.28Å; Y610-C612 PolarHBondContact O-N 3.33Å; C612-K614 PolarHBondContact SG-O 3.21Å
613	T	92.8	Very high	93.3	Very high	48 Å²	48	40.2 Å²	40.2	29%	0.294	23%	0.225	S	C	.	.			trans	-105	-10.8	-178.6	54.8	0	0	0	0	114.3	S611 L642 V644 S645	S611-T613 PolarHBondContact O-N 3.35Å; T613-L642 HydrophobicContact CG2-CD2 4.27Å; T613-V644 WeakPolarHBondContact O-CA 3.46Å; T613-S645 PolarHBondContact O-N 3.42Å
614	K	95.3	Very high	92.7	Very high	44 Å²	44	45.6 Å²	45.6	19%	0.191	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	124.7	-175.1	-72.8	178	-177.7	170.3	0	111.5	V556 S559 I561 M562 C612 S645 F912	V556-K614 HydrophobicContact CG1-CD 4.01Å; V556-K614 VanDerWaalsContact CG1-NZ 3.28Å; S559-K614 PolarHBondContact OG-NZ 3.49Å; I561-K614 WeakPolarHBondContact CA-O 3.34Å; I561-K614 HydrophobicContact CD1-CB 4.5Å; I561-K614 HydrophobicContact CD1-CD 4.48Å; I561-K614 HydrophobicContact CG1-CB 4.07Å; M562-K614 PolarHBondContact N-O 3.07Å; C612-K614 PolarHBondContact SG-O 3.21Å; K614-S645 WeakPolarHBondContact CA-O 3.47Å; K614-F912 HydrophobicContact CB-CD1 4.47Å; K614-F912 HydrophobicContact CB-CE1 3.72Å; K614-F912 HydrophobicContact CB-CZ 4.19Å; K614-F912 HydrophobicContact CD-CE1 4.01Å; K614-F912 HydrophobicContact CD-CE2 4.25Å; K614-F912 HydrophobicContact CD-CZ 3.79Å; K614-F912 HydrophobicContact CG-CD1 4.18Å; K614-F912 HydrophobicContact CG-CE1 3.74Å; K614-F912 HydrophobicContact CG-CZ 4.07Å
615	V	96.2	Very high	92.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	138.5	173.7	-174.5	0	0	0	0	109.1	M562 V564 M607 I617 F630 V644 S645 Y646 C647	M562-V615 CarbonylContact O-C 3.53Å; M562-V615 WeakPolarHBondContact O-CA 3.45Å; V564-V615 HydrophobicContact CG2-CG1 3.65Å; M607-V615 HydrophobicContact CE-CG2 3.72Å; V615-I617 HydrophobicContact CG1-CG1 4Å; V615-F630 HydrophobicContact CG1-CD1 4.16Å; V615-F630 HydrophobicContact CG1-CD2 4.41Å; V615-F630 HydrophobicContact CG1-CE1 3.99Å; V615-F630 HydrophobicContact CG1-CE2 4.25Å; V615-F630 HydrophobicContact CG1-CG 4.37Å; V615-F630 HydrophobicContact CG1-CZ 4.04Å; V615-F630 HydrophobicContact CG2-CD1 4.15Å; V615-F630 HydrophobicContact CG2-CE1 4.03Å; V615-V644 HydrophobicContact CG2-CG1 4.1Å; V615-S645 PolarHBondContact N-O 3.49Å; V615-Y646 CarbonylContact O-C 3.47Å; V615-Y646 VanDerWaalsContact O-CA 3.23Å; V615-Y646 WeakPolarHBondContact O-CA 3.34Å; V615-C647 PolarHBondContact O-N 3.15Å
616	V	96.1	Very high	92	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	115.5	178.8	177	0	0	0	0	108	I561 M562 G563 V564 C647 T649 I680 V684	I561-V616 HydrophobicContact CG2-CB 4.17Å; I561-V616 HydrophobicContact CG2-CG2 3.42Å; I561-V616 VanDerWaalsContact CG2-CG2 3.42Å; M562-V616 PolarHBondContact O-N 3.05Å; G563-V616 CarbonylContact C-O 3.37Å; V564-V616 PolarHBondContact N-O 2.91Å; V616-C647 WeakPolarHBondContact CA-O 3.47Å; V616-T649 HydrophobicContact CG1-CG2 3.47Å; V616-T649 VanDerWaalsContact CG1-CG2 3.47Å; V616-I680 HydrophobicContact CG1-CG2 3.83Å; V616-I680 WeakPolarHBondContact CG1-O 3.31Å; V616-V684 HydrophobicContact CB-CG2 4.37Å; V616-V684 HydrophobicContact CG1-CB 4.26Å; V616-V684 HydrophobicContact CG1-CG2 3.5Å; V616-V684 VanDerWaalsContact CG1-CG2 3.5Å; V616-V684 HydrophobicContact CG2-CB 3.88Å; V616-V684 HydrophobicContact CG2-CG1 4.01Å; V616-V684 HydrophobicContact CG2-CG2 3.88Å
617	I	94.9	Very high	91.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	128.3	-173.4	-50.5	177.7	0	0	0	108.8	V564 P566 V615 T626 E627 F630 Y646 C647 I648 T649	V564-I617 HydrophobicContact CB-CG1 4.47Å; P566-I617 HydrophobicContact CG-CG2 3.74Å; V615-I617 HydrophobicContact CG1-CG1 4Å; I617-T626 HydrophobicContact CD1-CG2 4.4Å; I617-T626 HydrophobicContact CG2-CG2 3.89Å; I617-E627 HydrophobicContact CD1-CB 4.39Å; I617-F630 HydrophobicContact CD1-CB 4.41Å; I617-F630 HydrophobicContact CD1-CD2 4.05Å; I617-F630 HydrophobicContact CD1-CG 4.48Å; I617-Y646 HydrophobicContact CD1-CD2 3.87Å; I617-Y646 HydrophobicContact CD1-CG 4.39Å; I617-C647 PolarHBondContact N-O 3.2Å; I617-I648 CarbonylContact O-C 3.58Å; I617-I648 WeakPolarHBondContact O-CA 3.4Å; I617-T649 PolarHBondContact O-N 3.49Å
618	G	92.6	Very high	91.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	145.1	170.8	0	0	0	0	0	111.8	V564 P566 G620 C623 E651	V564-G618 PolarHBondContact O-N 2.8Å; P566-G618 VanDerWaalsContact CG-O 3.3Å; P566-G618 WeakPolarHBondContact CG-O 3.49Å; G618-G620 VanDerWaalsContact C-N 3.26Å; G618-G620 PolarHBondContact O-N 2.87Å; G618-C623 WeakPolarHBondContact O-CB 3.45Å; G618-C623 PolarHBondContact O-SG 3.1Å; G618-E651 WeakPolarHBondContact CA-OE2 3.28Å
619	N	88	Confident	91.1	Very high	78 Å²	78	38.5 Å²	38.5	42%	0.417	21%	0.213	S	C	.	.	S	Bend	trans	-84.4	17	-175.8	71.2	-29.5	0	0	0	115.3	I648 T649 N650 E651	N619-I648 HydrophobicContact CB-CG2 3.65Å; N619-T649 WeakPolarHBondContact CB-O 2.99Å; N619-T649 PolarHBondContact N-O 2.84Å; N619-T649 PolarHBondContact OD1-O 3.4Å; N619-N650 WeakPolarHBondContact OD1-CA 3.32Å; N619-N650 PolarHBondContact OD1-OD1 3.16Å; N619-E651 PolarHBondContact N-OE2 2.82Å; N619-E651 PolarHBondContact OD1-N 3.45Å
620	G	86.3	Confident	90.9	Very high	25 Å²	25	34.8 Å²	34.8	26%	0.258	19%	0.191	S	C	.	.	S	Bend	trans	-91.9	-149.8	-175	0	0	0	0	0	116.5	G618 A622 C623 E651	G618-G620 VanDerWaalsContact C-N 3.26Å; G618-G620 PolarHBondContact O-N 2.87Å; G620-A622 PolarHBondContact O-N 3.08Å; G620-C623 WeakPolarHBondContact O-CB 3.06Å; G620-C623 PolarHBondContact O-N 3.21Å; G620-E651 VanDerWaalsContact CA-OE1 3.31Å; G620-E651 WeakPolarHBondContact CA-OE1 3.49Å; G620-E651 VanDerWaalsContact CA-OE2 3.29Å; G620-E651 WeakPolarHBondContact CA-OE2 3.41Å; G620-E651 VanDerWaalsContact N-CD 3.25Å; G620-E651 PolarHBondContact N-OE2 2.96Å
621	T	86.3	Confident	90.5	Very high	97 Å²	97	31.6 Å²	31.6	60%	0.595	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	125.1	-175.2	-56.5	0	0	0	0	111.3	P566 F568 C623	P566-T621 CarbonylContact C-O 3.52Å; P566-T621 WeakPolarHBondContact CB-O 3.41Å; F568-T621 HydrophobicContact CD2-CG2 3.83Å; F568-T621 HydrophobicContact CE2-CG2 3.8Å; T621-C623 VanDerWaalsContact C-N 3.33Å
622	A	88.6	Confident	90.2	Very high	6 Å²	6	30.7 Å²	30.7	5%	0.05	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	11.5	-172	0	0	0	0	0	115.9	P566 F568 G620 R624 E625 T626	P566-A622 HydrophobicContact CB-CB 4.3Å; F568-A622 HydrophobicContact CD1-CB 3.71Å; F568-A622 HydrophobicContact CD2-CB 3.82Å; F568-A622 HydrophobicContact CE1-CB 3.51Å; F568-A622 HydrophobicContact CE2-CB 3.63Å; F568-A622 HydrophobicContact CG-CB 3.86Å; F568-A622 HydrophobicContact CZ-CB 3.47Å; F568-A622 VanDerWaalsContact CZ-CB 3.47Å; G620-A622 PolarHBondContact O-N 3.08Å; A622-R624 VanDerWaalsContact C-N 3.3Å; A622-R624 PolarHBondContact O-N 3.29Å; A622-E625 VanDerWaalsContact CA-OE2 3.28Å; A622-E625 WeakPolarHBondContact CA-OE2 3.48Å; A622-E625 PolarHBondContact O-N 3.11Å; A622-T626 WeakPolarHBondContact O-CB 3.43Å; A622-T626 PolarHBondContact O-N 3.04Å; A622-T626 PolarHBondContact O-OG1 2.93Å
623	C	88.3	Confident	90.1	Very high	12 Å²	12	31 Å²	31	8%	0.081	17%	0.169	C	C	.	.	H	α-helix	trans	-54.6	-43.3	176	172.9	0	0	0	0	112.7	P566 G618 G620 T621 T626 E627	P566-C623 HydrophobicContact CG-CB 4.35Å; G618-C623 WeakPolarHBondContact O-CB 3.45Å; G618-C623 PolarHBondContact O-SG 3.1Å; G620-C623 WeakPolarHBondContact O-CB 3.06Å; G620-C623 PolarHBondContact O-N 3.21Å; T621-C623 VanDerWaalsContact C-N 3.33Å; C623-T626 PolarHBondContact O-N 3.39Å; C623-E627 VanDerWaalsContact O-CB 3.29Å; C623-E627 WeakPolarHBondContact O-CB 3.26Å; C623-E627 PolarHBondContact O-N 3.4Å
624	R	82.1	Confident	90	Very high	113 Å²	113	29.4 Å²	29.4	43%	0.426	16%	0.159	S	C	.	.	H	α-helix	trans	-68.6	-42.9	-174.5	-70.2	171.1	161.5	-131.6	-11.1	112.4	A622 T626 S628 V946 G947	A622-R624 VanDerWaalsContact C-N 3.3Å; A622-R624 PolarHBondContact O-N 3.29Å; R624-T626 VanDerWaalsContact C-N 3.31Å; R624-S628 WeakPolarHBondContact O-CB 3.41Å; R624-S628 PolarHBondContact O-N 3.13Å; R624-V946 PolarHBondContact NH2-O 3.38Å; R624-G947 PolarHBondContact NE-O 2.93Å; R624-G947 PolarHBondContact NH2-O 3.15Å
625	E	86.1	Confident	89.6	Confident	81 Å²	81	31.1 Å²	31.1	38%	0.379	18%	0.176	S	C	.	.	H	α-helix	trans	-67.1	-38.8	178.4	-62.7	82.5	172.7	0	0	109.8	F568 H592 A622 F629	F568-E625 HydrophobicContact CE1-CB 4.39Å; F568-E625 HydrophobicContact CE1-CG 3.96Å; F568-E625 HydrophobicContact CZ-CG 4.33Å; H592-E625 WeakPolarHBondContact CE1-CB 3.35Å; A622-E625 VanDerWaalsContact CA-OE2 3.28Å; A622-E625 WeakPolarHBondContact CA-OE2 3.48Å; A622-E625 PolarHBondContact O-N 3.11Å; E625-F629 WeakPolarHBondContact O-CB 3.42Å; E625-F629 PolarHBondContact O-N 3.37Å
626	T	90.9	Very high	89.3	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-68.7	-45.9	174.8	-62.2	0	0	0	0	112.2	V564 C572 L591 H592 I617 A622 C623 R624 S628 F629 F630	V564-T626 HydrophobicContact CG1-CG2 3.83Å; C572-T626 PolarHBondContact SG-OG1 3.19Å; C572-T626 VanDerWaalsContact SG-OG1 3.36Å; L591-T626 HydrophobicContact CD1-CG2 4Å; H592-T626 PolarHBondContact CE1-N 2.75Å; H592-T626 PolarHBondContact CE1-OG1 3.3Å; H592-T626 PolarHBondContact NE2-OG1 3.44Å; I617-T626 HydrophobicContact CD1-CG2 4.4Å; I617-T626 HydrophobicContact CG2-CG2 3.89Å; A622-T626 WeakPolarHBondContact O-CB 3.43Å; A622-T626 PolarHBondContact O-N 3.04Å; A622-T626 PolarHBondContact O-OG1 2.93Å; C623-T626 PolarHBondContact O-N 3.39Å; R624-T626 VanDerWaalsContact C-N 3.31Å; T626-S628 VanDerWaalsContact C-N 3.34Å; T626-S628 PolarHBondContact O-N 2.95Å; T626-F629 PolarHBondContact O-N 2.91Å; T626-F630 HydrophobicContact CG2-CD2 4Å; T626-F630 HydrophobicContact CG2-CE2 4.06Å; T626-F630 WeakPolarHBondContact O-CD2 3.13Å; T626-F630 PolarHBondContact O-N 2.96Å
627	E	89.9	Confident	89	Confident	7 Å²	7	46.6 Å²	46.6	3%	0.033	24%	0.235	C	C	.	.	H	α-helix	trans	-54.7	-50.4	171.6	166.7	171.5	-140.6	0	0	110.6	I617 C623 F629 F630 A631 Y646	I617-E627 HydrophobicContact CD1-CB 4.39Å; C623-E627 VanDerWaalsContact O-CB 3.29Å; C623-E627 WeakPolarHBondContact O-CB 3.26Å; C623-E627 PolarHBondContact O-N 3.4Å; E627-F629 VanDerWaalsContact C-N 3.31Å; E627-F629 PolarHBondContact O-N 3.3Å; E627-F630 PolarHBondContact O-N 2.88Å; E627-A631 VanDerWaalsContact O-CB 3.27Å; E627-A631 WeakPolarHBondContact O-CB 3.44Å; E627-A631 PolarHBondContact O-N 3.45Å; E627-Y646 HydrophobicContact CB-CE2 4.46Å; E627-Y646 HydrophobicContact CG-CE2 3.63Å; E627-Y646 WeakPolarHBondContact CG-OH 3.25Å; E627-Y646 WeakPolarHBondContact OE1-CE2 3.42Å; E627-Y646 PolarHBondContact OE1-OH 2.94Å
628	S	86	Confident	88.9	Confident	56 Å²	56	49.2 Å²	49.2	39%	0.392	25%	0.245	S	C	.	.	H	α-helix	trans	-59	-43.7	-178	-176.4	0	0	0	0	111.9	R624 T626 A631 D632	R624-S628 WeakPolarHBondContact O-CB 3.41Å; R624-S628 PolarHBondContact O-N 3.13Å; T626-S628 VanDerWaalsContact C-N 3.34Å; T626-S628 PolarHBondContact O-N 2.95Å; S628-A631 PolarHBondContact O-N 3.37Å; S628-D632 WeakPolarHBondContact O-CB 3.22Å; S628-D632 PolarHBondContact O-N 3.27Å
629	F	90.2	Very high	88.9	Confident	18 Å²	18	49.6 Å²	49.6	8%	0.079	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-47.3	175.9	-174.7	-100.1	0	0	0	112.8	L591 Q596 A600 L603 E625 T626 E627 L633	L591-F629 HydrophobicContact CB-CD1 4.32Å; L591-F629 HydrophobicContact CB-CG 4.46Å; L591-F629 HydrophobicContact CD1-CD1 3.98Å; L591-F629 HydrophobicContact CD1-CE1 4.48Å; L591-F629 HydrophobicContact CD2-CD1 4.01Å; L591-F629 HydrophobicContact CD2-CE1 3.7Å; L591-F629 HydrophobicContact CD2-CZ 4.35Å; L591-F629 HydrophobicContact CG-CD1 4.31Å; L591-F629 HydrophobicContact CG-CE1 4.47Å; Q596-F629 HydrophobicContact CB-CE2 3.94Å; A600-F629 HydrophobicContact CB-CZ 4.05Å; L603-F629 HydrophobicContact CD1-CE1 3.84Å; E625-F629 WeakPolarHBondContact O-CB 3.42Å; E625-F629 PolarHBondContact O-N 3.37Å; T626-F629 PolarHBondContact O-N 2.91Å; E627-F629 VanDerWaalsContact C-N 3.31Å; E627-F629 PolarHBondContact O-N 3.3Å; F629-L633 HydrophobicContact CD1-CD1 4.08Å; F629-L633 HydrophobicContact CE1-CD1 3.52Å; F629-L633 HydrophobicContact CE1-CG 4.42Å; F629-L633 HydrophobicContact CZ-CD1 3.81Å; F629-L633 HydrophobicContact CZ-CG 4.48Å; F629-L633 WeakPolarHBondContact O-CG 3.38Å; F629-L633 PolarHBondContact O-N 3.05Å
630	F	92.2	Very high	89	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.1	-41.4	177.2	-86.4	-76.8	0	0	0	112.4	M562 V564 L591 L603 V615 I617 T626 E627 L633 I634 F639	M562-F630 HydrophobicContact SD-CE1 4.49Å; M562-F630 HydrophobicContact SD-CZ 4.24Å; V564-F630 HydrophobicContact CG1-CE2 4.35Å; V564-F630 HydrophobicContact CG2-CE2 4.12Å; V564-F630 HydrophobicContact CG2-CZ 4.18Å; L591-F630 HydrophobicContact CD1-CE2 4.1Å; L603-F630 HydrophobicContact CD1-CE1 4.24Å; L603-F630 HydrophobicContact CD1-CZ 4.06Å; L603-F630 HydrophobicContact CD2-CZ 4.15Å; V615-F630 HydrophobicContact CG1-CD1 4.16Å; V615-F630 HydrophobicContact CG1-CD2 4.41Å; V615-F630 HydrophobicContact CG1-CE1 3.99Å; V615-F630 HydrophobicContact CG1-CE2 4.25Å; V615-F630 HydrophobicContact CG1-CG 4.37Å; V615-F630 HydrophobicContact CG1-CZ 4.04Å; V615-F630 HydrophobicContact CG2-CD1 4.15Å; V615-F630 HydrophobicContact CG2-CE1 4.03Å; I617-F630 HydrophobicContact CD1-CB 4.41Å; I617-F630 HydrophobicContact CD1-CD2 4.05Å; I617-F630 HydrophobicContact CD1-CG 4.48Å; T626-F630 HydrophobicContact CG2-CD2 4Å; T626-F630 HydrophobicContact CG2-CE2 4.06Å; T626-F630 WeakPolarHBondContact O-CD2 3.13Å; T626-F630 PolarHBondContact O-N 2.96Å; E627-F630 PolarHBondContact O-N 2.88Å; F630-L633 PolarHBondContact O-N 3.41Å; F630-I634 WeakPolarHBondContact O-CB 3.27Å; F630-I634 WeakPolarHBondContact O-CD1 3.49Å; F630-I634 WeakPolarHBondContact O-CG1 3.49Å; F630-I634 PolarHBondContact O-N 2.88Å; F630-F639 HydrophobicContact CD1-CZ 4.48Å
631	A	88.8	Confident	89.3	Confident	2 Å²	2	56.4 Å²	56.4	2%	0.017	28%	0.278	C	S	.	.	H	α-helix	trans	-65.3	-38	179.7	0	0	0	0	0	112.7	E627 S628 S635 Y646 I916	E627-A631 VanDerWaalsContact O-CB 3.27Å; E627-A631 WeakPolarHBondContact O-CB 3.44Å; E627-A631 PolarHBondContact O-N 3.45Å; S628-A631 PolarHBondContact O-N 3.37Å; A631-S635 VanDerWaalsContact O-CB 3.26Å; A631-S635 WeakPolarHBondContact O-CB 3.46Å; A631-S635 PolarHBondContact O-N 2.76Å; A631-S635 PolarHBondContact O-OG 3.2Å; A631-Y646 HydrophobicContact CB-CE1 3.94Å; A631-I916 HydrophobicContact CB-CD1 4.08Å; A631-I916 HydrophobicContact CB-CG1 3.41Å; A631-I916 VanDerWaalsContact CB-CG1 3.41Å
632	D	88.5	Confident	89.6	Confident	58 Å²	58	53.7 Å²	53.7	31%	0.31	26%	0.26	S	S	.	.	H	α-helix	trans	-62.3	-48.4	172.7	-179.5	67.6	0	0	0	111.6	S628 I634 S635 R636	S628-D632 WeakPolarHBondContact O-CB 3.22Å; S628-D632 PolarHBondContact O-N 3.27Å; D632-I634 PolarHBondContact O-N 3.2Å; D632-S635 PolarHBondContact O-N 3.03Å; D632-R636 VanDerWaalsContact CG-NH2 3.28Å; D632-R636 WeakPolarHBondContact O-CB 3.26Å; D632-R636 VanDerWaalsContact O-CG 3.29Å; D632-R636 WeakPolarHBondContact O-CG 3.29Å; D632-R636 PolarHBondContact O-N 3.26Å; D632-R636 IonicContact OD1-CZ 3.21Å; D632-R636 IonicContact OD1-NE 2.75Å; D632-R636 PolarHBondContact OD1-NE 2.9Å; D632-R636 IonicContact OD1-NH2 2.72Å; D632-R636 PolarHBondContact OD1-NH2 3.07Å; D632-R636 IonicContact OD2-CZ 3.17Å; D632-R636 IonicContact OD2-NE 2.78Å; D632-R636 PolarHBondContact OD2-NE 3.41Å; D632-R636 IonicContact OD2-NH2 2.75Å; D632-R636 PolarHBondContact OD2-NH2 3.47Å
633	L	91.4	Very high	89.6	Confident	6 Å²	6	57.1 Å²	57.1	3%	0.031	28%	0.277	C	S	.	.	H	α-helix	trans	-62.5	-39.9	177.5	-67.3	-178.2	0	0	0	112.7	A600 F629 F630 R637 Y638 F639	A600-L633 HydrophobicContact CB-CD1 4.1Å; A600-L633 HydrophobicContact CB-CD2 4.11Å; F629-L633 HydrophobicContact CD1-CD1 4.08Å; F629-L633 HydrophobicContact CE1-CD1 3.52Å; F629-L633 HydrophobicContact CE1-CG 4.42Å; F629-L633 HydrophobicContact CZ-CD1 3.81Å; F629-L633 HydrophobicContact CZ-CG 4.48Å; F629-L633 WeakPolarHBondContact O-CG 3.38Å; F629-L633 PolarHBondContact O-N 3.05Å; F630-L633 PolarHBondContact O-N 3.41Å; L633-R637 PolarHBondContact O-N 3.03Å; L633-Y638 HydrophobicContact CD2-CD1 4.02Å; L633-Y638 HydrophobicContact CD2-CD2 4.19Å; L633-Y638 HydrophobicContact CD2-CE1 4.49Å; L633-Y638 HydrophobicContact CD2-CG 3.86Å; L633-Y638 WeakPolarHBondContact O-CB 3.32Å; L633-Y638 PolarHBondContact O-N 2.99Å; L633-F639 HydrophobicContact CB-CD2 4.49Å; L633-F639 HydrophobicContact CB-CE2 3.61Å; L633-F639 HydrophobicContact CB-CZ 3.92Å; L633-F639 HydrophobicContact CD1-CE2 4.34Å; L633-F639 HydrophobicContact CD1-CZ 3.79Å
634	I	91.5	Very high	89.9	Confident	15 Å²	15	56.7 Å²	56.7	8%	0.077	28%	0.275	C	S	.	.	H	α-helix	trans	-65.2	-46.8	175.7	-69.8	163.2	0	0	0	110.6	F630 D632 R636 R637 F639 V644 Y646 R914	F630-I634 WeakPolarHBondContact O-CB 3.27Å; F630-I634 WeakPolarHBondContact O-CD1 3.49Å; F630-I634 WeakPolarHBondContact O-CG1 3.49Å; F630-I634 PolarHBondContact O-N 2.88Å; D632-I634 PolarHBondContact O-N 3.2Å; I634-R636 VanDerWaalsContact C-N 3.31Å; I634-R636 PolarHBondContact O-N 3Å; I634-R637 WeakPolarHBondContact O-CA 3.38Å; I634-R637 PolarHBondContact O-N 2.81Å; I634-F639 HydrophobicContact CG1-CD2 4.13Å; I634-F639 HydrophobicContact CG1-CE2 4.08Å; I634-V644 HydrophobicContact CD1-CG1 3.89Å; I634-V644 HydrophobicContact CG1-CB 4.2Å; I634-V644 HydrophobicContact CG1-CG1 3.84Å; I634-V644 WeakPolarHBondContact CG2-O 3.34Å; I634-Y646 HydrophobicContact CD1-CD1 3.76Å; I634-R914 HydrophobicContact CG2-CB 4.17Å
635	S	87.6	Confident	90.3	Very high	79 Å²	79	52.1 Å²	52.1	55%	0.552	26%	0.26	S	S	*	.	H	α-helix	trans	-61.4	-38.7	179.6	-61.1	0	0	0	0	112	A631 D632 R637	A631-S635 VanDerWaalsContact O-CB 3.26Å; A631-S635 WeakPolarHBondContact O-CB 3.46Å; A631-S635 PolarHBondContact O-N 2.76Å; A631-S635 PolarHBondContact O-OG 3.2Å; D632-S635 PolarHBondContact O-N 3.03Å; S635-R637 PolarHBondContact O-N 3.48Å
636	R	89.2	Confident	90.7	Very high	168 Å²	168	48.3 Å²	48.3	63%	0.634	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.3	5.3	174.4	-65.4	178.3	-164	-154.8	12.5	114.3	D632 I634 Y638	D632-R636 VanDerWaalsContact CG-NH2 3.28Å; D632-R636 WeakPolarHBondContact O-CB 3.26Å; D632-R636 VanDerWaalsContact O-CG 3.29Å; D632-R636 WeakPolarHBondContact O-CG 3.29Å; D632-R636 PolarHBondContact O-N 3.26Å; D632-R636 IonicContact OD1-CZ 3.21Å; D632-R636 IonicContact OD1-NE 2.75Å; D632-R636 PolarHBondContact OD1-NE 2.9Å; D632-R636 IonicContact OD1-NH2 2.72Å; D632-R636 PolarHBondContact OD1-NH2 3.07Å; D632-R636 IonicContact OD2-CZ 3.17Å; D632-R636 IonicContact OD2-NE 2.78Å; D632-R636 PolarHBondContact OD2-NE 3.41Å; D632-R636 IonicContact OD2-NH2 2.75Å; D632-R636 PolarHBondContact OD2-NH2 3.47Å; I634-R636 VanDerWaalsContact C-N 3.31Å; I634-R636 PolarHBondContact O-N 3Å; R636-Y638 PolarHBondContact O-N 3.15Å
637	R	90.1	Very high	90.6	Very high	158 Å²	158	48.4 Å²	48.4	60%	0.596	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	28.8	-176	-59.6	-62.2	-165.8	160.5	3.8	113.8	L633 I634 S635 F639 H640 D643	L633-R637 PolarHBondContact O-N 3.03Å; I634-R637 WeakPolarHBondContact O-CA 3.38Å; I634-R637 PolarHBondContact O-N 2.81Å; S635-R637 PolarHBondContact O-N 3.48Å; R637-F639 PolarHBondContact O-N 3.4Å; R637-F639 VanDerWaalsContact O-N 3.1Å; R637-H640 WeakPolarHBondContact O-CB 3.49Å; R637-H640 PolarHBondContact O-N 3.11Å; R637-H640 VanDerWaalsContact O-N 3.08Å; R637-D643 IonicContact NH1-OD1 3.68Å; R637-D643 PolarHBondContact NH1-OD1 3.2Å
638	Y	92.1	Very high	90.6	Very high	55 Å²	55	50.5 Å²	50.5	22%	0.216	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-27	-172	-165.8	-97.6	0	0	0	113.6	A600 V601 R604 L633 R636	A600-Y638 HydrophobicContact CB-CE1 3.95Å; A600-Y638 WeakPolarHBondContact O-CE1 3.4Å; V601-Y638 VanDerWaalsContact CG2-OH 3.29Å; V601-Y638 WeakPolarHBondContact CG2-OH 3.32Å; R604-Y638 HydrophobicContact CB-CD1 4.08Å; R604-Y638 HydrophobicContact CB-CE1 3.73Å; R604-Y638 VanDerWaalsContact CD-O 3.24Å; R604-Y638 WeakPolarHBondContact CD-O 3.41Å; R604-Y638 HydrophobicContact CG-CD1 4.43Å; R604-Y638 HydrophobicContact CG-CE1 4.32Å; R604-Y638 PolarHBondContact NE-O 2.91Å; R604-Y638 VanDerWaalsContact NE-O 3.15Å; L633-Y638 HydrophobicContact CD2-CD1 4.02Å; L633-Y638 HydrophobicContact CD2-CD2 4.19Å; L633-Y638 HydrophobicContact CD2-CE1 4.49Å; L633-Y638 HydrophobicContact CD2-CG 3.86Å; L633-Y638 WeakPolarHBondContact O-CB 3.32Å; L633-Y638 PolarHBondContact O-N 2.99Å; R636-Y638 PolarHBondContact O-N 3.15Å
639	F	93.8	Very high	90.7	Very high	8 Å²	8	49 Å²	49	4%	0.035	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	5.3	-179.4	-57.3	-66.5	0	0	0	115	L603 R604 M607 F630 L633 I634 R637 L642 V644	L603-F639 HydrophobicContact CB-CE1 4.39Å; R604-F639 HydrophobicContact CB-CD1 4.26Å; R604-F639 HydrophobicContact CB-CE1 4.37Å; R604-F639 HydrophobicContact CG-CD1 4.47Å; M607-F639 HydrophobicContact SD-CD1 3.76Å; M607-F639 HydrophobicContact SD-CE1 3.49Å; M607-F639 WeakPolarHBondContact SD-CE1 3.26Å; M607-F639 HydrophobicContact SD-CE2 4.47Å; M607-F639 HydrophobicContact SD-CG 4.38Å; M607-F639 HydrophobicContact SD-CZ 3.88Å; F630-F639 HydrophobicContact CD1-CZ 4.48Å; L633-F639 HydrophobicContact CB-CD2 4.49Å; L633-F639 HydrophobicContact CB-CE2 3.61Å; L633-F639 HydrophobicContact CB-CZ 3.92Å; L633-F639 HydrophobicContact CD1-CE2 4.34Å; L633-F639 HydrophobicContact CD1-CZ 3.79Å; I634-F639 HydrophobicContact CG1-CD2 4.13Å; I634-F639 HydrophobicContact CG1-CE2 4.08Å; R637-F639 PolarHBondContact O-N 3.4Å; R637-F639 VanDerWaalsContact O-N 3.1Å; F639-L642 WeakPolarHBondContact O-CB 3.48Å; F639-L642 PolarHBondContact O-N 2.75Å; F639-V644 HydrophobicContact CB-CB 4.21Å; F639-V644 HydrophobicContact CB-CG2 3.46Å; F639-V644 VanDerWaalsContact CB-CG2 3.46Å; F639-V644 HydrophobicContact CD2-CB 3.95Å; F639-V644 HydrophobicContact CD2-CG1 4.06Å; F639-V644 HydrophobicContact CD2-CG2 3.94Å; F639-V644 HydrophobicContact CE2-CG1 4.41Å; F639-V644 HydrophobicContact CG-CB 4.31Å; F639-V644 HydrophobicContact CG-CG2 3.78Å
640	H	89.7	Confident	90.6	Very high	133 Å²	133	50.3 Å²	50.3	62%	0.616	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.7	134.1	179.9	-172.9	-82.6	0	0	0	112.1	R637	R637-H640 WeakPolarHBondContact O-CB 3.49Å; R637-H640 PolarHBondContact O-N 3.11Å; R637-H640 VanDerWaalsContact O-N 3.08Å
641	P	92.1	Very high	90.4	Very high	112 Å²	112	52.4 Å²	52.4	73%	0.727	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	cis	-86.6	3.5	12.7	35.7	-37.7	0	0	0	116.4	D643	P641-D643 PolarHBondContact O-N 3.18Å
642	L	91.9	Very high	90.4	Very high	40 Å²	40	53.7 Å²	53.7	21%	0.209	27%	0.27	C	S	.	.	S	Bend	trans	-73.2	129.8	179.9	-60.7	175.5	0	0	0	111.4	M607 T613 F639 V644	M607-L642 HydrophobicContact CB-CD1 4.24Å; M607-L642 VanDerWaalsContact O-CD1 3.25Å; M607-L642 WeakPolarHBondContact O-CD1 3.38Å; T613-L642 HydrophobicContact CG2-CD2 4.27Å; F639-L642 WeakPolarHBondContact O-CB 3.48Å; F639-L642 PolarHBondContact O-N 2.75Å; L642-V644 VanDerWaalsContact C-N 3.34Å; L642-V644 HydrophobicContact CB-CG2 3.89Å; L642-V644 PolarHBondContact O-N 3.42Å; L642-V644 VanDerWaalsContact O-N 3.08Å
643	D	90.6	Very high	90.5	Very high	78 Å²	78	51.2 Å²	51.2	42%	0.417	26%	0.259	S	S	.	.			trans	-83.4	80.5	172.4	-163.7	42	0	0	0	109.8	R637 P641 R914	R637-D643 IonicContact NH1-OD1 3.68Å; R637-D643 PolarHBondContact NH1-OD1 3.2Å; P641-D643 PolarHBondContact O-N 3.18Å; D643-R914 IonicContact OD1-CZ 2.84Å; D643-R914 IonicContact OD1-NH1 2.76Å; D643-R914 PolarHBondContact OD1-NH1 3.17Å; D643-R914 IonicContact OD1-NH2 3.12Å; D643-R914 IonicContact OD2-CZ 3.54Å; D643-R914 IonicContact OD2-NH1 2.68Å; D643-R914 PolarHBondContact OD2-NH1 2.77Å; D643-R914 IonicContact OD2-NH2 3.63Å; D643-R914 PolarHBondContact OD2-NH2 2.92Å
644	V	93.3	Very high	90.5	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.024	26%	0.259	C	S	.	.			trans	-79	138.4	-175	177.4	0	0	0	0	111.7	M607 T613 V615 I634 F639 L642	M607-V644 HydrophobicContact CE-CB 4.3Å; M607-V644 HydrophobicContact CE-CG1 3.59Å; M607-V644 HydrophobicContact CE-CG2 3.62Å; T613-V644 WeakPolarHBondContact O-CA 3.46Å; V615-V644 HydrophobicContact CG2-CG1 4.1Å; I634-V644 HydrophobicContact CD1-CG1 3.89Å; I634-V644 HydrophobicContact CG1-CB 4.2Å; I634-V644 HydrophobicContact CG1-CG1 3.84Å; I634-V644 WeakPolarHBondContact CG2-O 3.34Å; F639-V644 HydrophobicContact CB-CB 4.21Å; F639-V644 HydrophobicContact CB-CG2 3.46Å; F639-V644 VanDerWaalsContact CB-CG2 3.46Å; F639-V644 HydrophobicContact CD2-CB 3.95Å; F639-V644 HydrophobicContact CD2-CG1 4.06Å; F639-V644 HydrophobicContact CD2-CG2 3.94Å; F639-V644 HydrophobicContact CE2-CG1 4.41Å; F639-V644 HydrophobicContact CG-CB 4.31Å; F639-V644 HydrophobicContact CG-CG2 3.78Å; L642-V644 VanDerWaalsContact C-N 3.34Å; L642-V644 HydrophobicContact CB-CG2 3.89Å; L642-V644 PolarHBondContact O-N 3.42Å; L642-V644 VanDerWaalsContact O-N 3.08Å
645	S	91.7	Very high	90.5	Very high	17 Å²	17	54.2 Å²	54.2	12%	0.119	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	159.3	171	59.9	0	0	0	0	110.8	T613 K614 V615	T613-S645 PolarHBondContact O-N 3.42Å; K614-S645 WeakPolarHBondContact CA-O 3.47Å; V615-S645 PolarHBondContact N-O 3.49Å
646	Y	92.6	Very high	90.7	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	151.4	-178.2	78.1	-85.5	0	0	0	112.1	V615 I617 E627 A631 I634 F912 K913 G915	V615-Y646 CarbonylContact O-C 3.47Å; V615-Y646 VanDerWaalsContact O-CA 3.23Å; V615-Y646 WeakPolarHBondContact O-CA 3.34Å; I617-Y646 HydrophobicContact CD1-CD2 3.87Å; I617-Y646 HydrophobicContact CD1-CG 4.39Å; E627-Y646 HydrophobicContact CB-CE2 4.46Å; E627-Y646 HydrophobicContact CG-CE2 3.63Å; E627-Y646 WeakPolarHBondContact CG-OH 3.25Å; E627-Y646 WeakPolarHBondContact OE1-CE2 3.42Å; E627-Y646 PolarHBondContact OE1-OH 2.94Å; A631-Y646 HydrophobicContact CB-CE1 3.94Å; I634-Y646 HydrophobicContact CD1-CD1 3.76Å; Y646-F912 CarbonylContact O-C 3.6Å; Y646-F912 WeakPolarHBondContact O-CA 3.25Å; Y646-K913 HydrophobicContact CD1-CB 4.3Å; Y646-K913 WeakPolarHBondContact CD1-O 3.23Å; Y646-K913 HydrophobicContact CE1-CB 3.75Å; Y646-K913 HydrophobicContact CE2-CB 4.11Å; Y646-K913 HydrophobicContact CE2-CD 4.29Å; Y646-K913 PolarHBondContact N-O 2.92Å; Y646-K913 PolarHBondContact O-N 3.04Å; Y646-G915 PolarHBondContact OH-O 3.06Å
647	C	90.6	Very high	90.9	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.014	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	157.5	166.4	70.5	0	0	0	0	110.6	V615 V616 I617 D911 F912	V615-C647 PolarHBondContact O-N 3.15Å; V616-C647 WeakPolarHBondContact CA-O 3.47Å; I617-C647 PolarHBondContact N-O 3.2Å; C647-D911 WeakPolarHBondContact CB-O 3.41Å; C647-F912 HydrophobicContact CB-CD1 3.99Å; C647-F912 HydrophobicContact CB-CE1 4.01Å; C647-F912 HydrophobicContact CB-CG 4.24Å; C647-F912 HydrophobicContact CB-CZ 4.29Å
648	I	88.4	Confident	91.1	Very high	52 Å²	52	37.8 Å²	37.8	27%	0.267	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	138.4	171.5	-62.5	170.1	0	0	0	107.7	I617 N619	I617-I648 CarbonylContact O-C 3.58Å; I617-I648 WeakPolarHBondContact O-CA 3.4Å; N619-I648 HydrophobicContact CB-CG2 3.65Å
649	T	88.8	Confident	91.2	Very high	25 Å²	25	39.8 Å²	39.8	15%	0.153	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	155.6	174.5	-165.1	0	0	0	0	111.1	V616 I617 N619 E651 I680 V684	V616-T649 HydrophobicContact CG1-CG2 3.47Å; V616-T649 VanDerWaalsContact CG1-CG2 3.47Å; I617-T649 PolarHBondContact O-N 3.49Å; N619-T649 WeakPolarHBondContact CB-O 2.99Å; N619-T649 PolarHBondContact N-O 2.84Å; N619-T649 PolarHBondContact OD1-O 3.4Å; T649-E651 PolarHBondContact O-N 3.14Å; T649-I680 HydrophobicContact CG2-CG2 3.79Å; T649-V684 HydrophobicContact CG2-CG2 4.46Å
650	N	87.1	Confident	91.2	Very high	44 Å²	44	40.2 Å²	40.2	24%	0.235	23%	0.234	C	C	.	.			trans	-70.5	121.8	174.5	-175.2	3.5	0	0	0	109.8	R550 N619 A652 R683	R550-N650 PolarHBondContact NH1-ND2 2.71Å; N619-N650 WeakPolarHBondContact OD1-CA 3.32Å; N619-N650 PolarHBondContact OD1-OD1 3.16Å; N650-A652 WeakPolarHBondContact OD1-CB 3.33Å; N650-A652 PolarHBondContact OD1-N 3.2Å; N650-R683 PolarHBondContact O-NH1 3.13Å
651	E	89.4	Confident	91.3	Very high	45 Å²	45	38.7 Å²	38.7	21%	0.21	24%	0.236	C	C	.	.			trans	-91.6	-4.9	177.4	74.8	-178.2	-136.6	0	0	113.7	G618 N619 G620 T649 G653 A654 I680 R683	G618-E651 WeakPolarHBondContact CA-OE2 3.28Å; N619-E651 PolarHBondContact N-OE2 2.82Å; N619-E651 PolarHBondContact OD1-N 3.45Å; G620-E651 VanDerWaalsContact CA-OE1 3.31Å; G620-E651 WeakPolarHBondContact CA-OE1 3.49Å; G620-E651 VanDerWaalsContact CA-OE2 3.29Å; G620-E651 WeakPolarHBondContact CA-OE2 3.41Å; G620-E651 VanDerWaalsContact N-CD 3.25Å; G620-E651 PolarHBondContact N-OE2 2.96Å; T649-E651 PolarHBondContact O-N 3.14Å; E651-G653 PolarHBondContact O-N 2.7Å; E651-A654 WeakPolarHBondContact O-CB 3.32Å; E651-A654 PolarHBondContact O-N 3.11Å; E651-I680 HydrophobicContact CB-CD1 4.05Å; E651-I680 HydrophobicContact CB-CG1 4.2Å; E651-R683 VanDerWaalsContact C-NH1 3.33Å
652	A	88.8	Confident	91.2	Very high	28 Å²	28	36.2 Å²	36.2	23%	0.231	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.2	128.4	-177.5	0	0	0	0	0	111.8	N650 A654 R683 H698 I699	N650-A652 WeakPolarHBondContact OD1-CB 3.33Å; N650-A652 PolarHBondContact OD1-N 3.2Å; A652-A654 VanDerWaalsContact C-N 3.31Å; A652-A654 PolarHBondContact O-N 2.77Å; A652-R683 PolarHBondContact O-NH1 3.32Å; A652-R683 PolarHBondContact O-NH2 2.88Å; A652-H698 CarbonylContact C-O 3.22Å; A652-I699 WeakPolarHBondContact CB-O 3.49Å
653	G	89.6	Confident	91.2	Very high	7 Å²	7	34.3 Å²	34.3	7%	0.072	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	-2.9	-175.9	0	0	0	0	0	116.1	E651 S655 I656 Y657 H698	E651-G653 PolarHBondContact O-N 2.7Å; G653-S655 VanDerWaalsContact C-N 3.35Å; G653-S655 PolarHBondContact O-N 3.21Å; G653-I656 PolarHBondContact O-N 3.29Å; G653-Y657 WeakPolarHBondContact O-CB 3.45Å; G653-Y657 PolarHBondContact O-N 2.81Å; G653-H698 WeakPolarHBondContact CA-O 3.48Å; G653-H698 PolarHBondContact N-O 3.01Å
654	A	91.6	Very high	91.4	Very high	3 Å²	3	33.8 Å²	33.8	3%	0.025	20%	0.204	C	C	.	.	H	α-helix	trans	-66.4	-36.3	178.8	0	0	0	0	0	112.4	E651 A652 Y657 S658 I680 R683	E651-A654 WeakPolarHBondContact O-CB 3.32Å; E651-A654 PolarHBondContact O-N 3.11Å; A652-A654 VanDerWaalsContact C-N 3.31Å; A652-A654 PolarHBondContact O-N 2.77Å; A654-Y657 PolarHBondContact O-N 2.89Å; A654-S658 PolarHBondContact O-N 3.44Å; A654-I680 HydrophobicContact CB-CG1 4.45Å; A654-R683 VanDerWaalsContact N-NH2 3.13Å
655	S	90.9	Very high	91.3	Very high	81 Å²	81	40.7 Å²	40.7	57%	0.566	23%	0.234	S	C	*	.	H	α-helix	trans	-68.7	-31.2	171.9	53.1	0	0	0	0	113.3	G653 S658	G653-S655 VanDerWaalsContact C-N 3.35Å; G653-S655 PolarHBondContact O-N 3.21Å; S655-S658 PolarHBondContact O-OG 2.72Å; S655-S658 VanDerWaalsContact O-OG 3.06Å
656	I	92.7	Very high	91.1	Very high	50 Å²	50	43.2 Å²	43.2	26%	0.256	24%	0.244	S	C	.	.	H	α-helix	trans	-75.7	-39.8	175.2	-65.9	172	0	0	0	109.9	G653 V659 S660 H698	G653-I656 PolarHBondContact O-N 3.29Å; I656-V659 WeakPolarHBondContact O-CG2 3.5Å; I656-S660 PolarHBondContact O-N 3.03Å; I656-H698 HydrophobicContact CD1-CB 3.81Å
657	Y	94.3	Very high	91.1	Very high	1 Å²	1	43.7 Å²	43.7	0%	0.004	25%	0.246	C	C	.	.	H	α-helix	trans	-60.8	-46.6	172.3	172.9	-109.6	0	0	0	111.9	G653 A654 V659 S660 A663 E666 M667 E690 K693	G653-Y657 WeakPolarHBondContact O-CB 3.45Å; G653-Y657 PolarHBondContact O-N 2.81Å; A654-Y657 PolarHBondContact O-N 2.89Å; Y657-V659 PolarHBondContact O-N 3.31Å; Y657-V659 VanDerWaalsContact O-N 3.1Å; Y657-S660 WeakPolarHBondContact O-CB 3.47Å; Y657-S660 PolarHBondContact O-N 3.49Å; Y657-S660 PolarHBondContact O-OG 3.13Å; Y657-A663 HydrophobicContact CD1-CB 4.26Å; Y657-A663 HydrophobicContact CD2-CB 4.16Å; Y657-A663 HydrophobicContact CE1-CB 3.93Å; Y657-A663 HydrophobicContact CE2-CB 3.79Å; Y657-A663 HydrophobicContact CG-CB 4.39Å; Y657-A663 WeakPolarHBondContact O-CB 3.21Å; Y657-E666 PolarHBondContact OH-OE2 3.48Å; Y657-E666 VanDerWaalsContact OH-OE2 3.13Å; Y657-M667 HydrophobicContact CE1-CE 3.88Å; Y657-E690 WeakPolarHBondContact CE1-OE1 3.48Å; Y657-K693 HydrophobicContact CD2-CB 3.95Å; Y657-K693 HydrophobicContact CE2-CB 3.76Å; Y657-K693 HydrophobicContact CE2-CD 3.64Å; Y657-K693 HydrophobicContact CE2-CG 4.35Å
658	S	93.4	Very high	91.1	Very high	8 Å²	8	47.3 Å²	47.3	6%	0.056	27%	0.269	C	S	.	.	H	α-helix	trans	-62.3	-25.5	-172.4	63	0	0	0	0	115.2	A654 S655 P672 R675	A654-S658 PolarHBondContact O-N 3.44Å; S655-S658 PolarHBondContact O-OG 2.72Å; S655-S658 VanDerWaalsContact O-OG 3.06Å; S658-P672 WeakPolarHBondContact CB-O 3.4Å; S658-P672 PolarHBondContact OG-O 3Å; S658-R675 VanDerWaalsContact O-CD 3.24Å; S658-R675 WeakPolarHBondContact O-CD 3.4Å; S658-R675 PolarHBondContact O-NH1 2.83Å
659	V	94.3	Very high	91.3	Very high	98 Å²	98	52.5 Å²	52.5	59%	0.594	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	0.3	174.3	-58.8	0	0	0	0	113.7	I656 Y657 P672	I656-V659 WeakPolarHBondContact O-CG2 3.5Å; Y657-V659 PolarHBondContact O-N 3.31Å; Y657-V659 VanDerWaalsContact O-N 3.1Å; V659-P672 HydrophobicContact CG1-CB 4.15Å
660	S	93.6	Very high	91.5	Very high	17 Å²	17	52.7 Å²	52.7	12%	0.119	30%	0.298	C	S	.	.	S	Bend	trans	-69.9	152.9	-179.9	70.4	0	0	0	0	112.8	I656 Y657 E662 A663 V664	I656-S660 PolarHBondContact O-N 3.03Å; Y657-S660 WeakPolarHBondContact O-CB 3.47Å; Y657-S660 PolarHBondContact O-N 3.49Å; Y657-S660 PolarHBondContact O-OG 3.13Å; S660-E662 PolarHBondContact O-N 3.31Å; S660-A663 PolarHBondContact O-N 2.88Å; S660-A663 WeakPolarHBondContact OG-CB 3.43Å; S660-A663 PolarHBondContact OG-N 2.68Å; S660-V664 WeakPolarHBondContact O-CG2 3.37Å; S660-V664 PolarHBondContact O-N 3.12Å
661	P	91.6	Very high	91.7	Very high	101 Å²	101	54.4 Å²	54.4	66%	0.656	31%	0.307	S	S	*	.	H	α-helix	trans	-55.9	-36.6	170.6	-24.1	34.8	0	0	0	112.8	V664 K665	P661-V664 PolarHBondContact O-N 3.19Å; P661-K665 WeakPolarHBondContact O-CB 3.2Å; P661-K665 PolarHBondContact O-N 2.73Å
662	E	90.3	Very high	91.7	Very high	59 Å²	59	54.3 Å²	54.3	28%	0.276	31%	0.31	S	S	.	.	H	α-helix	trans	-59.1	-50.1	174.8	-76.3	73.5	-172.5	0	0	112	S660 V664 K665 E666 R741	S660-E662 PolarHBondContact O-N 3.31Å; E662-V664 PolarHBondContact O-N 2.88Å; E662-K665 PolarHBondContact O-N 3.15Å; E662-E666 PolarHBondContact O-N 2.69Å; E662-R741 IonicContact OE1-NH1 2.89Å
663	A	92.4	Very high	91.7	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-69.4	-32.5	178.7	0	0	0	0	0	112.8	Y657 S660 K665 E666 M667	Y657-A663 HydrophobicContact CD1-CB 4.26Å; Y657-A663 HydrophobicContact CD2-CB 4.16Å; Y657-A663 HydrophobicContact CE1-CB 3.93Å; Y657-A663 HydrophobicContact CE2-CB 3.79Å; Y657-A663 HydrophobicContact CG-CB 4.39Å; Y657-A663 WeakPolarHBondContact O-CB 3.21Å; S660-A663 PolarHBondContact O-N 2.88Å; S660-A663 WeakPolarHBondContact OG-CB 3.43Å; S660-A663 PolarHBondContact OG-N 2.68Å; A663-K665 VanDerWaalsContact C-N 3.35Å; A663-E666 PolarHBondContact O-N 3.44Å; A663-M667 HydrophobicContact CB-CE 4.09Å; A663-M667 PolarHBondContact O-N 2.93Å
664	V	93.8	Very high	91.9	Very high	67 Å²	67	57.9 Å²	57.9	41%	0.406	32%	0.323	S	S	.	.	H	α-helix	trans	-65.7	-37.5	171.3	174.5	0	0	0	0	111.1	S660 P661 E662 P668	S660-V664 WeakPolarHBondContact O-CG2 3.37Å; S660-V664 PolarHBondContact O-N 3.12Å; P661-V664 PolarHBondContact O-N 3.19Å; E662-V664 PolarHBondContact O-N 2.88Å; V664-P668 VanDerWaalsContact O-CA 3.25Å; V664-P668 WeakPolarHBondContact O-CA 3.05Å
665	K	90.6	Very high	92.1	Very high	150 Å²	150	58.5 Å²	58.5	65%	0.652	33%	0.325	S	S	*	.	H	α-helix	trans	-69.3	-39	174.9	-175.9	-176.7	175.2	-177.9	0	112	P661 E662 A663 E737	P661-K665 WeakPolarHBondContact O-CB 3.2Å; P661-K665 PolarHBondContact O-N 2.73Å; E662-K665 PolarHBondContact O-N 3.15Å; A663-K665 VanDerWaalsContact C-N 3.35Å; K665-E737 IonicContact NZ-OE2 2.87Å; K665-E737 PolarHBondContact NZ-OE2 3.36Å
666	E	89.3	Confident	92.2	Very high	70 Å²	70	54.9 Å²	54.9	33%	0.327	30%	0.3	S	S	.	.	H	α-helix	trans	-75.4	-34.4	178.1	-75	-169.6	-159.3	0	0	113.7	Y657 E662 A663 R682 K693	Y657-E666 PolarHBondContact OH-OE2 3.48Å; Y657-E666 VanDerWaalsContact OH-OE2 3.13Å; E662-E666 PolarHBondContact O-N 2.69Å; A663-E666 PolarHBondContact O-N 3.44Å; E666-R682 IonicContact OE2-CZ 2.99Å; E666-R682 IonicContact OE2-NH1 3.4Å; E666-R682 PolarHBondContact OE2-NH1 3.48Å; E666-K693 VanDerWaalsContact CD-NZ 3.27Å; E666-K693 WeakPolarHBondContact OE1-CE 3.43Å; E666-K693 IonicContact OE1-NZ 2.65Å; E666-K693 PolarHBondContact OE1-NZ 3.47Å; E666-K693 IonicContact OE2-NZ 2.69Å; E666-K693 PolarHBondContact OE2-NZ 3.08Å
667	M	92.3	Very high	92.4	Very high	10 Å²	10	52.5 Å²	52.5	5%	0.049	29%	0.288	C	S	.	.			trans	-142.6	62.8	-168.7	-60.3	169.9	-74.1	0	0	111.2	I583 Y657 A663 D669 L670 R675 V678	I583-M667 HydrophobicContact CD1-CG 3.94Å; I583-M667 HydrophobicContact CD1-SD 3.76Å; Y657-M667 HydrophobicContact CE1-CE 3.88Å; A663-M667 HydrophobicContact CB-CE 4.09Å; A663-M667 PolarHBondContact O-N 2.93Å; M667-D669 PolarHBondContact O-N 3.12Å; M667-L670 HydrophobicContact CB-CB 4.06Å; M667-L670 HydrophobicContact CB-CD2 4.44Å; M667-L670 PolarHBondContact O-N 3.42Å; M667-L670 HydrophobicContact SD-CD2 4.03Å; M667-R675 HydrophobicContact CB-CG 4.18Å; M667-R675 HydrophobicContact CE-CB 3.93Å; M667-R675 HydrophobicContact CE-CG 3.84Å; M667-R675 PolarHBondContact O-NE 2.84Å; M667-R675 PolarHBondContact O-NH2 3.09Å; M667-R675 HydrophobicContact SD-CB 4.44Å; M667-R675 HydrophobicContact SD-CG 4.1Å; M667-V678 HydrophobicContact SD-CB 4.05Å; M667-V678 HydrophobicContact SD-CG1 3.73Å; M667-V678 HydrophobicContact SD-CG2 4.14Å
668	P	91	Very high	92.5	Very high	77 Å²	77	52.5 Å²	52.5	50%	0.5	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-46.9	-171.4	21.9	-32.9	0	0	0	112.7	V664 L670 R675	V664-P668 VanDerWaalsContact O-CA 3.25Å; V664-P668 WeakPolarHBondContact O-CA 3.05Å; P668-L670 VanDerWaalsContact C-N 3.29Å; P668-L670 PolarHBondContact O-N 2.87Å; P668-R675 PolarHBondContact O-NH2 3.02Å; P668-R675 VanDerWaalsContact O-NH2 3.12Å
669	D	91.4	Very high	92.6	Very high	162 Å²	162	52.1 Å²	52.1	87%	0.866	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-1.2	-173	-50.7	-58.3	0	0	0	114.5	M667	M667-D669 PolarHBondContact O-N 3.12Å
670	L	93.3	Very high	92.7	Very high	29 Å²	29	47.4 Å²	47.4	15%	0.152	26%	0.257	C	S	.	.	S	Bend	trans	-95.7	136.1	-176.7	-168	62.8	0	0	0	111.8	I583 T586 M667 P668 L674 R675 V678	I583-L670 HydrophobicContact CD1-CD2 4.31Å; T586-L670 HydrophobicContact CG2-CD1 4.06Å; T586-L670 HydrophobicContact CG2-CD2 4.29Å; M667-L670 HydrophobicContact CB-CB 4.06Å; M667-L670 HydrophobicContact CB-CD2 4.44Å; M667-L670 PolarHBondContact O-N 3.42Å; M667-L670 HydrophobicContact SD-CD2 4.03Å; P668-L670 VanDerWaalsContact C-N 3.29Å; P668-L670 PolarHBondContact O-N 2.87Å; L670-L674 HydrophobicContact CD1-CB 3.65Å; L670-L674 HydrophobicContact CD1-CD1 3.66Å; L670-L674 HydrophobicContact CD1-CG 4.31Å; L670-L674 HydrophobicContact CD2-CB 4.09Å; L670-L674 HydrophobicContact CG-CB 3.75Å; L670-R675 HydrophobicContact CB-CG 4.1Å; L670-R675 HydrophobicContact CD2-CG 3.9Å; L670-R675 HydrophobicContact CG-CG 4.06Å; L670-R675 PolarHBondContact O-NE 3.18Å; L670-R675 PolarHBondContact O-NH2 3.01Å; L670-V678 HydrophobicContact CD2-CG2 3.94Å
671	D	91.5	Very high	92.8	Very high	80 Å²	80	46.6 Å²	46.6	43%	0.428	25%	0.251	S	S	.	.			trans	-60	140.8	175.3	-178.5	-93.8	0	0	0	111.8	N673 L674 R675	D671-N673 PolarHBondContact O-N 3.36Å; D671-N673 VanDerWaalsContact O-N 3.13Å; D671-N673 VanDerWaalsContact OD1-CB 3.23Å; D671-N673 WeakPolarHBondContact OD1-CB 3.29Å; D671-N673 PolarHBondContact OD1-N 2.62Å; D671-N673 PolarHBondContact OD1-ND2 3.37Å; D671-L674 HydrophobicContact CB-CD1 4.21Å; D671-L674 HydrophobicContact CB-CG 4.34Å; D671-L674 PolarHBondContact O-N 3.14Å; D671-R675 PolarHBondContact O-N 2.98Å; D671-R675 VanDerWaalsContact O-N 3.11Å
672	P	89.8	Confident	92.9	Very high	43 Å²	43	43.5 Å²	43.5	28%	0.279	23%	0.226	S	C	.	.	H	α-helix	trans	-53.7	-32.7	178.9	-28.8	36.5	0	0	0	115	S658 V659 L674 R675 S676	S658-P672 WeakPolarHBondContact CB-O 3.4Å; S658-P672 PolarHBondContact OG-O 3Å; V659-P672 HydrophobicContact CG1-CB 4.15Å; P672-L674 VanDerWaalsContact C-N 3.29Å; P672-L674 PolarHBondContact O-N 2.86Å; P672-R675 PolarHBondContact O-N 3.34Å; P672-S676 PolarHBondContact O-N 2.84Å
673	N	87.8	Confident	93.1	Very high	85 Å²	85	41.2 Å²	41.2	46%	0.455	22%	0.215	S	C	.	.	H	α-helix	trans	-75.3	-17.4	178.2	-53.1	-82.9	0	0	0	113	K573 D671 S676	K573-N673 VanDerWaalsContact CB-O 3.25Å; K573-N673 WeakPolarHBondContact CB-O 3.33Å; K573-N673 HydrophobicContact CD-CB 4.05Å; K573-N673 WeakPolarHBondContact CD-O 3.24Å; K573-N673 HydrophobicContact CG-CB 4.15Å; K573-N673 WeakPolarHBondContact CG-O 3.41Å; D671-N673 PolarHBondContact O-N 3.36Å; D671-N673 VanDerWaalsContact O-N 3.13Å; D671-N673 VanDerWaalsContact OD1-CB 3.23Å; D671-N673 WeakPolarHBondContact OD1-CB 3.29Å; D671-N673 PolarHBondContact OD1-N 2.62Å; D671-N673 PolarHBondContact OD1-ND2 3.37Å; N673-S676 PolarHBondContact O-OG 3.08Å
674	L	94.4	Very high	93.2	Very high	24 Å²	24	41.5 Å²	41.5	13%	0.126	22%	0.217	C	C	.	.	H	α-helix	trans	-89.2	-30.9	173.2	-64.7	173.9	0	0	0	111	K573 D587 V588 L670 D671 P672 S676 A677 V678	K573-L674 HydrophobicContact CB-CD2 4.01Å; K573-L674 HydrophobicContact CG-CD2 4.18Å; D587-L674 WeakPolarHBondContact O-CD2 3.26Å; V588-L674 HydrophobicContact CG2-CD2 3.89Å; L670-L674 HydrophobicContact CD1-CB 3.65Å; L670-L674 HydrophobicContact CD1-CD1 3.66Å; L670-L674 HydrophobicContact CD1-CG 4.31Å; L670-L674 HydrophobicContact CD2-CB 4.09Å; L670-L674 HydrophobicContact CG-CB 3.75Å; D671-L674 HydrophobicContact CB-CD1 4.21Å; D671-L674 HydrophobicContact CB-CG 4.34Å; D671-L674 PolarHBondContact O-N 3.14Å; P672-L674 VanDerWaalsContact C-N 3.29Å; P672-L674 PolarHBondContact O-N 2.86Å; L674-S676 VanDerWaalsContact C-N 3.3Å; L674-S676 PolarHBondContact O-N 3.28Å; L674-A677 PolarHBondContact O-N 3.08Å; L674-V678 PolarHBondContact O-N 3.06Å; L674-V678 VanDerWaalsContact O-N 3.16Å
675	R	95.6	Very high	93.1	Very high	17 Å²	17	38.7 Å²	38.7	6%	0.064	20%	0.199	C	C	.	.	H	α-helix	trans	-63.2	-31.3	174.7	-65.6	176.7	-172.2	154.8	3.6	113.1	S658 M667 P668 L670 D671 P672 V678 S679	S658-R675 VanDerWaalsContact O-CD 3.24Å; S658-R675 WeakPolarHBondContact O-CD 3.4Å; S658-R675 PolarHBondContact O-NH1 2.83Å; M667-R675 HydrophobicContact CB-CG 4.18Å; M667-R675 HydrophobicContact CE-CB 3.93Å; M667-R675 HydrophobicContact CE-CG 3.84Å; M667-R675 PolarHBondContact O-NE 2.84Å; M667-R675 PolarHBondContact O-NH2 3.09Å; M667-R675 HydrophobicContact SD-CB 4.44Å; M667-R675 HydrophobicContact SD-CG 4.1Å; P668-R675 PolarHBondContact O-NH2 3.02Å; P668-R675 VanDerWaalsContact O-NH2 3.12Å; L670-R675 HydrophobicContact CB-CG 4.1Å; L670-R675 HydrophobicContact CD2-CG 3.9Å; L670-R675 HydrophobicContact CG-CG 4.06Å; L670-R675 PolarHBondContact O-NE 3.18Å; L670-R675 PolarHBondContact O-NH2 3.01Å; D671-R675 PolarHBondContact O-N 2.98Å; D671-R675 VanDerWaalsContact O-N 3.11Å; P672-R675 PolarHBondContact O-N 3.34Å; R675-V678 PolarHBondContact O-N 3.08Å; R675-S679 PolarHBondContact O-N 2.91Å
676	S	93.4	Very high	93.3	Very high	5 Å²	5	33 Å²	33	4%	0.035	18%	0.176	C	C	.	.	H	α-helix	trans	-64.8	-44.8	173.7	45.5	0	0	0	0	111.7	D565 P672 N673 L674 V678 S679 I680	D565-S676 VanDerWaalsContact OD2-CB 3.27Å; D565-S676 WeakPolarHBondContact OD2-CB 3.36Å; D565-S676 PolarHBondContact OD2-OG 3.4Å; P672-S676 PolarHBondContact O-N 2.84Å; N673-S676 PolarHBondContact O-OG 3.08Å; L674-S676 VanDerWaalsContact C-N 3.3Å; L674-S676 PolarHBondContact O-N 3.28Å; S676-V678 VanDerWaalsContact C-N 3.32Å; S676-V678 PolarHBondContact O-N 2.79Å; S676-S679 WeakPolarHBondContact O-CB 3.22Å; S676-S679 PolarHBondContact O-N 3.46Å; S676-S679 VanDerWaalsContact O-N 3.09Å; S676-I680 WeakPolarHBondContact O-CG1 3.28Å; S676-I680 PolarHBondContact O-N 3.26Å
677	A	95.8	Very high	93.5	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.9	-38.5	174.5	0	0	0	0	0	112.5	D565 K573 A575 L674 I680 G681	D565-A677 HydrophobicContact CB-CB 3.97Å; K573-A677 HydrophobicContact CB-CB 4.05Å; K573-A677 WeakPolarHBondContact O-CB 3.23Å; A575-A677 HydrophobicContact CB-CB 4.02Å; L674-A677 PolarHBondContact O-N 3.08Å; A677-I680 PolarHBondContact O-N 3.13Å; A677-G681 PolarHBondContact O-N 3.14Å; A677-G681 VanDerWaalsContact O-N 3.14Å
678	V	96.8	Very high	93.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.6	-46.4	171.4	173.5	0	0	0	0	110.9	A575 L577 I583 T586 M667 L670 L674 R675 S676 G681 R682	A575-V678 HydrophobicContact CB-CB 4.24Å; A575-V678 HydrophobicContact CB-CG2 3.55Å; L577-V678 HydrophobicContact CD2-CG1 4.18Å; I583-V678 HydrophobicContact CD1-CG1 4.14Å; I583-V678 HydrophobicContact CD1-CG2 3.84Å; I583-V678 HydrophobicContact CG1-CG1 4.19Å; I583-V678 HydrophobicContact CG1-CG2 4.08Å; T586-V678 HydrophobicContact CG2-CG2 4.46Å; M667-V678 HydrophobicContact SD-CB 4.05Å; M667-V678 HydrophobicContact SD-CG1 3.73Å; M667-V678 HydrophobicContact SD-CG2 4.14Å; L670-V678 HydrophobicContact CD2-CG2 3.94Å; L674-V678 PolarHBondContact O-N 3.06Å; L674-V678 VanDerWaalsContact O-N 3.16Å; R675-V678 PolarHBondContact O-N 3.08Å; S676-V678 VanDerWaalsContact C-N 3.32Å; S676-V678 PolarHBondContact O-N 2.79Å; V678-G681 PolarHBondContact O-N 3.28Å; V678-R682 HydrophobicContact CG1-CG 4.34Å; V678-R682 WeakPolarHBondContact O-CB 3.49Å; V678-R682 WeakPolarHBondContact O-CG 3.37Å; V678-R682 PolarHBondContact O-N 3.48Å
679	S	95.9	Very high	93.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63	-43.9	178.7	-166.9	0	0	0	0	112.2	R675 S676 G681 R682 R683 E690	R675-S679 PolarHBondContact O-N 2.91Å; S676-S679 WeakPolarHBondContact O-CB 3.22Å; S676-S679 PolarHBondContact O-N 3.46Å; S676-S679 VanDerWaalsContact O-N 3.09Å; S679-G681 VanDerWaalsContact C-N 3.34Å; S679-G681 PolarHBondContact O-N 3.02Å; S679-R682 PolarHBondContact O-N 3.4Å; S679-R683 VanDerWaalsContact O-CG 3.25Å; S679-R683 WeakPolarHBondContact O-CG 3.4Å; S679-R683 PolarHBondContact O-N 2.94Å; S679-E690 VanDerWaalsContact CA-OE1 3.28Å; S679-E690 WeakPolarHBondContact CA-OE1 3.47Å; S679-E690 VanDerWaalsContact CB-OE1 3.23Å; S679-E690 WeakPolarHBondContact CB-OE1 3.43Å; S679-E690 PolarHBondContact OG-OE1 3.04Å
680	I	95.4	Very high	93.9	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-55.1	-47.2	176.5	-75.6	168	0	0	0	111.3	D565 V616 T649 E651 A654 S676 A677	D565-I680 HydrophobicContact CB-CD1 3.76Å; V616-I680 HydrophobicContact CG1-CG2 3.83Å; V616-I680 WeakPolarHBondContact CG1-O 3.31Å; T649-I680 HydrophobicContact CG2-CG2 3.79Å; E651-I680 HydrophobicContact CB-CD1 4.05Å; E651-I680 HydrophobicContact CB-CG1 4.2Å; A654-I680 HydrophobicContact CB-CG1 4.45Å; S676-I680 WeakPolarHBondContact O-CG1 3.28Å; S676-I680 PolarHBondContact O-N 3.26Å; A677-I680 PolarHBondContact O-N 3.13Å
681	G	95.4	Very high	93.9	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-65.4	-45	175.6	0	0	0	0	0	113.2	A677 V678 S679 R683 V684 Q685	A677-G681 PolarHBondContact O-N 3.14Å; A677-G681 VanDerWaalsContact O-N 3.14Å; V678-G681 PolarHBondContact O-N 3.28Å; S679-G681 VanDerWaalsContact C-N 3.34Å; S679-G681 PolarHBondContact O-N 3.02Å; G681-R683 VanDerWaalsContact C-N 3.34Å; G681-R683 PolarHBondContact O-N 3.03Å; G681-V684 PolarHBondContact O-N 3.21Å; G681-Q685 PolarHBondContact O-N 2.88Å
682	R	95.2	Very high	94.1	Very high	36 Å²	36	15.8 Å²	15.8	14%	0.136	9%	0.087	C	C	.	.	H	α-helix	trans	-63.9	-34.7	-179.5	-75	-179.5	174.8	176.2	-6.5	113.3	L577 S581 E666 V678 S679 V684 Q685 D686 E690	L577-R682 HydrophobicContact CD1-CG 3.75Å; S581-R682 PolarHBondContact O-NE 2.91Å; S581-R682 PolarHBondContact O-NH2 2.76Å; S581-R682 VanDerWaalsContact O-NH2 3.1Å; E666-R682 IonicContact OE2-CZ 2.99Å; E666-R682 IonicContact OE2-NH1 3.4Å; E666-R682 PolarHBondContact OE2-NH1 3.48Å; V678-R682 HydrophobicContact CG1-CG 4.34Å; V678-R682 WeakPolarHBondContact O-CB 3.49Å; V678-R682 WeakPolarHBondContact O-CG 3.37Å; V678-R682 PolarHBondContact O-N 3.48Å; S679-R682 PolarHBondContact O-N 3.4Å; R682-V684 PolarHBondContact O-N 3.25Å; R682-Q685 PolarHBondContact O-N 3.47Å; R682-Q685 VanDerWaalsContact O-N 3.07Å; R682-D686 PolarHBondContact O-N 3.1Å; R682-E690 HydrophobicContact CB-CB 4.13Å; R682-E690 HydrophobicContact CB-CG 3.75Å; R682-E690 WeakPolarHBondContact CD-OE2 3.3Å
683	R	93.9	Very high	94.2	Very high	10 Å²	10	15 Å²	15	4%	0.038	8%	0.079	C	C	.	.	H	α-helix	trans	-56.3	-29	174.9	-76.1	168	-170	-134.6	-5	113.4	N650 E651 A652 A654 S679 G681 P687 E690 L691	N650-R683 PolarHBondContact O-NH1 3.13Å; E651-R683 VanDerWaalsContact C-NH1 3.33Å; A652-R683 PolarHBondContact O-NH1 3.32Å; A652-R683 PolarHBondContact O-NH2 2.88Å; A654-R683 VanDerWaalsContact N-NH2 3.13Å; S679-R683 VanDerWaalsContact O-CG 3.25Å; S679-R683 WeakPolarHBondContact O-CG 3.4Å; S679-R683 PolarHBondContact O-N 2.94Å; G681-R683 VanDerWaalsContact C-N 3.34Å; G681-R683 PolarHBondContact O-N 3.03Å; R683-P687 WeakPolarHBondContact O-CA 3.45Å; R683-P687 WeakPolarHBondContact O-CB 3.3Å; R683-P687 WeakPolarHBondContact O-CD 3.43Å; R683-P687 WeakPolarHBondContact O-CG 3.32Å; R683-E690 HydrophobicContact CG-CB 4.32Å; R683-E690 HydrophobicContact CG-CG 3.83Å; R683-L691 HydrophobicContact CG-CD2 4.25Å
684	V	93.9	Very high	94.4	Very high	7 Å²	7	11.4 Å²	11.4	4%	0.042	6%	0.06	C	C	.	.	H	α-helix	trans	-90.1	-30.7	176.7	173.9	0	0	0	0	111.6	V556 I561 V616 T649 G681 R682 A910 F912	V556-V684 HydrophobicContact CB-CG1 3.96Å; V556-V684 WeakPolarHBondContact CB-O 3.42Å; V556-V684 HydrophobicContact CG2-CG1 3.59Å; V556-V684 WeakPolarHBondContact CG2-O 3.39Å; V556-V684 PolarHBondContact N-O 2.74Å; I561-V684 HydrophobicContact CD1-CG1 4.2Å; V616-V684 HydrophobicContact CB-CG2 4.37Å; V616-V684 HydrophobicContact CG1-CB 4.26Å; V616-V684 HydrophobicContact CG1-CG2 3.5Å; V616-V684 VanDerWaalsContact CG1-CG2 3.5Å; V616-V684 HydrophobicContact CG2-CB 3.88Å; V616-V684 HydrophobicContact CG2-CG1 4.01Å; V616-V684 HydrophobicContact CG2-CG2 3.88Å; T649-V684 HydrophobicContact CG2-CG2 4.46Å; G681-V684 PolarHBondContact O-N 3.21Å; R682-V684 PolarHBondContact O-N 3.25Å; V684-A910 HydrophobicContact CG1-CB 4.07Å; V684-F912 HydrophobicContact CG1-CZ 4.09Å
685	Q	93.2	Very high	94.1	Very high	8 Å²	8	12.9 Å²	12.9	4%	0.037	7%	0.068	C	C	.	.	H	α-helix	trans	-66.8	-48.9	174.8	-68	-171.8	-41.7	0	0	112.4	P555 V556 S559 I561 S578 S581 G681 R682	P555-Q685 WeakPolarHBondContact CB-O 3.37Å; V556-Q685 PolarHBondContact N-O 3.45Å; S559-Q685 PolarHBondContact O-NE2 3.49Å; I561-Q685 HydrophobicContact CD1-CG 3.73Å; I561-Q685 HydrophobicContact CG1-CG 4.23Å; S578-Q685 PolarHBondContact O-NE2 3.15Å; S581-Q685 VanDerWaalsContact CA-OE1 3.28Å; S581-Q685 VanDerWaalsContact CB-OE1 3.27Å; S581-Q685 PolarHBondContact OG-OE1 3.48Å; G681-Q685 PolarHBondContact O-N 2.88Å; R682-Q685 PolarHBondContact O-N 3.47Å; R682-Q685 VanDerWaalsContact O-N 3.07Å
686	D	93.8	Very high	93.6	Very high	29 Å²	29	12.6 Å²	12.6	16%	0.155	7%	0.068	C	C	.	.			trans	-148	101.2	166.7	-163.6	-57.4	0	0	0	110.7	P555 R557 R682 L688 A689 E690 R904	P555-D686 HydrophobicContact CB-CB 4.32Å; R557-D686 IonicContact NH2-OD2 3.99Å; R557-D686 PolarHBondContact NH2-OD2 2.98Å; R682-D686 PolarHBondContact O-N 3.1Å; D686-L688 VanDerWaalsContact C-N 3.3Å; D686-L688 PolarHBondContact O-N 2.83Å; D686-L688 WeakPolarHBondContact OD1-CB 3.41Å; D686-L688 PolarHBondContact OD1-N 2.67Å; D686-A689 HydrophobicContact CB-CB 4.05Å; D686-A689 PolarHBondContact O-N 3.24Å; D686-A689 PolarHBondContact OD1-N 2.96Å; D686-A689 VanDerWaalsContact OD1-N 3.09Å; D686-E690 PolarHBondContact O-N 3.35Å; D686-R904 VanDerWaalsContact CG-NH1 3.34Å; D686-R904 IonicContact OD1-CZ 3.09Å; D686-R904 IonicContact OD1-NH1 2.76Å; D686-R904 PolarHBondContact OD1-NH1 2.82Å; D686-R904 IonicContact OD1-NH2 3.48Å; D686-R904 IonicContact OD2-CZ 3.98Å; D686-R904 IonicContact OD2-NH1 3.42Å; D686-R904 PolarHBondContact OD2-NH1 2.76Å; D686-R904 IonicContact OD2-NH2 3.16Å; D686-R904 PolarHBondContact OD2-NH2 2.82Å
687	P	93.8	Very high	93.1	Very high	7 Å²	7	16.1 Å²	16.1	5%	0.045	8%	0.083	C	C	.	.	H	α-helix	trans	-56.9	-40.7	-177.7	-22.9	28.2	0	0	0	113.4	V553 R683 L691	V553-P687 HydrophobicContact CB-CB 4.23Å; V553-P687 HydrophobicContact CB-CG 3.78Å; V553-P687 HydrophobicContact CG1-CG 3.8Å; R683-P687 WeakPolarHBondContact O-CA 3.45Å; R683-P687 WeakPolarHBondContact O-CB 3.3Å; R683-P687 WeakPolarHBondContact O-CD 3.43Å; R683-P687 WeakPolarHBondContact O-CG 3.32Å; P687-L691 HydrophobicContact CB-CD1 4.45Å; P687-L691 WeakPolarHBondContact O-CB 3.38Å; P687-L691 WeakPolarHBondContact O-CG 3.17Å; P687-L691 PolarHBondContact O-N 3.48Å
688	L	94.8	Very high	92.7	Very high	4 Å²	4	18.9 Å²	18.9	2%	0.021	10%	0.096	C	C	.	.	H	α-helix	trans	-65.7	-50.9	-178.4	-176.5	67.4	0	0	0	110.6	L551 D686 E690 V692 C724 V725 V728 L739 R904	L551-L688 HydrophobicContact CB-CD1 3.95Å; L551-L688 HydrophobicContact CD2-CD1 4.25Å; D686-L688 VanDerWaalsContact C-N 3.3Å; D686-L688 PolarHBondContact O-N 2.83Å; D686-L688 WeakPolarHBondContact OD1-CB 3.41Å; D686-L688 PolarHBondContact OD1-N 2.67Å; L688-E690 VanDerWaalsContact C-N 3.26Å; L688-E690 PolarHBondContact O-N 3.47Å; L688-V692 HydrophobicContact CD1-CG1 4.29Å; L688-V692 WeakPolarHBondContact O-CG1 3.18Å; L688-V692 WeakPolarHBondContact O-CG2 3.3Å; L688-V692 PolarHBondContact O-N 2.79Å; L688-C724 HydrophobicContact CD1-CB 4.06Å; L688-V725 HydrophobicContact CD1-CG2 3.83Å; L688-V725 HydrophobicContact CD2-CG2 4.43Å; L688-V725 HydrophobicContact CG-CG2 4.24Å; L688-V728 HydrophobicContact CD2-CB 3.91Å; L688-V728 HydrophobicContact CD2-CG1 3.96Å; L688-V728 HydrophobicContact CD2-CG2 3.98Å; L688-L739 HydrophobicContact CG-CD1 4.21Å; L688-R904 VanDerWaalsContact CB-NH1 3.29Å
689	A	93.4	Very high	92.1	Very high	30 Å²	30	19.1 Å²	19.1	25%	0.248	10%	0.097	C	C	.	.	H	α-helix	trans	-66.4	-26.3	-174.5	0	0	0	0	0	113.8	D686 K693 L739	D686-A689 HydrophobicContact CB-CB 4.05Å; D686-A689 PolarHBondContact O-N 3.24Å; D686-A689 PolarHBondContact OD1-N 2.96Å; D686-A689 VanDerWaalsContact OD1-N 3.09Å; A689-K693 WeakPolarHBondContact O-CE 3.49Å; A689-L739 HydrophobicContact CB-CD2 4.3Å
690	E	94.6	Very high	91.2	Very high	4 Å²	4	20.5 Å²	20.5	2%	0.019	11%	0.111	C	C	.	.	H	α-helix	trans	-92.4	-41.5	178.5	-172.2	63.7	-165.8	0	0	112.6	Y657 S679 R682 R683 D686 L688 V692 K693	Y657-E690 WeakPolarHBondContact CE1-OE1 3.48Å; S679-E690 VanDerWaalsContact CA-OE1 3.28Å; S679-E690 WeakPolarHBondContact CA-OE1 3.47Å; S679-E690 VanDerWaalsContact CB-OE1 3.23Å; S679-E690 WeakPolarHBondContact CB-OE1 3.43Å; S679-E690 PolarHBondContact OG-OE1 3.04Å; R682-E690 HydrophobicContact CB-CB 4.13Å; R682-E690 HydrophobicContact CB-CG 3.75Å; R682-E690 WeakPolarHBondContact CD-OE2 3.3Å; R683-E690 HydrophobicContact CG-CB 4.32Å; R683-E690 HydrophobicContact CG-CG 3.83Å; D686-E690 PolarHBondContact O-N 3.35Å; L688-E690 VanDerWaalsContact C-N 3.26Å; L688-E690 PolarHBondContact O-N 3.47Å; E690-V692 PolarHBondContact O-N 2.81Å; E690-K693 WeakPolarHBondContact O-CB 3.39Å; E690-K693 WeakPolarHBondContact O-CG 3.47Å; E690-K693 PolarHBondContact O-N 3.41Å; E690-K693 WeakPolarHBondContact OE2-CE 3.44Å; E690-K693 IonicContact OE2-NZ 3.91Å; E690-K693 PolarHBondContact OE2-NZ 3.3Å
691	L	94.1	Very high	90.6	Very high	12 Å²	12	20.5 Å²	20.5	6%	0.063	11%	0.111	C	C	.	.	H	α-helix	trans	-68.9	-29.9	-177.3	-70.8	175	0	0	0	113.5	R550 L551 R683 P687 K693 I694 I699	R550-L691 HydrophobicContact CB-CD1 4.3Å; L551-L691 HydrophobicContact CD2-CB 3.76Å; L551-L691 HydrophobicContact CD2-CD1 4.18Å; R683-L691 HydrophobicContact CG-CD2 4.25Å; P687-L691 HydrophobicContact CB-CD1 4.45Å; P687-L691 WeakPolarHBondContact O-CB 3.38Å; P687-L691 WeakPolarHBondContact O-CG 3.17Å; P687-L691 PolarHBondContact O-N 3.48Å; L691-K693 PolarHBondContact O-N 2.92Å; L691-K693 VanDerWaalsContact O-N 3.16Å; L691-I694 WeakPolarHBondContact O-CB 3.32Å; L691-I694 PolarHBondContact O-N 2.91Å; L691-I694 VanDerWaalsContact O-N 3.11Å; L691-I699 HydrophobicContact CB-CD1 4.26Å; L691-I699 HydrophobicContact CD2-CG2 4.31Å
692	V	94.3	Very high	89.9	Confident	11 Å²	11	21 Å²	21	7%	0.067	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-9.8	176.1	-62.1	0	0	0	0	114.1	L551 L688 E690 I694 V721 V725 L739	L551-V692 HydrophobicContact CD2-CG1 4.48Å; L688-V692 HydrophobicContact CD1-CG1 4.29Å; L688-V692 WeakPolarHBondContact O-CG1 3.18Å; L688-V692 WeakPolarHBondContact O-CG2 3.3Å; L688-V692 PolarHBondContact O-N 2.79Å; E690-V692 PolarHBondContact O-N 2.81Å; V692-I694 PolarHBondContact O-N 3.05Å; V692-V721 HydrophobicContact CB-CG1 4.43Å; V692-V721 HydrophobicContact CG1-CG1 3.68Å; V692-V725 HydrophobicContact CG1-CG2 4.01Å; V692-L739 HydrophobicContact CG2-CB 4.37Å; V692-L739 HydrophobicContact CG2-CD1 3.95Å
693	K	92.9	Very high	89.2	Confident	26 Å²	26	22.5 Å²	22.5	11%	0.113	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-5.7	172.4	-54.5	178.8	-177.4	177.7	0	112.9	Y657 E666 A689 E690 L691 T738	Y657-K693 HydrophobicContact CD2-CB 3.95Å; Y657-K693 HydrophobicContact CE2-CB 3.76Å; Y657-K693 HydrophobicContact CE2-CD 3.64Å; Y657-K693 HydrophobicContact CE2-CG 4.35Å; E666-K693 VanDerWaalsContact CD-NZ 3.27Å; E666-K693 WeakPolarHBondContact OE1-CE 3.43Å; E666-K693 IonicContact OE1-NZ 2.65Å; E666-K693 PolarHBondContact OE1-NZ 3.47Å; E666-K693 IonicContact OE2-NZ 2.69Å; E666-K693 PolarHBondContact OE2-NZ 3.08Å; A689-K693 WeakPolarHBondContact O-CE 3.49Å; E690-K693 WeakPolarHBondContact O-CB 3.39Å; E690-K693 WeakPolarHBondContact O-CG 3.47Å; E690-K693 PolarHBondContact O-N 3.41Å; E690-K693 WeakPolarHBondContact OE2-CE 3.44Å; E690-K693 IonicContact OE2-NZ 3.91Å; E690-K693 PolarHBondContact OE2-NZ 3.3Å; L691-K693 PolarHBondContact O-N 2.92Å; L691-K693 VanDerWaalsContact O-N 3.16Å; K693-T738 HydrophobicContact CB-CG2 4.44Å; K693-T738 HydrophobicContact CG-CG2 4.05Å
694	I	92	Very high	88.8	Confident	9 Å²	9	25.1 Å²	25.1	5%	0.046	14%	0.14	C	C	.	.	S	Bend	trans	-118.5	133.9	-172.4	-49	-176.9	0	0	0	107.9	L691 V692 P696 H698 I699	L691-I694 WeakPolarHBondContact O-CB 3.32Å; L691-I694 PolarHBondContact O-N 2.91Å; L691-I694 VanDerWaalsContact O-N 3.11Å; V692-I694 PolarHBondContact O-N 3.05Å; I694-P696 WeakPolarHBondContact O-CD 3.28Å; I694-H698 HydrophobicContact CG2-CB 3.95Å; I694-I699 HydrophobicContact CB-CG1 4.25Å; I694-I699 HydrophobicContact CG2-CG1 4.14Å
695	D	88.1	Confident	88.5	Confident	56 Å²	56	25.7 Å²	25.7	30%	0.299	14%	0.142	S	C	.	.			trans	-55.2	122.7	171.4	-178.3	-40.7	0	0	0	108.7	K697 H698	D695-K697 PolarHBondContact O-N 3.43Å; D695-K697 VanDerWaalsContact OD1-CD 3.26Å; D695-K697 WeakPolarHBondContact OD1-CD 3.28Å; D695-K697 VanDerWaalsContact OD1-CG 3.24Å; D695-K697 WeakPolarHBondContact OD1-CG 3.45Å; D695-K697 PolarHBondContact OD1-N 2.91Å; D695-K697 IonicContact OD1-NZ 3.88Å; D695-K697 VanDerWaalsContact OD2-CE 3.29Å; D695-K697 WeakPolarHBondContact OD2-CE 3.45Å; D695-K697 IonicContact OD2-NZ 2.88Å; D695-K697 PolarHBondContact OD2-NZ 3.43Å; D695-H698 WeakPolarHBondContact O-CB 3.29Å; D695-H698 PolarHBondContact O-N 3.25Å
696	P	84.9	Confident	88.2	Confident	10 Å²	10	31.6 Å²	31.6	7%	0.065	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-53.3	-27.8	-169.8	-33	38	0	0	0	115.9	L547 I694 H698 I699 L717 V721	L547-P696 HydrophobicContact CD2-CB 3.88Å; L547-P696 HydrophobicContact CD2-CG 4.49Å; I694-P696 WeakPolarHBondContact O-CD 3.28Å; P696-H698 PolarHBondContact O-N 3.3Å; P696-I699 WeakPolarHBondContact O-CB 3.32Å; P696-I699 PolarHBondContact O-N 2.97Å; P696-L717 HydrophobicContact CB-CB 3.58Å; P696-L717 HydrophobicContact CB-CD1 3.75Å; P696-L717 HydrophobicContact CB-CG 4.25Å; P696-L717 HydrophobicContact CG-CB 4.17Å; P696-V721 HydrophobicContact CG-CG2 3.89Å
697	K	83.8	Confident	87.9	Confident	80 Å²	80	32.3 Å²	32.3	35%	0.348	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-63.2	-21.5	176.2	79.3	-158.1	177.7	-148.7	0	113.4	D695 Q705	D695-K697 PolarHBondContact O-N 3.43Å; D695-K697 VanDerWaalsContact OD1-CD 3.26Å; D695-K697 WeakPolarHBondContact OD1-CD 3.28Å; D695-K697 VanDerWaalsContact OD1-CG 3.24Å; D695-K697 WeakPolarHBondContact OD1-CG 3.45Å; D695-K697 PolarHBondContact OD1-N 2.91Å; D695-K697 IonicContact OD1-NZ 3.88Å; D695-K697 VanDerWaalsContact OD2-CE 3.29Å; D695-K697 WeakPolarHBondContact OD2-CE 3.45Å; D695-K697 IonicContact OD2-NZ 2.88Å; D695-K697 PolarHBondContact OD2-NZ 3.43Å; K697-Q705 PolarHBondContact O-NE2 2.95Å
698	H	87.7	Confident	87.8	Confident	58 Å²	58	32.4 Å²	32.4	27%	0.269	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-93.6	-3.4	-179.2	-65.1	-47.1	0	0	0	113.6	A652 G653 I656 I694 D695 P696 G700	A652-H698 CarbonylContact C-O 3.22Å; G653-H698 WeakPolarHBondContact CA-O 3.48Å; G653-H698 PolarHBondContact N-O 3.01Å; I656-H698 HydrophobicContact CD1-CB 3.81Å; I694-H698 HydrophobicContact CG2-CB 3.95Å; D695-H698 WeakPolarHBondContact O-CB 3.29Å; D695-H698 PolarHBondContact O-N 3.25Å; P696-H698 PolarHBondContact O-N 3.3Å; H698-G700 PolarHBondContact O-N 3.15Å
699	I	83.6	Confident	87.6	Confident	4 Å²	4	34.8 Å²	34.8	2%	0.021	19%	0.191	C	C	.	.	S	Bend	trans	-77.4	-6.3	178	-59.5	177.2	0	0	0	111.4	L547 R550 A652 L691 I694 P696 I701	L547-I699 HydrophobicContact CD1-CD1 3.89Å; L547-I699 HydrophobicContact CD1-CG2 4.35Å; R550-I699 PolarHBondContact NH1-O 3.27Å; A652-I699 WeakPolarHBondContact CB-O 3.49Å; L691-I699 HydrophobicContact CB-CD1 4.26Å; L691-I699 HydrophobicContact CD2-CG2 4.31Å; I694-I699 HydrophobicContact CB-CG1 4.25Å; I694-I699 HydrophobicContact CG2-CG1 4.14Å; P696-I699 WeakPolarHBondContact O-CB 3.32Å; P696-I699 PolarHBondContact O-N 2.97Å; I699-I701 HydrophobicContact CB-CG2 4.07Å; I699-I701 HydrophobicContact CG2-CG2 4.27Å
700	G	76.4	Confident	87.5	Confident	30 Å²	30	37.1 Å²	37.1	31%	0.309	21%	0.21	S	C	.	.			trans	71.5	57.1	175.4	0	0	0	0	0	112.2	R550 H698	R550-G700 PolarHBondContact NH1-O 3.47Å; R550-G700 PolarHBondContact NH2-O 3.08Å; R550-G700 VanDerWaalsContact NH2-O 3.13Å; H698-G700 PolarHBondContact O-N 3.15Å
701	I	82.8	Confident	87.2	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.235	C	C	.	.			trans	-89	-12.7	-163	59.5	-171.9	0	0	0	114.4	F543 N546 L547 I699 L713 L717	F543-I701 HydrophobicContact CB-CB 4.44Å; F543-I701 HydrophobicContact CB-CD1 3.79Å; F543-I701 HydrophobicContact CB-CG1 3.92Å; F543-I701 HydrophobicContact CD1-CG1 4.4Å; F543-I701 HydrophobicContact CG-CD1 4.35Å; F543-I701 HydrophobicContact CG-CG1 4.18Å; N546-I701 WeakPolarHBondContact CB-O 3.45Å; N546-I701 PolarHBondContact ND2-O 3.41Å; L547-I701 HydrophobicContact CB-CG2 4.2Å; L547-I701 HydrophobicContact CD1-CG2 4.31Å; I699-I701 HydrophobicContact CB-CG2 4.07Å; I699-I701 HydrophobicContact CG2-CG2 4.27Å; I701-L713 HydrophobicContact CD1-CD1 4.42Å; I701-L717 HydrophobicContact CD1-CD1 3.27Å; I701-L717 HydrophobicContact CD1-CD2 3.54Å; I701-L717 HydrophobicContact CD1-CG 4.02Å
702	G	81.7	Confident	87	Confident	11 Å²	11	40.4 Å²	40.4	11%	0.113	25%	0.245	C	C	.	.			trans	171.1	166.4	171.5	0	0	0	0	0	113.7	Q705	G702-Q705 WeakPolarHBondContact O-CG 3.2Å
703	T	80.3	Confident	86.8	Confident	67 Å²	67	40.2 Å²	40.2	41%	0.411	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	150.2	174.9	50.2	0	0	0	0	110.7	F543 Q705	F543-T703 VanDerWaalsContact CE1-O 3.3Å; F543-T703 WeakPolarHBondContact CE1-O 3.47Å; F543-T703 WeakPolarHBondContact CZ-O 3.39Å; T703-Q705 PolarHBondContact O-N 3.46Å
704	Y	85.6	Confident	86.7	Confident	64 Å²	64	44.4 Å²	44.4	25%	0.251	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	15	-177.3	-52.1	-82	0	0	0	115.6	L459 A460 H706 D707	L459-Y704 HydrophobicContact CB-CD1 4.27Å; L459-Y704 HydrophobicContact CB-CG 4.28Å; L459-Y704 HydrophobicContact CD1-CG 4.45Å; A460-Y704 HydrophobicContact CB-CE1 4.2Å; Y704-H706 PolarHBondContact O-N 3.26Å; Y704-H706 VanDerWaalsContact O-N 3.08Å; Y704-D707 WeakPolarHBondContact CA-OD2 3.32Å; Y704-D707 HydrophobicContact CD1-CB 4.36Å; Y704-D707 WeakPolarHBondContact CD1-OD2 3.24Å; Y704-D707 PolarHBondContact O-N 3.4Å
705	Q	86.3	Confident	86.6	Confident	19 Å²	19	47.1 Å²	47.1	9%	0.089	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-20.9	175.2	62.9	170.6	37.6	0	0	114.4	F543 K697 G702 T703 L713	F543-Q705 HydrophobicContact CE2-CB 4.21Å; F543-Q705 HydrophobicContact CZ-CB 4.22Å; K697-Q705 PolarHBondContact O-NE2 2.95Å; G702-Q705 WeakPolarHBondContact O-CG 3.2Å; T703-Q705 PolarHBondContact O-N 3.46Å; Q705-L713 HydrophobicContact CB-CD2 4.46Å; Q705-L713 VanDerWaalsContact O-CD2 3.28Å; Q705-L713 WeakPolarHBondContact O-CD2 3.46Å
706	H	86.8	Confident	86.8	Confident	132 Å²	132	45.1 Å²	45.1	61%	0.611	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-7.7	175.2	-62.1	-68.3	0	0	0	113.7	Y704	Y704-H706 PolarHBondContact O-N 3.26Å; Y704-H706 VanDerWaalsContact O-N 3.08Å
707	D	89.1	Confident	87.1	Confident	44 Å²	44	44.8 Å²	44.8	24%	0.235	27%	0.274	C	S	.	.	S	Bend	trans	-102.6	8.9	-178.3	-56.5	-80.1	0	0	0	112.3	R463 Y704	R463-D707 VanDerWaalsContact CD-OD1 3.23Å; R463-D707 WeakPolarHBondContact CD-OD1 3.42Å; R463-D707 VanDerWaalsContact CG-OD1 3.22Å; R463-D707 WeakPolarHBondContact CG-OD1 3.31Å; R463-D707 IonicContact CZ-OD2 3.76Å; R463-D707 IonicContact NE-OD1 3.65Å; R463-D707 IonicContact NE-OD2 3.03Å; R463-D707 IonicContact NH1-OD1 2.86Å; R463-D707 IonicContact NH1-OD2 2.92Å; R463-D707 PolarHBondContact NH1-OD2 3.1Å; Y704-D707 WeakPolarHBondContact CA-OD2 3.32Å; Y704-D707 HydrophobicContact CD1-CB 4.36Å; Y704-D707 WeakPolarHBondContact CD1-OD2 3.24Å; Y704-D707 PolarHBondContact O-N 3.4Å
708	V	91.3	Very high	87.6	Confident	10 Å²	10	43.6 Å²	43.6	6%	0.061	27%	0.272	C	S	.	.	S	Bend	trans	-114	159.8	172.8	-56.7	0	0	0	0	111	L459 E536 I540 F543 A710 L713	L459-V708 HydrophobicContact CD1-CG1 4.01Å; L459-V708 HydrophobicContact CD2-CG1 4.37Å; E536-V708 HydrophobicContact CB-CB 4.47Å; E536-V708 HydrophobicContact CB-CG1 4.38Å; E536-V708 HydrophobicContact CG-CB 4.13Å; E536-V708 HydrophobicContact CG-CG1 4.1Å; E536-V708 WeakPolarHBondContact OE1-CA 3.35Å; I540-V708 HydrophobicContact CG1-CG2 4.22Å; F543-V708 HydrophobicContact CE2-CG1 4.31Å; F543-V708 HydrophobicContact CE2-CG2 4.11Å; V708-A710 PolarHBondContact O-N 3.03Å; V708-L713 HydrophobicContact CG2-CB 4.14Å; V708-L713 HydrophobicContact CG2-CD1 4.46Å; V708-L713 HydrophobicContact CG2-CD2 4.05Å; V708-L713 HydrophobicContact CG2-CG 4.46Å
709	S	90.4	Very high	87.8	Confident	54 Å²	54	41.6 Å²	41.6	38%	0.378	27%	0.267	S	S	.	.			trans	-49.7	107.9	174.3	176.5	0	0	0	0	112.6	E536 G711 A712 L713	E536-S709 PolarHBondContact OE1-N 3.45Å; S709-G711 PolarHBondContact O-N 2.96Å; S709-A712 PolarHBondContact O-N 3.29Å; S709-L713 WeakPolarHBondContact O-CB 3.33Å; S709-L713 PolarHBondContact O-N 2.89Å
710	A	90.3	Very high	88.3	Confident	78 Å²	78	41.4 Å²	41.4	65%	0.645	27%	0.266	S	S	*	.	H	α-helix	trans	-60.1	-30.2	-177.2	0	0	0	0	0	113.5	V708 K714	V708-A710 PolarHBondContact O-N 3.03Å; A710-K714 VanDerWaalsContact O-CB 3.31Å; A710-K714 WeakPolarHBondContact O-CB 3.37Å; A710-K714 PolarHBondContact O-N 2.86Å
711	G	90.1	Very high	89.2	Confident	52 Å²	52	40.1 Å²	40.1	54%	0.536	25%	0.252	S	S	.	.	H	α-helix	trans	-70.9	-47.9	176	0	0	0	0	0	112.4	S709 K714 A715	S709-G711 PolarHBondContact O-N 2.96Å; G711-K714 PolarHBondContact O-N 3.39Å; G711-A715 PolarHBondContact O-N 3.28Å
712	A	88.6	Confident	89.8	Confident	33 Å²	33	42.5 Å²	42.5	27%	0.273	26%	0.263	S	S	.	.	H	α-helix	trans	-65.7	-41.8	177.4	0	0	0	0	0	111.4	I540 S709 A715 A716	I540-A712 HydrophobicContact CD1-CB 3.96Å; S709-A712 PolarHBondContact O-N 3.29Å; A712-A715 PolarHBondContact O-N 3.48Å; A712-A716 WeakPolarHBondContact O-CB 3.39Å; A712-A716 PolarHBondContact O-N 3.32Å
713	L	90.6	Very high	90.5	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.042	26%	0.261	C	S	.	.	H	α-helix	trans	-57.2	-53.4	173.6	-179.4	62.7	0	0	0	110.8	I540 F543 I701 Q705 V708 S709 A715 A716 L717	I540-L713 HydrophobicContact CG1-CD1 4.22Å; F543-L713 HydrophobicContact CB-CD1 4.35Å; F543-L713 HydrophobicContact CD2-CD1 3.61Å; F543-L713 HydrophobicContact CE2-CD1 4.4Å; F543-L713 HydrophobicContact CG-CD1 4.43Å; I701-L713 HydrophobicContact CD1-CD1 4.42Å; Q705-L713 HydrophobicContact CB-CD2 4.46Å; Q705-L713 VanDerWaalsContact O-CD2 3.28Å; Q705-L713 WeakPolarHBondContact O-CD2 3.46Å; V708-L713 HydrophobicContact CG2-CB 4.14Å; V708-L713 HydrophobicContact CG2-CD1 4.46Å; V708-L713 HydrophobicContact CG2-CD2 4.05Å; V708-L713 HydrophobicContact CG2-CG 4.46Å; S709-L713 WeakPolarHBondContact O-CB 3.33Å; S709-L713 PolarHBondContact O-N 2.89Å; L713-A715 PolarHBondContact O-N 2.87Å; L713-A716 PolarHBondContact O-N 3.3Å; L713-L717 HydrophobicContact CD1-CD1 3.74Å; L713-L717 HydrophobicContact CD1-CD2 4.29Å; L713-L717 HydrophobicContact CD1-CG 3.95Å; L713-L717 HydrophobicContact CG-CD1 3.8Å; L713-L717 HydrophobicContact CG-CG 4.33Å; L713-L717 VanDerWaalsContact O-CG 3.26Å; L713-L717 WeakPolarHBondContact O-CG 3.49Å; L713-L717 PolarHBondContact O-N 3.31Å
714	K	91.1	Very high	91.2	Very high	113 Å²	113	39.4 Å²	39.4	49%	0.491	24%	0.241	S	C	.	.	H	α-helix	trans	-57.1	-50	-179.3	-177.5	179.4	175	-176.6	0	111.8	A710 G711 A716 L717 D718	A710-K714 VanDerWaalsContact O-CB 3.31Å; A710-K714 WeakPolarHBondContact O-CB 3.37Å; A710-K714 PolarHBondContact O-N 2.86Å; G711-K714 PolarHBondContact O-N 3.39Å; K714-A716 VanDerWaalsContact C-N 3.32Å; K714-A716 PolarHBondContact O-N 3.42Å; K714-L717 PolarHBondContact O-N 2.93Å; K714-D718 WeakPolarHBondContact CE-OD2 3.37Å; K714-D718 WeakPolarHBondContact CG-OD2 3.44Å; K714-D718 WeakPolarHBondContact O-CB 3.44Å; K714-D718 PolarHBondContact O-N 2.82Å
715	A	90.1	Very high	91.8	Very high	67 Å²	67	36.3 Å²	36.3	55%	0.554	23%	0.229	S	C	*	.	H	α-helix	trans	-58.6	-42.8	-179.5	0	0	0	0	0	112.3	G711 A712 L713 G719	G711-A715 PolarHBondContact O-N 3.28Å; A712-A715 PolarHBondContact O-N 3.48Å; L713-A715 PolarHBondContact O-N 2.87Å; A715-G719 PolarHBondContact O-N 3.48Å
716	A	91.4	Very high	92.2	Very high	14 Å²	14	35.4 Å²	35.4	12%	0.116	23%	0.225	C	C	.	.	H	α-helix	trans	-64.9	-43.6	177.8	0	0	0	0	0	112.5	I540 V544 A712 L713 K714 V720	I540-A716 HydrophobicContact CG2-CB 3.45Å; I540-A716 VanDerWaalsContact CG2-CB 3.45Å; V544-A716 HydrophobicContact CG2-CB 3.82Å; A712-A716 WeakPolarHBondContact O-CB 3.39Å; A712-A716 PolarHBondContact O-N 3.32Å; L713-A716 PolarHBondContact O-N 3.3Å; K714-A716 VanDerWaalsContact C-N 3.32Å; K714-A716 PolarHBondContact O-N 3.42Å; A716-V720 WeakPolarHBondContact O-CG2 3.34Å; A716-V720 PolarHBondContact O-N 2.97Å; A716-V720 VanDerWaalsContact O-N 3.11Å
717	L	92.5	Very high	92.6	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-72.1	-42.2	-179.6	-58.4	174.6	0	0	0	112.6	F543 V544 L547 P696 I701 L713 K714 G719 V720 V721	F543-L717 HydrophobicContact CB-CD2 4.28Å; V544-L717 HydrophobicContact CG2-CD2 4.49Å; L547-L717 HydrophobicContact CB-CD2 4.42Å; L547-L717 HydrophobicContact CD2-CB 3.89Å; L547-L717 HydrophobicContact CD2-CD2 3.78Å; L547-L717 HydrophobicContact CD2-CG 4.34Å; P696-L717 HydrophobicContact CB-CB 3.58Å; P696-L717 HydrophobicContact CB-CD1 3.75Å; P696-L717 HydrophobicContact CB-CG 4.25Å; P696-L717 HydrophobicContact CG-CB 4.17Å; I701-L717 HydrophobicContact CD1-CD1 3.27Å; I701-L717 HydrophobicContact CD1-CD2 3.54Å; I701-L717 HydrophobicContact CD1-CG 4.02Å; L713-L717 HydrophobicContact CD1-CD1 3.74Å; L713-L717 HydrophobicContact CD1-CD2 4.29Å; L713-L717 HydrophobicContact CD1-CG 3.95Å; L713-L717 HydrophobicContact CG-CD1 3.8Å; L713-L717 HydrophobicContact CG-CG 4.33Å; L713-L717 VanDerWaalsContact O-CG 3.26Å; L713-L717 WeakPolarHBondContact O-CG 3.49Å; L713-L717 PolarHBondContact O-N 3.31Å; K714-L717 PolarHBondContact O-N 2.93Å; L717-G719 VanDerWaalsContact C-N 3.27Å; L717-G719 PolarHBondContact O-N 3.4Å; L717-V720 PolarHBondContact O-N 2.94Å; L717-V720 VanDerWaalsContact O-N 3.13Å; L717-V721 WeakPolarHBondContact O-CG2 3.25Å; L717-V721 PolarHBondContact O-N 3.45Å
718	D	92.3	Very high	92.9	Very high	56 Å²	56	29.6 Å²	29.6	30%	0.299	20%	0.196	S	C	.	.	H	α-helix	trans	-58.9	-41.6	174.6	-74.5	-13.7	0	0	0	110.2	K714 V720 V721 E722	K714-D718 WeakPolarHBondContact CE-OD2 3.37Å; K714-D718 WeakPolarHBondContact CG-OD2 3.44Å; K714-D718 WeakPolarHBondContact O-CB 3.44Å; K714-D718 PolarHBondContact O-N 2.82Å; D718-V720 PolarHBondContact O-N 3.21Å; D718-V721 PolarHBondContact O-N 3.01Å; D718-E722 PolarHBondContact O-N 2.92Å
719	G	92.7	Very high	93	Very high	16 Å²	16	29.5 Å²	29.5	17%	0.165	20%	0.198	C	C	.	.	H	α-helix	trans	-66.6	-29.4	175.5	0	0	0	0	0	114.5	R267 A715 L717 E723	R267-G719 PolarHBondContact NH2-O 3.49Å; A715-G719 PolarHBondContact O-N 3.48Å; L717-G719 VanDerWaalsContact C-N 3.27Å; L717-G719 PolarHBondContact O-N 3.4Å; G719-E723 PolarHBondContact O-N 2.97Å; G719-E723 VanDerWaalsContact O-N 3.13Å
720	V	93.9	Very high	93.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-75	-38.2	172.5	170	0	0	0	0	111.5	V544 L547 R548 A716 L717 D718 E722 E723 C724	V544-V720 HydrophobicContact CB-CG2 3.92Å; V544-V720 HydrophobicContact CG1-CG2 3.48Å; V544-V720 VanDerWaalsContact CG1-CG2 3.48Å; V544-V720 HydrophobicContact CG2-CG2 3.75Å; L547-V720 HydrophobicContact CD2-CB 4.47Å; L547-V720 HydrophobicContact CD2-CG1 4.31Å; L547-V720 HydrophobicContact CG-CG1 4.33Å; R548-V720 HydrophobicContact CB-CG1 3.85Å; A716-V720 WeakPolarHBondContact O-CG2 3.34Å; A716-V720 PolarHBondContact O-N 2.97Å; A716-V720 VanDerWaalsContact O-N 3.11Å; L717-V720 PolarHBondContact O-N 2.94Å; L717-V720 VanDerWaalsContact O-N 3.13Å; D718-V720 PolarHBondContact O-N 3.21Å; V720-E722 VanDerWaalsContact C-N 3.33Å; V720-E723 PolarHBondContact O-N 2.9Å; V720-C724 WeakPolarHBondContact O-CB 3.45Å; V720-C724 PolarHBondContact O-N 3.14Å; V720-C724 PolarHBondContact O-SG 2.94Å
721	V	95.4	Very high	93.4	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.018	16%	0.155	C	C	.	.	H	α-helix	trans	-60.2	-46.3	171.9	172	0	0	0	0	109.8	L547 L551 V692 P696 L717 D718 E723 C724 V725 H742	L547-V721 HydrophobicContact CD2-CG2 4.17Å; L551-V721 HydrophobicContact CD1-CG2 3.9Å; V692-V721 HydrophobicContact CB-CG1 4.43Å; V692-V721 HydrophobicContact CG1-CG1 3.68Å; P696-V721 HydrophobicContact CG-CG2 3.89Å; L717-V721 WeakPolarHBondContact O-CG2 3.25Å; L717-V721 PolarHBondContact O-N 3.45Å; D718-V721 PolarHBondContact O-N 3.01Å; V721-E723 PolarHBondContact O-N 2.85Å; V721-C724 PolarHBondContact O-N 3.01Å; V721-V725 HydrophobicContact CG1-CG2 4.24Å; V721-V725 WeakPolarHBondContact O-CB 3.19Å; V721-V725 VanDerWaalsContact O-CG2 3.31Å; V721-V725 WeakPolarHBondContact O-CG2 3.5Å; V721-V725 PolarHBondContact O-N 3.36Å; V721-H742 HydrophobicContact CG1-CB 3.89Å
722	E	95.9	Very high	93.6	Very high	49 Å²	49	21.7 Å²	21.7	23%	0.229	13%	0.129	C	C	.	.	H	α-helix	trans	-57.8	-46.7	176.9	-169	-168.3	-133.9	0	0	112	P248 D718 V720 S726 H742 A744	P248-E722 HydrophobicContact CG-CG 4.25Å; D718-E722 PolarHBondContact O-N 2.92Å; V720-E722 VanDerWaalsContact C-N 3.33Å; E722-S726 WeakPolarHBondContact O-CB 3.17Å; E722-S726 PolarHBondContact O-N 2.98Å; E722-S726 PolarHBondContact O-OG 2.85Å; E722-H742 VanDerWaalsContact CA-O 3.32Å; E722-H742 WeakPolarHBondContact CA-O 3.44Å; E722-A744 HydrophobicContact CG-CB 4.23Å; E722-A744 WeakPolarHBondContact OE1-CA 3.33Å
723	E	95.5	Very high	93.8	Very high	13 Å²	13	21 Å²	21	6%	0.061	12%	0.121	C	C	.	.	H	α-helix	trans	-59.6	-50.7	174.9	176.6	-161	133.7	0	0	112.5	P248 A263 R267 R548 G719 V720 V721 V725 S726 F727	P248-E723 HydrophobicContact CG-CB 4.37Å; A263-E723 HydrophobicContact CB-CG 4.38Å; A263-E723 WeakPolarHBondContact CB-OE2 3.17Å; R267-E723 IonicContact CZ-OE2 2.81Å; R267-E723 IonicContact NH1-OE2 3.82Å; R267-E723 PolarHBondContact NH1-OE2 3.3Å; R267-E723 VanDerWaalsContact NH2-CB 3.3Å; R267-E723 IonicContact NH2-OE2 3.63Å; R267-E723 PolarHBondContact NH2-OE2 2.77Å; R548-E723 IonicContact CZ-OE1 2.81Å; R548-E723 IonicContact CZ-OE2 3.33Å; R548-E723 IonicContact NE-OE1 2.85Å; R548-E723 PolarHBondContact NE-OE1 2.78Å; R548-E723 IonicContact NE-OE2 3.66Å; R548-E723 IonicContact NH2-OE1 2.78Å; R548-E723 PolarHBondContact NH2-OE1 3.01Å; R548-E723 IonicContact NH2-OE2 2.73Å; R548-E723 PolarHBondContact NH2-OE2 2.87Å; G719-E723 PolarHBondContact O-N 2.97Å; G719-E723 VanDerWaalsContact O-N 3.13Å; V720-E723 PolarHBondContact O-N 2.9Å; V721-E723 PolarHBondContact O-N 2.85Å; E723-V725 PolarHBondContact O-N 3.13Å; E723-S726 PolarHBondContact O-N 3.15Å; E723-F727 HydrophobicContact CG-CD2 3.62Å; E723-F727 HydrophobicContact CG-CE2 3.55Å; E723-F727 HydrophobicContact CG-CG 4.31Å; E723-F727 HydrophobicContact CG-CZ 4.19Å; E723-F727 VanDerWaalsContact O-CB 3.26Å; E723-F727 WeakPolarHBondContact O-CB 3.2Å; E723-F727 WeakPolarHBondContact O-CG 3.45Å; E723-F727 PolarHBondContact O-N 3.28Å
724	C	95.9	Very high	93.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.8	-45.8	-176.4	-66.1	0	0	0	0	111.3	L551 L552 L688 V720 V721 V728	L551-C724 HydrophobicContact CB-CB 4.11Å; L551-C724 HydrophobicContact CD1-CB 4.01Å; L552-C724 HydrophobicContact CD2-CB 4.03Å; L552-C724 HydrophobicContact CG-CB 4.44Å; L688-C724 HydrophobicContact CD1-CB 4.06Å; V720-C724 WeakPolarHBondContact O-CB 3.45Å; V720-C724 PolarHBondContact O-N 3.14Å; V720-C724 PolarHBondContact O-SG 2.94Å; V721-C724 PolarHBondContact O-N 3.01Å; C724-V728 WeakPolarHBondContact O-CB 3.11Å; C724-V728 VanDerWaalsContact O-CG2 3.28Å; C724-V728 WeakPolarHBondContact O-CG2 3.47Å; C724-V728 PolarHBondContact O-N 3.07Å
725	V	96.8	Very high	93.7	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64	-45.6	178.3	173.4	0	0	0	0	111.2	L688 V692 V721 E723 G729 V730 L739 H742 V743	L688-V725 HydrophobicContact CD1-CG2 3.83Å; L688-V725 HydrophobicContact CD2-CG2 4.43Å; L688-V725 HydrophobicContact CG-CG2 4.24Å; V692-V725 HydrophobicContact CG1-CG2 4.01Å; V721-V725 HydrophobicContact CG1-CG2 4.24Å; V721-V725 WeakPolarHBondContact O-CB 3.19Å; V721-V725 VanDerWaalsContact O-CG2 3.31Å; V721-V725 WeakPolarHBondContact O-CG2 3.5Å; V721-V725 PolarHBondContact O-N 3.36Å; E723-V725 PolarHBondContact O-N 3.13Å; V725-G729 PolarHBondContact O-N 3.43Å; V725-V730 HydrophobicContact CG1-CG1 3.84Å; V725-L739 HydrophobicContact CB-CD1 4.37Å; V725-L739 HydrophobicContact CG1-CD1 3.83Å; V725-L739 HydrophobicContact CG1-CG 4.37Å; V725-L739 HydrophobicContact CG2-CD1 3.63Å; V725-H742 HydrophobicContact CB-CB 4.14Å; V725-H742 HydrophobicContact CG1-CB 4.2Å; V725-H742 HydrophobicContact CG2-CB 3.92Å; V725-V743 HydrophobicContact CG1-CG2 3.96Å
726	S	96.6	Very high	93.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-67	-43.2	-180	-55.4	0	0	0	0	111.8	E722 E723 G729 A744 F787	E722-S726 WeakPolarHBondContact O-CB 3.17Å; E722-S726 PolarHBondContact O-N 2.98Å; E722-S726 PolarHBondContact O-OG 2.85Å; E723-S726 PolarHBondContact O-N 3.15Å; S726-G729 PolarHBondContact O-N 3.26Å; S726-A744 WeakPolarHBondContact OG-CB 3.48Å; S726-A744 PolarHBondContact OG-N 3.06Å; S726-F787 WeakPolarHBondContact O-CD1 3.39Å
727	F	94.7	Very high	93.8	Very high	43 Å²	43	21.3 Å²	21.3	19%	0.189	12%	0.118	C	C	.	.	H	α-helix	trans	-71.1	-37.8	-177	-75.1	-6.1	0	0	0	113.3	P248 V251 R252 E723 G729 F787 I903	P248-F727 HydrophobicContact CB-CD1 4.36Å; P248-F727 HydrophobicContact CB-CE1 3.9Å; V251-F727 HydrophobicContact CB-CZ 4.14Å; V251-F727 HydrophobicContact CG1-CZ 3.86Å; R252-F727 HydrophobicContact CB-CE1 4.37Å; R252-F727 VanDerWaalsContact NH2-CA 3.33Å; R252-F727 PolarHBondContact NH2-O 3.02Å; E723-F727 HydrophobicContact CG-CD2 3.62Å; E723-F727 HydrophobicContact CG-CE2 3.55Å; E723-F727 HydrophobicContact CG-CG 4.31Å; E723-F727 HydrophobicContact CG-CZ 4.19Å; E723-F727 VanDerWaalsContact O-CB 3.26Å; E723-F727 WeakPolarHBondContact O-CB 3.2Å; E723-F727 WeakPolarHBondContact O-CG 3.45Å; E723-F727 PolarHBondContact O-N 3.28Å; F727-G729 VanDerWaalsContact C-N 3.32Å; F727-F787 HydrophobicContact CD1-CE1 4.19Å; F727-F787 HydrophobicContact CE1-CE1 4.46Å; F727-I903 HydrophobicContact CB-CD1 3.89Å
728	V	94.9	Very high	93.7	Very high	10 Å²	10	21.9 Å²	21.9	6%	0.061	12%	0.122	C	C	.	.	H	α-helix	trans	-65.4	-38.5	168.8	173.5	0	0	0	0	110.8	L552 L688 C724 R789 I903 R904	L552-V728 HydrophobicContact CD2-CG2 3.65Å; L688-V728 HydrophobicContact CD2-CB 3.91Å; L688-V728 HydrophobicContact CD2-CG1 3.96Å; L688-V728 HydrophobicContact CD2-CG2 3.98Å; C724-V728 WeakPolarHBondContact O-CB 3.11Å; C724-V728 VanDerWaalsContact O-CG2 3.28Å; C724-V728 WeakPolarHBondContact O-CG2 3.47Å; C724-V728 PolarHBondContact O-N 3.07Å; V728-R789 PolarHBondContact O-NH2 3.23Å; V728-I903 HydrophobicContact CB-CG1 4.47Å; V728-I903 HydrophobicContact CG2-CD1 3.88Å; V728-I903 HydrophobicContact CG2-CG1 3.75Å; V728-R904 HydrophobicContact CG2-CG 3.84Å
729	G	94.3	Very high	93.8	Very high	9 Å²	9	20.2 Å²	20.2	9%	0.093	11%	0.113	C	C	.	.			trans	75.4	142.5	179.9	0	0	0	0	0	112.6	V725 S726 F727 F787 R789	V725-G729 PolarHBondContact O-N 3.43Å; S726-G729 PolarHBondContact O-N 3.26Å; F727-G729 VanDerWaalsContact C-N 3.32Å; G729-F787 CarbonylContact C-O 3.55Å; G729-F787 WeakPolarHBondContact CA-O 3.33Å; G729-R789 PolarHBondContact O-NH2 3.32Å
730	V	94.4	Very high	93.9	Very high	7 Å²	7	19.4 Å²	19.4	4%	0.042	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	139.4	-173.3	-58.4	0	0	0	0	111.6	V725 I732 C735 L739 V743 F787 I788 R789	V725-V730 HydrophobicContact CG1-CG1 3.84Å; V730-I732 PolarHBondContact O-N 3.36Å; V730-C735 HydrophobicContact CB-CB 4.16Å; V730-L739 HydrophobicContact CG1-CD2 4.07Å; V730-L739 HydrophobicContact CG1-CG 3.96Å; V730-V743 HydrophobicContact CB-CG2 4.41Å; V730-V743 HydrophobicContact CG1-CG2 3.93Å; V730-V743 HydrophobicContact CG2-CG2 3.54Å; V730-F787 PolarHBondContact N-O 3.2Å; V730-I788 HydrophobicContact CG2-CG1 4.41Å; V730-R789 PolarHBondContact O-N 2.67Å
731	D	93.3	Very high	94	Very high	13 Å²	13	22.3 Å²	22.3	7%	0.07	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	114.4	165.2	-179.8	-32.9	0	0	0	108.9	N733 I734 C735 R789 N791 T794	D731-N733 PolarHBondContact O-N 3.05Å; D731-N733 WeakPolarHBondContact OD1-CB 3.37Å; D731-N733 PolarHBondContact OD1-N 3.45Å; D731-I734 HydrophobicContact CB-CD1 4.13Å; D731-I734 HydrophobicContact CB-CG1 3.69Å; D731-I734 PolarHBondContact O-N 3.16Å; D731-C735 WeakPolarHBondContact O-CB 3.42Å; D731-C735 PolarHBondContact O-N 3.5Å; D731-R789 WeakPolarHBondContact CA-O 3.34Å; D731-N791 WeakPolarHBondContact OD2-CB 3.49Å; D731-N791 PolarHBondContact OD2-ND2 2.84Å; D731-T794 WeakPolarHBondContact OD2-CG2 3.46Å; D731-T794 PolarHBondContact OD2-OG1 3.23Å
732	I	94.1	Very high	94	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-23.3	-172.1	-152.5	71.7	0	0	0	113.5	V730 M740 I754 R758 F764 L770 I788 R789 I790	V730-I732 PolarHBondContact O-N 3.36Å; I732-M740 HydrophobicContact CD1-CE 3.76Å; I732-M740 HydrophobicContact CD1-CG 4.12Å; I732-M740 HydrophobicContact CD1-SD 3.81Å; I732-M740 HydrophobicContact CG1-CE 4.28Å; I732-I754 HydrophobicContact CD1-CG2 3.98Å; I732-I754 HydrophobicContact CG1-CG2 3.79Å; I732-R758 PolarHBondContact O-NH1 2.85Å; I732-F764 HydrophobicContact CG1-CD2 4.29Å; I732-F764 HydrophobicContact CG1-CE2 4.34Å; I732-F764 HydrophobicContact CG2-CB 3.84Å; I732-F764 HydrophobicContact CG2-CD2 3.7Å; I732-F764 HydrophobicContact CG2-CG 3.98Å; I732-L770 HydrophobicContact CG1-CD2 4.38Å; I732-I788 HydrophobicContact CB-CG2 3.74Å; I732-I788 HydrophobicContact CD1-CD1 4.04Å; I732-I788 HydrophobicContact CD1-CG1 4.13Å; I732-I788 HydrophobicContact CD1-CG2 4.09Å; I732-I788 HydrophobicContact CG1-CG2 4.19Å; I732-I788 HydrophobicContact CG2-CG2 4.21Å; I732-R789 PolarHBondContact N-O 2.93Å; I732-R789 VanDerWaalsContact N-O 3.08Å; I732-I790 HydrophobicContact CG2-CD1 4.47Å; I732-I790 HydrophobicContact CG2-CG1 3.91Å
733	N	92.8	Very high	94.1	Very high	19 Å²	19	21.8 Å²	21.8	10%	0.102	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-25.8	-176.8	-70.6	-31.2	0	0	0	112.5	D731 R758 P763 F764	D731-N733 PolarHBondContact O-N 3.05Å; D731-N733 WeakPolarHBondContact OD1-CB 3.37Å; D731-N733 PolarHBondContact OD1-N 3.45Å; N733-R758 PolarHBondContact O-NH1 2.91Å; N733-P763 HydrophobicContact CB-CB 4.46Å; N733-P763 WeakPolarHBondContact OD1-CA 3.43Å; N733-F764 PolarHBondContact ND2-O 3.39Å; N733-F764 PolarHBondContact OD1-N 2.94Å
734	I	88.9	Confident	94.1	Very high	123 Å²	123	21.1 Å²	21.1	63%	0.631	11%	0.11	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.8	-13.1	179.3	60.1	166.8	0	0	0	114.4	D731 T794	D731-I734 HydrophobicContact CB-CD1 4.13Å; D731-I734 HydrophobicContact CB-CG1 3.69Å; D731-I734 PolarHBondContact O-N 3.16Å; I734-T794 HydrophobicContact CD1-CG2 4.05Å; I734-T794 HydrophobicContact CG1-CG2 4.31Å; I734-T794 HydrophobicContact CG2-CG2 3.72Å
735	C	90.9	Very high	94.1	Very high	9 Å²	9	21.5 Å²	21.5	6%	0.061	11%	0.114	C	C	.	.			trans	-64.1	143.4	179.9	-174.9	0	0	0	0	112.5	V730 D731 M740 R758	V730-C735 HydrophobicContact CB-CB 4.16Å; D731-C735 WeakPolarHBondContact O-CB 3.42Å; D731-C735 PolarHBondContact O-N 3.5Å; C735-M740 HydrophobicContact CB-CE 4.32Å; C735-M740 PolarHBondContact SG-N 3.39Å; C735-M740 VanDerWaalsContact SG-N 3.45Å; C735-R758 PolarHBondContact O-NH1 3.48Å; C735-R758 PolarHBondContact O-NH2 3.15Å
736	S	90.8	Very high	94	Very high	44 Å²	44	22.1 Å²	22.1	31%	0.308	12%	0.117	S	C	.	.			trans	-79.4	155.6	175.5	67.6	0	0	0	0	112.2	T738 L739 M740	S736-T738 PolarHBondContact O-N 2.75Å; S736-T738 VanDerWaalsContact O-N 3.13Å; S736-L739 PolarHBondContact O-N 3.34Å; S736-L739 PolarHBondContact OG-N 2.74Å; S736-L739 VanDerWaalsContact OG-N 3.1Å; S736-M740 WeakPolarHBondContact O-CB 3.27Å; S736-M740 PolarHBondContact O-N 3.44Å
737	E	92.3	Very high	93.9	Very high	32 Å²	32	25.3 Å²	25.3	15%	0.15	13%	0.134	C	C	.	.	H	α-helix	trans	-52.1	-34.3	171.3	-176.5	-170.5	-178.4	0	0	111.3	K665 R741 R752	K665-E737 IonicContact NZ-OE2 2.87Å; K665-E737 PolarHBondContact NZ-OE2 3.36Å; E737-R741 PolarHBondContact O-N 3.36Å; E737-R752 IonicContact OE1-CZ 3.17Å; E737-R752 IonicContact OE1-NE 2.65Å; E737-R752 PolarHBondContact OE1-NE 2.74Å; E737-R752 IonicContact OE1-NH2 3.88Å; E737-R752 PolarHBondContact OE1-NH2 3.47Å
738	T	92.3	Very high	93.8	Very high	13 Å²	13	25.3 Å²	25.3	8%	0.08	14%	0.142	C	C	.	.	H	α-helix	trans	-72.7	-48.8	180	-50.5	0	0	0	0	112.7	K693 S736 M740 R741 H742	K693-T738 HydrophobicContact CB-CG2 4.44Å; K693-T738 HydrophobicContact CG-CG2 4.05Å; S736-T738 PolarHBondContact O-N 2.75Å; S736-T738 VanDerWaalsContact O-N 3.13Å; T738-M740 VanDerWaalsContact C-N 3.34Å; T738-M740 PolarHBondContact O-N 3.11Å; T738-R741 WeakPolarHBondContact O-CG 3.41Å; T738-R741 PolarHBondContact OG1-NH2 3.09Å; T738-R741 VanDerWaalsContact OG1-NH2 3.14Å; T738-H742 PolarHBondContact O-CD2 3.32Å
739	L	94.1	Very high	93.8	Very high	21 Å²	21	26.6 Å²	26.6	11%	0.11	16%	0.158	C	C	.	.	H	α-helix	trans	-67.8	-37.9	177.3	179.1	63.7	0	0	0	111.3	L688 A689 V692 V725 V730 S736 R741 H742	L688-L739 HydrophobicContact CG-CD1 4.21Å; A689-L739 HydrophobicContact CB-CD2 4.3Å; V692-L739 HydrophobicContact CG2-CB 4.37Å; V692-L739 HydrophobicContact CG2-CD1 3.95Å; V725-L739 HydrophobicContact CB-CD1 4.37Å; V725-L739 HydrophobicContact CG1-CD1 3.83Å; V725-L739 HydrophobicContact CG1-CG 4.37Å; V725-L739 HydrophobicContact CG2-CD1 3.63Å; V730-L739 HydrophobicContact CG1-CD2 4.07Å; V730-L739 HydrophobicContact CG1-CG 3.96Å; S736-L739 PolarHBondContact O-N 3.34Å; S736-L739 PolarHBondContact OG-N 2.74Å; S736-L739 VanDerWaalsContact OG-N 3.1Å; L739-R741 VanDerWaalsContact C-N 3.35Å; L739-R741 PolarHBondContact O-N 3.36Å; L739-H742 PolarHBondContact O-N 3.42Å
740	M	94.8	Very high	93.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-65.4	-31.5	-177.7	-167.7	-174.3	-55.8	0	0	113.8	I732 C735 S736 T738 H742 V743 L746 A751 I754	I732-M740 HydrophobicContact CD1-CE 3.76Å; I732-M740 HydrophobicContact CD1-CG 4.12Å; I732-M740 HydrophobicContact CD1-SD 3.81Å; I732-M740 HydrophobicContact CG1-CE 4.28Å; C735-M740 HydrophobicContact CB-CE 4.32Å; C735-M740 PolarHBondContact SG-N 3.39Å; C735-M740 VanDerWaalsContact SG-N 3.45Å; S736-M740 WeakPolarHBondContact O-CB 3.27Å; S736-M740 PolarHBondContact O-N 3.44Å; T738-M740 VanDerWaalsContact C-N 3.34Å; T738-M740 PolarHBondContact O-N 3.11Å; M740-H742 PolarHBondContact O-N 3.16Å; M740-H742 VanDerWaalsContact O-N 3.11Å; M740-V743 PolarHBondContact O-N 3.25Å; M740-L746 HydrophobicContact CG-CD1 3.69Å; M740-L746 WeakPolarHBondContact O-CD1 3.43Å; M740-A751 HydrophobicContact CB-CB 4.05Å; M740-A751 HydrophobicContact CG-CB 4.05Å; M740-A751 HydrophobicContact SD-CB 4.14Å; M740-I754 HydrophobicContact CE-CG2 3.96Å; M740-I754 HydrophobicContact SD-CB 3.63Å; M740-I754 HydrophobicContact SD-CD1 3.72Å; M740-I754 HydrophobicContact SD-CG1 4.29Å; M740-I754 HydrophobicContact SD-CG2 3.55Å; M740-I754 VanDerWaalsContact SD-CG2 3.55Å
741	R	95.2	Very high	93.9	Very high	60 Å²	60	29.1 Å²	29.1	23%	0.226	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.8	179.7	86.3	-174.5	63.7	162.6	3	113.9	E662 E737 T738 L739 A748 A751	E662-R741 IonicContact OE1-NH1 2.89Å; E737-R741 PolarHBondContact O-N 3.36Å; T738-R741 WeakPolarHBondContact O-CG 3.41Å; T738-R741 PolarHBondContact OG1-NH2 3.09Å; T738-R741 VanDerWaalsContact OG1-NH2 3.14Å; L739-R741 VanDerWaalsContact C-N 3.35Å; L739-R741 PolarHBondContact O-N 3.36Å; R741-A748 HydrophobicContact CB-CB 4.46Å; R741-A751 HydrophobicContact CB-CB 4Å
742	H	96.1	Very high	94	Very high	40 Å²	40	33.9 Å²	33.9	19%	0.185	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	6.7	-179.4	-62	-72.3	0	0	0	113.5	V721 E722 V725 T738 L739 M740	V721-H742 HydrophobicContact CG1-CB 3.89Å; E722-H742 VanDerWaalsContact CA-O 3.32Å; E722-H742 WeakPolarHBondContact CA-O 3.44Å; V725-H742 HydrophobicContact CB-CB 4.14Å; V725-H742 HydrophobicContact CG1-CB 4.2Å; V725-H742 HydrophobicContact CG2-CB 3.92Å; T738-H742 PolarHBondContact O-CD2 3.32Å; L739-H742 PolarHBondContact O-N 3.42Å; M740-H742 PolarHBondContact O-N 3.16Å; M740-H742 VanDerWaalsContact O-N 3.11Å
743	V	97.1	Very high	94.1	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.006	19%	0.19	C	C	.	.	S	Bend	trans	-74.1	137.7	168.5	-178.8	0	0	0	0	108.6	V725 V730 M740 G745 L746 C784 F787 I788	V725-V743 HydrophobicContact CG1-CG2 3.96Å; V730-V743 HydrophobicContact CB-CG2 4.41Å; V730-V743 HydrophobicContact CG1-CG2 3.93Å; V730-V743 HydrophobicContact CG2-CG2 3.54Å; M740-V743 PolarHBondContact O-N 3.25Å; V743-G745 PolarHBondContact O-N 3.29Å; V743-L746 HydrophobicContact CB-CB 4.32Å; V743-L746 HydrophobicContact CB-CD1 3.92Å; V743-L746 HydrophobicContact CB-CG 4.05Å; V743-L746 HydrophobicContact CG1-CD1 4.43Å; V743-L746 HydrophobicContact CG1-CG 4.43Å; V743-L746 HydrophobicContact CG2-CD1 4.35Å; V743-L746 WeakPolarHBondContact O-CB 3.27Å; V743-L746 PolarHBondContact O-N 3.28Å; V743-C784 HydrophobicContact CG1-CB 4.23Å; V743-F787 HydrophobicContact CG1-CB 3.72Å; V743-I788 HydrophobicContact CG1-CG1 4.46Å
744	A	96.6	Very high	94.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	132.1	177.8	0	0	0	0	0	110.8	T246 P248 E722 S726 L746 Q783 C784 F787	T246-A744 HydrophobicContact CG2-CB 4.27Å; T246-A744 WeakPolarHBondContact OG1-CB 3.2Å; P248-A744 HydrophobicContact CB-CB 4.04Å; P248-A744 HydrophobicContact CG-CB 4.05Å; E722-A744 HydrophobicContact CG-CB 4.23Å; E722-A744 WeakPolarHBondContact OE1-CA 3.33Å; S726-A744 WeakPolarHBondContact OG-CB 3.48Å; S726-A744 PolarHBondContact OG-N 3.06Å; A744-L746 PolarHBondContact O-N 2.96Å; A744-Q783 CarbonylContact O-C 3.52Å; A744-C784 WeakPolarHBondContact O-CA 3.25Å; A744-C784 WeakPolarHBondContact O-CB 3.47Å; A744-C784 PolarHBondContact O-N 3.13Å; A744-F787 HydrophobicContact CB-CD2 3.85Å; A744-F787 HydrophobicContact CB-CE2 3.67Å
745	G	94.4	Very high	94.5	Very high	8 Å²	8	28.8 Å²	28.8	8%	0.082	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	-1.5	-176.2	0	0	0	0	0	115.5	V743 R750	V743-G745 PolarHBondContact O-N 3.29Å; G745-R750 PolarHBondContact O-NH1 3.33Å
746	L	95.8	Very high	94.6	Very high	12 Å²	12	33.2 Å²	33.2	6%	0.063	18%	0.178	C	C	.	.			trans	-101	169.5	167.9	-59	-167.5	0	0	0	111.5	M740 V743 A744 R750 I754 M776 C784 I788	M740-L746 HydrophobicContact CG-CD1 3.69Å; M740-L746 WeakPolarHBondContact O-CD1 3.43Å; V743-L746 HydrophobicContact CB-CB 4.32Å; V743-L746 HydrophobicContact CB-CD1 3.92Å; V743-L746 HydrophobicContact CB-CG 4.05Å; V743-L746 HydrophobicContact CG1-CD1 4.43Å; V743-L746 HydrophobicContact CG1-CG 4.43Å; V743-L746 HydrophobicContact CG2-CD1 4.35Å; V743-L746 WeakPolarHBondContact O-CB 3.27Å; V743-L746 PolarHBondContact O-N 3.28Å; A744-L746 PolarHBondContact O-N 2.96Å; L746-R750 HydrophobicContact CD2-CB 4.25Å; L746-I754 HydrophobicContact CD1-CD1 3.75Å; L746-I754 HydrophobicContact CD2-CD1 4.04Å; L746-M776 HydrophobicContact CD2-CE 3.88Å; L746-M776 HydrophobicContact CD2-SD 4.46Å; L746-C784 HydrophobicContact CD2-CB 3.78Å; L746-C784 HydrophobicContact CG-CB 3.87Å; L746-I788 HydrophobicContact CD1-CD1 4.42Å
747	N	94.4	Very high	94.9	Very high	67 Å²	67	32.8 Å²	32.8	36%	0.358	17%	0.17	S	C	.	.			trans	-154.1	176	172.3	65.5	38.2	0	0	0	108.9	G749 R750 A751	N747-G749 PolarHBondContact O-N 2.92Å; N747-G749 VanDerWaalsContact O-N 3.15Å; N747-G749 WeakPolarHBondContact OD1-CA 3.48Å; N747-G749 PolarHBondContact OD1-N 2.86Å; N747-R750 PolarHBondContact O-N 2.81Å; N747-R750 PolarHBondContact OD1-N 3.21Å; N747-A751 VanDerWaalsContact O-CB 3.31Å; N747-A751 WeakPolarHBondContact O-CB 3.48Å; N747-A751 PolarHBondContact O-N 2.73Å
748	A	92.8	Very high	94.9	Very high	43 Å²	43	33.7 Å²	33.7	36%	0.355	17%	0.171	S	C	.	.	H	α-helix	trans	-59.2	-28	-177.4	0	0	0	0	0	114.4	R741 R752	R741-A748 HydrophobicContact CB-CB 4.46Å; A748-R752 PolarHBondContact O-N 3.31Å
749	G	95.2	Very high	94.9	Very high	38 Å²	38	40.2 Å²	40.2	39%	0.392	20%	0.201	S	C	.	.	H	α-helix	trans	-74.1	-51.1	174.6	0	0	0	0	0	112	N747 A751 R752 S753	N747-G749 PolarHBondContact O-N 2.92Å; N747-G749 VanDerWaalsContact O-N 3.15Å; N747-G749 WeakPolarHBondContact OD1-CA 3.48Å; N747-G749 PolarHBondContact OD1-N 2.86Å; G749-A751 PolarHBondContact O-N 3.39Å; G749-R752 PolarHBondContact O-N 2.79Å; G749-S753 PolarHBondContact O-N 3.3Å; G749-S753 VanDerWaalsContact O-N 3.07Å
750	R	95.4	Very high	94.9	Very high	68 Å²	68	47.8 Å²	47.8	26%	0.257	23%	0.233	S	C	.	.	H	α-helix	trans	-61.7	-44.2	178.6	-63.7	176.6	-168.6	135.9	5.7	111.5	G745 L746 N747 R752 S753 I754 S780	G745-R750 PolarHBondContact O-NH1 3.33Å; L746-R750 HydrophobicContact CD2-CB 4.25Å; N747-R750 PolarHBondContact O-N 2.81Å; N747-R750 PolarHBondContact OD1-N 3.21Å; R750-R752 VanDerWaalsContact C-N 3.29Å; R750-R752 PolarHBondContact O-N 3.2Å; R750-S753 PolarHBondContact O-N 3.06Å; R750-I754 VanDerWaalsContact O-CG1 3.3Å; R750-I754 WeakPolarHBondContact O-CG1 3.45Å; R750-I754 PolarHBondContact O-N 2.61Å; R750-S780 PolarHBondContact NE-OG 2.85Å; R750-S780 PolarHBondContact NH2-OG 2.92Å
751	A	95.3	Very high	94.7	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.6	-39.8	177.7	0	0	0	0	0	112.4	M740 R741 N747 G749 A755	M740-A751 HydrophobicContact CB-CB 4.05Å; M740-A751 HydrophobicContact CG-CB 4.05Å; M740-A751 HydrophobicContact SD-CB 4.14Å; R741-A751 HydrophobicContact CB-CB 4Å; N747-A751 VanDerWaalsContact O-CB 3.31Å; N747-A751 WeakPolarHBondContact O-CB 3.48Å; N747-A751 PolarHBondContact O-N 2.73Å; G749-A751 PolarHBondContact O-N 3.39Å; A751-A755 PolarHBondContact O-N 3.21Å; A751-A755 VanDerWaalsContact O-N 3.07Å
752	R	95	Very high	94.5	Very high	113 Å²	113	50.4 Å²	50.4	43%	0.426	26%	0.258	S	S	.	.	H	α-helix	trans	-66.2	-46.9	174.1	-169.7	178.1	-56.1	119.5	19.2	112.1	E737 A748 G749 R750 I754 A755 E756	E737-R752 IonicContact OE1-CZ 3.17Å; E737-R752 IonicContact OE1-NE 2.65Å; E737-R752 PolarHBondContact OE1-NE 2.74Å; E737-R752 IonicContact OE1-NH2 3.88Å; E737-R752 PolarHBondContact OE1-NH2 3.47Å; A748-R752 PolarHBondContact O-N 3.31Å; G749-R752 PolarHBondContact O-N 2.79Å; R750-R752 VanDerWaalsContact C-N 3.29Å; R750-R752 PolarHBondContact O-N 3.2Å; R752-I754 VanDerWaalsContact C-N 3.27Å; R752-I754 PolarHBondContact O-N 3.26Å; R752-A755 WeakPolarHBondContact O-CB 3.43Å; R752-A755 PolarHBondContact O-N 3.37Å; R752-A755 VanDerWaalsContact O-N 3.09Å; R752-E756 HydrophobicContact CG-CG 4.27Å; R752-E756 WeakPolarHBondContact CG-OE1 3.49Å; R752-E756 WeakPolarHBondContact O-CB 3.3Å; R752-E756 WeakPolarHBondContact O-CG 3.25Å; R752-E756 PolarHBondContact O-N 3.27Å
753	S	96.2	Very high	94.3	Very high	27 Å²	27	51 Å²	51	19%	0.189	27%	0.265	C	S	.	.	H	α-helix	trans	-64.9	-29	178.6	-65.7	0	0	0	0	113.3	G749 R750 W757 K774	G749-S753 PolarHBondContact O-N 3.3Å; G749-S753 VanDerWaalsContact O-N 3.07Å; R750-S753 PolarHBondContact O-N 3.06Å; S753-W757 VanDerWaalsContact O-CB 3.26Å; S753-W757 WeakPolarHBondContact O-CB 3.45Å; S753-W757 PolarHBondContact O-N 3.13Å; S753-K774 WeakPolarHBondContact CB-O 3.41Å
754	I	95.8	Very high	94.2	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-68.1	-44.9	169.7	-64.6	163.2	0	0	0	110.7	I732 M740 L746 R750 R752 W757 R758 F764 V773 M776	I732-I754 HydrophobicContact CD1-CG2 3.98Å; I732-I754 HydrophobicContact CG1-CG2 3.79Å; M740-I754 HydrophobicContact CE-CG2 3.96Å; M740-I754 HydrophobicContact SD-CB 3.63Å; M740-I754 HydrophobicContact SD-CD1 3.72Å; M740-I754 HydrophobicContact SD-CG1 4.29Å; M740-I754 HydrophobicContact SD-CG2 3.55Å; M740-I754 VanDerWaalsContact SD-CG2 3.55Å; L746-I754 HydrophobicContact CD1-CD1 3.75Å; L746-I754 HydrophobicContact CD2-CD1 4.04Å; R750-I754 VanDerWaalsContact O-CG1 3.3Å; R750-I754 WeakPolarHBondContact O-CG1 3.45Å; R750-I754 PolarHBondContact O-N 2.61Å; R752-I754 VanDerWaalsContact C-N 3.27Å; R752-I754 PolarHBondContact O-N 3.26Å; I754-W757 PolarHBondContact O-N 2.74Å; I754-R758 WeakPolarHBondContact O-CB 3.23Å; I754-R758 PolarHBondContact O-N 2.93Å; I754-F764 HydrophobicContact CG2-CE2 3.69Å; I754-F764 HydrophobicContact CG2-CZ 3.86Å; I754-V773 HydrophobicContact CG1-CG1 3.91Å; I754-V773 HydrophobicContact CG1-CG2 4.37Å; I754-M776 HydrophobicContact CD1-CE 3.84Å; I754-M776 HydrophobicContact CG1-CE 4.19Å
755	A	93.8	Very high	94	Very high	9 Å²	9	53.4 Å²	53.4	7%	0.074	28%	0.278	C	S	.	.	H	α-helix	trans	-62.8	-46.7	177.2	0	0	0	0	0	112.1	A751 R752 W757 R758 E759	A751-A755 PolarHBondContact O-N 3.21Å; A751-A755 VanDerWaalsContact O-N 3.07Å; R752-A755 WeakPolarHBondContact O-CB 3.43Å; R752-A755 PolarHBondContact O-N 3.37Å; R752-A755 VanDerWaalsContact O-N 3.09Å; A755-W757 VanDerWaalsContact C-N 3.3Å; A755-W757 PolarHBondContact O-N 3.22Å; A755-R758 WeakPolarHBondContact O-CB 3.41Å; A755-R758 PolarHBondContact O-N 2.93Å; A755-E759 WeakPolarHBondContact O-CG 3.48Å; A755-E759 PolarHBondContact O-N 2.89Å
756	E	94.3	Very high	93.9	Very high	101 Å²	101	53.3 Å²	53.3	47%	0.472	28%	0.275	S	S	.	.	H	α-helix	trans	-57.9	-40.2	173.3	-70.8	167.9	178.3	0	0	111.8	R752 K760	R752-E756 HydrophobicContact CG-CG 4.27Å; R752-E756 WeakPolarHBondContact CG-OE1 3.49Å; R752-E756 WeakPolarHBondContact O-CB 3.3Å; R752-E756 WeakPolarHBondContact O-CG 3.25Å; R752-E756 PolarHBondContact O-N 3.27Å; E756-K760 WeakPolarHBondContact O-CB 3.29Å; E756-K760 PolarHBondContact O-N 2.95Å; E756-K760 VanDerWaalsContact O-N 3.08Å
757	W	95.4	Very high	93.9	Very high	36 Å²	36	52.8 Å²	52.8	14%	0.136	27%	0.272	C	S	.	.	H	α-helix	trans	-66.4	-43.8	176.1	-169.8	104.7	0	0	0	111.5	S753 I754 A755 K760 N761 F764 Q769 L772 V773	S753-W757 VanDerWaalsContact O-CB 3.26Å; S753-W757 WeakPolarHBondContact O-CB 3.45Å; S753-W757 PolarHBondContact O-N 3.13Å; I754-W757 PolarHBondContact O-N 2.74Å; A755-W757 VanDerWaalsContact C-N 3.3Å; A755-W757 PolarHBondContact O-N 3.22Å; W757-K760 PolarHBondContact O-N 3.44Å; W757-N761 HydrophobicContact CD2-CB 4.09Å; W757-N761 HydrophobicContact CE3-CB 4.03Å; W757-N761 HydrophobicContact CH2-CB 3.93Å; W757-N761 HydrophobicContact CZ2-CB 3.98Å; W757-N761 HydrophobicContact CZ3-CB 3.96Å; W757-N761 WeakPolarHBondContact O-CB 3.48Å; W757-N761 PolarHBondContact O-N 3.44Å; W757-N761 PolarHBondContact O-ND2 3.21Å; W757-F764 HydrophobicContact CB-CZ 4.39Å; W757-F764 AromaticContact CD2-CE1 3.84Å; W757-F764 HydrophobicContact CD2-CE1 3.84Å; W757-F764 AromaticContact CD2-CZ 3.75Å; W757-F764 HydrophobicContact CD2-CZ 3.75Å; W757-F764 AromaticContact CE3-CD1 3.94Å; W757-F764 HydrophobicContact CE3-CD1 3.94Å; W757-F764 HydrophobicContact CE3-CD2 4.22Å; W757-F764 AromaticContact CE3-CE1 3.33Å; W757-F764 HydrophobicContact CE3-CE1 3.33Å; W757-F764 AromaticContact CE3-CE2 3.67Å; W757-F764 HydrophobicContact CE3-CE2 3.67Å; W757-F764 HydrophobicContact CE3-CG 4.35Å; W757-F764 AromaticContact CE3-CZ 3.18Å; W757-F764 HydrophobicContact CE3-CZ 3.18Å; W757-F764 HydrophobicContact CG-CZ 4.28Å; W757-F764 HydrophobicContact CH2-CD1 4.04Å; W757-F764 AromaticContact CH2-CE1 3.99Å; W757-F764 HydrophobicContact CH2-CE1 3.99Å; W757-F764 HydrophobicContact CZ2-CE1 4.41Å; W757-F764 AromaticContact CZ3-CD1 3.55Å; W757-F764 HydrophobicContact CZ3-CD1 3.55Å; W757-F764 HydrophobicContact CZ3-CD2 4.17Å; W757-F764 AromaticContact CZ3-CE1 3.43Å; W757-F764 HydrophobicContact CZ3-CE1 3.43Å; W757-F764 VanDerWaalsContact CZ3-CE1 3.43Å; W757-F764 HydrophobicContact CZ3-CE2 4.08Å; W757-F764 AromaticContact CZ3-CG 3.93Å; W757-F764 HydrophobicContact CZ3-CG 3.93Å; W757-F764 AromaticContact CZ3-CZ 3.72Å; W757-F764 HydrophobicContact CZ3-CZ 3.72Å; W757-Q769 HydrophobicContact CH2-CB 4.19Å; W757-Q769 HydrophobicContact CZ2-CB 4.45Å; W757-L772 HydrophobicContact CZ2-CD1 4.42Å; W757-V773 HydrophobicContact CB-CG2 4.1Å; W757-V773 HydrophobicContact CD2-CG2 4.34Å; W757-V773 HydrophobicContact CG-CG2 3.89Å
758	R	94	Very high	93.9	Very high	50 Å²	50	52 Å²	52	19%	0.189	27%	0.266	C	S	.	.	H	α-helix	trans	-62.7	-41.3	177.9	-173.9	-179	64.8	-167.1	5.2	112.1	I732 N733 C735 I754 A755 G762 F764	I732-R758 PolarHBondContact O-NH1 2.85Å; N733-R758 PolarHBondContact O-NH1 2.91Å; C735-R758 PolarHBondContact O-NH1 3.48Å; C735-R758 PolarHBondContact O-NH2 3.15Å; I754-R758 WeakPolarHBondContact O-CB 3.23Å; I754-R758 PolarHBondContact O-N 2.93Å; A755-R758 WeakPolarHBondContact O-CB 3.41Å; A755-R758 PolarHBondContact O-N 2.93Å; R758-G762 WeakPolarHBondContact CA-O 3Å; R758-G762 CarbonylContact O-C 3.59Å; R758-G762 WeakPolarHBondContact O-CA 3.36Å; R758-G762 PolarHBondContact O-N 3.22Å; R758-G762 VanDerWaalsContact O-N 3.08Å; R758-G762 VanDerWaalsContact O-O 3.08Å; R758-F764 HydrophobicContact CB-CE2 4.04Å
759	E	91.2	Very high	94	Very high	151 Å²	151	51 Å²	51	71%	0.706	25%	0.254	S	S	*	.	H	α-helix	trans	-67.1	-36.4	176.5	-73.6	169.5	-164.9	0	0	112.1	A755	A755-E759 WeakPolarHBondContact O-CG 3.48Å; A755-E759 PolarHBondContact O-N 2.89Å
760	K	94.1	Very high	93.9	Very high	179 Å²	179	49.1 Å²	49.1	78%	0.778	24%	0.236	S	C	*	.	H	α-helix	trans	-83	-38.7	-177.9	-177.7	174.6	178.2	179.7	0	114.6	E756 W757	E756-K760 WeakPolarHBondContact O-CB 3.29Å; E756-K760 PolarHBondContact O-N 2.95Å; E756-K760 VanDerWaalsContact O-N 3.08Å; W757-K760 PolarHBondContact O-N 3.44Å
761	N	91.8	Very high	93.9	Very high	90 Å²	90	47.6 Å²	47.6	48%	0.481	23%	0.231	S	C	.	.	H	α-helix	trans	-109.6	-4	-170.3	-52.1	-87.1	0	0	0	113.2	W757	W757-N761 HydrophobicContact CD2-CB 4.09Å; W757-N761 HydrophobicContact CE3-CB 4.03Å; W757-N761 HydrophobicContact CH2-CB 3.93Å; W757-N761 HydrophobicContact CZ2-CB 3.98Å; W757-N761 HydrophobicContact CZ3-CB 3.96Å; W757-N761 WeakPolarHBondContact O-CB 3.48Å; W757-N761 PolarHBondContact O-N 3.44Å; W757-N761 PolarHBondContact O-ND2 3.21Å
762	G	90.5	Very high	93.8	Very high	26 Å²	26	51.9 Å²	51.9	27%	0.268	25%	0.253	S	S	.	.			trans	88	-171.9	-173.2	0	0	0	0	0	113.3	R758	R758-G762 WeakPolarHBondContact CA-O 3Å; R758-G762 CarbonylContact O-C 3.59Å; R758-G762 WeakPolarHBondContact O-CA 3.36Å; R758-G762 PolarHBondContact O-N 3.22Å; R758-G762 VanDerWaalsContact O-N 3.08Å; R758-G762 VanDerWaalsContact O-O 3.08Å
763	P	92.4	Very high	93.8	Very high	52 Å²	52	46.8 Å²	46.8	34%	0.338	24%	0.235	S	C	.	.	S	Bend	trans	-66.8	146.7	-178.3	29	-35.2	0	0	0	112.1	N733 I765 L795	N733-P763 HydrophobicContact CB-CB 4.46Å; N733-P763 WeakPolarHBondContact OD1-CA 3.43Å; P763-I765 PolarHBondContact O-N 3.09Å; P763-L795 HydrophobicContact CB-CD2 3.9Å; P763-L795 HydrophobicContact CG-CD2 3.9Å
764	F	93.5	Very high	93.6	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.263	C	S	.	.			trans	-67.6	127.8	171	-68.5	-89.9	0	0	0	110.2	I732 N733 I754 W757 R758 Q769 L770 V773 I790	I732-F764 HydrophobicContact CG1-CD2 4.29Å; I732-F764 HydrophobicContact CG1-CE2 4.34Å; I732-F764 HydrophobicContact CG2-CB 3.84Å; I732-F764 HydrophobicContact CG2-CD2 3.7Å; I732-F764 HydrophobicContact CG2-CG 3.98Å; N733-F764 PolarHBondContact ND2-O 3.39Å; N733-F764 PolarHBondContact OD1-N 2.94Å; I754-F764 HydrophobicContact CG2-CE2 3.69Å; I754-F764 HydrophobicContact CG2-CZ 3.86Å; W757-F764 HydrophobicContact CB-CZ 4.39Å; W757-F764 AromaticContact CD2-CE1 3.84Å; W757-F764 HydrophobicContact CD2-CE1 3.84Å; W757-F764 AromaticContact CD2-CZ 3.75Å; W757-F764 HydrophobicContact CD2-CZ 3.75Å; W757-F764 AromaticContact CE3-CD1 3.94Å; W757-F764 HydrophobicContact CE3-CD1 3.94Å; W757-F764 HydrophobicContact CE3-CD2 4.22Å; W757-F764 AromaticContact CE3-CE1 3.33Å; W757-F764 HydrophobicContact CE3-CE1 3.33Å; W757-F764 AromaticContact CE3-CE2 3.67Å; W757-F764 HydrophobicContact CE3-CE2 3.67Å; W757-F764 HydrophobicContact CE3-CG 4.35Å; W757-F764 AromaticContact CE3-CZ 3.18Å; W757-F764 HydrophobicContact CE3-CZ 3.18Å; W757-F764 HydrophobicContact CG-CZ 4.28Å; W757-F764 HydrophobicContact CH2-CD1 4.04Å; W757-F764 AromaticContact CH2-CE1 3.99Å; W757-F764 HydrophobicContact CH2-CE1 3.99Å; W757-F764 HydrophobicContact CZ2-CE1 4.41Å; W757-F764 AromaticContact CZ3-CD1 3.55Å; W757-F764 HydrophobicContact CZ3-CD1 3.55Å; W757-F764 HydrophobicContact CZ3-CD2 4.17Å; W757-F764 AromaticContact CZ3-CE1 3.43Å; W757-F764 HydrophobicContact CZ3-CE1 3.43Å; W757-F764 VanDerWaalsContact CZ3-CE1 3.43Å; W757-F764 HydrophobicContact CZ3-CE2 4.08Å; W757-F764 AromaticContact CZ3-CG 3.93Å; W757-F764 HydrophobicContact CZ3-CG 3.93Å; W757-F764 AromaticContact CZ3-CZ 3.72Å; W757-F764 HydrophobicContact CZ3-CZ 3.72Å; R758-F764 HydrophobicContact CB-CE2 4.04Å; F764-Q769 HydrophobicContact CD1-CB 3.85Å; F764-Q769 HydrophobicContact CE1-CB 4.36Å; F764-L770 HydrophobicContact CD1-CD2 4.11Å; F764-L770 HydrophobicContact CD1-CG 4.48Å; F764-L770 HydrophobicContact CE1-CD2 3.73Å; F764-L770 HydrophobicContact CE1-CG 4.37Å; F764-L770 HydrophobicContact CZ-CD2 3.97Å; F764-V773 HydrophobicContact CE1-CG2 3.92Å; F764-V773 HydrophobicContact CZ-CG2 3.83Å; F764-I790 HydrophobicContact CB-CD1 3.95Å; F764-I790 HydrophobicContact CB-CG1 4.49Å; F764-I790 VanDerWaalsContact O-CG2 3.31Å; F764-I790 WeakPolarHBondContact O-CG2 3.45Å
765	I	92.8	Very high	93.2	Very high	52 Å²	52	56.8 Å²	56.8	27%	0.267	29%	0.291	S	S	.	.	S	Bend	trans	-90.6	-34.5	-179.6	-55.3	174.1	0	0	0	110.8	P763 L795 L826	P763-I765 PolarHBondContact O-N 3.09Å; I765-L795 HydrophobicContact CG1-CD2 4.47Å; I765-L826 HydrophobicContact CG2-CB 4.25Å
766	N	93.3	Very high	93.2	Very high	5 Å²	5	56.9 Å²	56.9	3%	0.027	29%	0.29	C	S	.	.	S	Bend	trans	-149.2	165.1	175.6	60.5	51.3	0	0	0	112.2	E768 Q769 I790 P823 S825 D830	N766-E768 VanDerWaalsContact C-N 3.29Å; N766-E768 PolarHBondContact O-N 3.14Å; N766-E768 PolarHBondContact OD1-N 2.78Å; N766-Q769 PolarHBondContact O-N 2.97Å; N766-Q769 PolarHBondContact OD1-N 3.33Å; N766-I790 VanDerWaalsContact CA-CD1 3.47Å; N766-I790 WeakPolarHBondContact O-CD1 3.35Å; N766-P823 PolarHBondContact ND2-O 3.3Å; N766-S825 PolarHBondContact ND2-O 2.95Å; N766-D830 WeakPolarHBondContact CA-OD2 3.38Å; N766-D830 WeakPolarHBondContact CB-OD2 3.45Å
767	R	95.3	Very high	93.1	Very high	1 Å²	1	53.3 Å²	53.3	0%	0.004	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-64	-32.1	-178.2	-74.9	175	178.9	163.5	-9.5	112.9	Q769 L770 Y781 A785 I788 I790 D830 T832 I834 Y839	R767-Q769 PolarHBondContact O-N 2.84Å; R767-L770 WeakPolarHBondContact O-CB 3.25Å; R767-L770 VanDerWaalsContact O-CG 3.3Å; R767-L770 WeakPolarHBondContact O-CG 3.26Å; R767-L770 PolarHBondContact O-N 2.84Å; R767-Y781 VanDerWaalsContact O-CE2 3.31Å; R767-Y781 WeakPolarHBondContact O-CE2 3.49Å; R767-A785 WeakPolarHBondContact CD-O 3.38Å; R767-A785 VanDerWaalsContact CZ-O 3.3Å; R767-A785 PolarHBondContact NE-O 3.49Å; R767-I788 PolarHBondContact NE-O 3.48Å; R767-I788 PolarHBondContact NH2-O 2.62Å; R767-I790 HydrophobicContact CG-CD1 4.36Å; R767-D830 WeakPolarHBondContact CD-OD1 3.24Å; R767-D830 HydrophobicContact CG-CB 4.07Å; R767-D830 PolarHBondContact N-OD2 2.8Å; R767-D830 PolarHBondContact NH2-O 2.87Å; R767-T832 PolarHBondContact NH2-O 3.26Å; R767-I834 PolarHBondContact NH1-O 3.22Å; R767-Y839 WeakPolarHBondContact CD-OH 3.06Å; R767-Y839 PolarHBondContact NH1-OH 2.88Å
768	E	93.6	Very high	93	Very high	50 Å²	50	53.4 Å²	53.4	23%	0.234	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-61.3	-30.3	-178.4	-73.5	-67	123.1	0	0	112.7	N766 L770 K771 Y781 V822	N766-E768 VanDerWaalsContact C-N 3.29Å; N766-E768 PolarHBondContact O-N 3.14Å; N766-E768 PolarHBondContact OD1-N 2.78Å; E768-L770 PolarHBondContact O-N 3.29Å; E768-L770 VanDerWaalsContact O-N 3.13Å; E768-K771 VanDerWaalsContact CD-NZ 3.31Å; E768-K771 WeakPolarHBondContact O-CB 3.19Å; E768-K771 PolarHBondContact O-N 2.91Å; E768-K771 WeakPolarHBondContact OE1-CE 3.46Å; E768-K771 IonicContact OE1-NZ 2.66Å; E768-K771 PolarHBondContact OE1-NZ 3.41Å; E768-K771 VanDerWaalsContact OE1-NZ 3.16Å; E768-K771 WeakPolarHBondContact OE2-CD 3.33Å; E768-K771 WeakPolarHBondContact OE2-CE 3.44Å; E768-K771 IonicContact OE2-NZ 2.67Å; E768-K771 PolarHBondContact OE2-NZ 3.16Å; E768-Y781 PolarHBondContact OE1-OH 3.26Å; E768-V822 HydrophobicContact CB-CG1 3.9Å
769	Q	94.4	Very high	93	Very high	22 Å²	22	53.5 Å²	53.5	10%	0.103	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-59.5	-20.9	172.2	-72.4	177.4	-27	0	0	113.9	W757 F764 N766 R767 K771 L772 V822	W757-Q769 HydrophobicContact CH2-CB 4.19Å; W757-Q769 HydrophobicContact CZ2-CB 4.45Å; F764-Q769 HydrophobicContact CD1-CB 3.85Å; F764-Q769 HydrophobicContact CE1-CB 4.36Å; N766-Q769 PolarHBondContact O-N 2.97Å; N766-Q769 PolarHBondContact OD1-N 3.33Å; R767-Q769 PolarHBondContact O-N 2.84Å; Q769-K771 PolarHBondContact O-N 2.93Å; Q769-L772 VanDerWaalsContact O-CB 3.3Å; Q769-L772 WeakPolarHBondContact O-CB 3.28Å; Q769-L772 PolarHBondContact O-N 2.87Å; Q769-V822 HydrophobicContact CG-CG1 3.75Å
770	L	94.6	Very high	93.2	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-61.9	-28.5	173.4	-64.6	167.2	0	0	0	112.2	I732 F764 R767 E768 L772 V773 M776 Y781 I788	I732-L770 HydrophobicContact CG1-CD2 4.38Å; F764-L770 HydrophobicContact CD1-CD2 4.11Å; F764-L770 HydrophobicContact CD1-CG 4.48Å; F764-L770 HydrophobicContact CE1-CD2 3.73Å; F764-L770 HydrophobicContact CE1-CG 4.37Å; F764-L770 HydrophobicContact CZ-CD2 3.97Å; R767-L770 WeakPolarHBondContact O-CB 3.25Å; R767-L770 VanDerWaalsContact O-CG 3.3Å; R767-L770 WeakPolarHBondContact O-CG 3.26Å; R767-L770 PolarHBondContact O-N 2.84Å; E768-L770 PolarHBondContact O-N 3.29Å; E768-L770 VanDerWaalsContact O-N 3.13Å; L770-L772 PolarHBondContact O-N 2.87Å; L770-V773 WeakPolarHBondContact O-CB 3.23Å; L770-V773 WeakPolarHBondContact O-CG2 3.42Å; L770-V773 PolarHBondContact O-N 2.84Å; L770-M776 WeakPolarHBondContact O-CB 3.46Å; L770-M776 WeakPolarHBondContact O-CG 3.46Å; L770-Y781 HydrophobicContact CB-CD2 3.97Å; L770-Y781 HydrophobicContact CB-CE2 3.97Å; L770-Y781 HydrophobicContact CD1-CD2 4.47Å; L770-Y781 HydrophobicContact CD1-CE2 4.16Å; L770-I788 HydrophobicContact CD1-CB 4.48Å; L770-I788 HydrophobicContact CD1-CD1 3.65Å; L770-I788 HydrophobicContact CD1-CG2 4.11Å
771	K	94.8	Very high	93.4	Very high	35 Å²	35	38.6 Å²	38.6	15%	0.152	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-64.1	-19.4	174.7	-61	178.9	-180	174	0	112.7	F178 E768 Q769 V773 Y781	F178-K771 HydrophobicContact CB-CD 4.36Å; F178-K771 HydrophobicContact CD1-CD 3.67Å; F178-K771 HydrophobicContact CD1-CG 3.96Å; F178-K771 HydrophobicContact CE1-CB 4.29Å; F178-K771 HydrophobicContact CE1-CD 4.26Å; F178-K771 HydrophobicContact CE1-CG 4.04Å; F178-K771 HydrophobicContact CG-CD 4.26Å; E768-K771 VanDerWaalsContact CD-NZ 3.31Å; E768-K771 WeakPolarHBondContact O-CB 3.19Å; E768-K771 PolarHBondContact O-N 2.91Å; E768-K771 WeakPolarHBondContact OE1-CE 3.46Å; E768-K771 IonicContact OE1-NZ 2.66Å; E768-K771 PolarHBondContact OE1-NZ 3.41Å; E768-K771 VanDerWaalsContact OE1-NZ 3.16Å; E768-K771 WeakPolarHBondContact OE2-CD 3.33Å; E768-K771 WeakPolarHBondContact OE2-CE 3.44Å; E768-K771 IonicContact OE2-NZ 2.67Å; E768-K771 PolarHBondContact OE2-NZ 3.16Å; Q769-K771 PolarHBondContact O-N 2.93Å; K771-V773 VanDerWaalsContact C-N 3.33Å; K771-Y781 HydrophobicContact CD-CD1 4.44Å; K771-Y781 HydrophobicContact CD-CE1 4.31Å; K771-Y781 VanDerWaalsContact CE-CD1 3.46Å; K771-Y781 HydrophobicContact CG-CD1 4.15Å; K771-Y781 HydrophobicContact CG-CD2 4.19Å; K771-Y781 HydrophobicContact CG-CE1 4.26Å; K771-Y781 HydrophobicContact CG-CE2 4.31Å; K771-Y781 HydrophobicContact CG-CG 4.11Å
772	L	93.9	Very high	93.6	Very high	91 Å²	91	36 Å²	36	48%	0.476	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-83.1	-9.2	175.9	-53.5	176.4	0	0	0	112.9	W757 Q769 L770 V822	W757-L772 HydrophobicContact CZ2-CD1 4.42Å; Q769-L772 VanDerWaalsContact O-CB 3.3Å; Q769-L772 WeakPolarHBondContact O-CB 3.28Å; Q769-L772 PolarHBondContact O-N 2.87Å; L770-L772 PolarHBondContact O-N 2.87Å; L772-V822 HydrophobicContact CD1-CB 4.44Å; L772-V822 HydrophobicContact CD1-CG2 4.08Å; L772-V822 HydrophobicContact CD2-CG2 3.91Å; L772-V822 HydrophobicContact CG-CG2 4.04Å
773	V	94.6	Very high	93.9	Very high	6 Å²	6	35 Å²	35	4%	0.036	20%	0.195	C	C	.	.	S	Bend	trans	-76.6	131	-179	-178.9	0	0	0	0	110.4	I754 W757 F764 L770 K771 G775 M776	I754-V773 HydrophobicContact CG1-CG1 3.91Å; I754-V773 HydrophobicContact CG1-CG2 4.37Å; W757-V773 HydrophobicContact CB-CG2 4.1Å; W757-V773 HydrophobicContact CD2-CG2 4.34Å; W757-V773 HydrophobicContact CG-CG2 3.89Å; F764-V773 HydrophobicContact CE1-CG2 3.92Å; F764-V773 HydrophobicContact CZ-CG2 3.83Å; L770-V773 WeakPolarHBondContact O-CB 3.23Å; L770-V773 WeakPolarHBondContact O-CG2 3.42Å; L770-V773 PolarHBondContact O-N 2.84Å; K771-V773 VanDerWaalsContact C-N 3.33Å; V773-G775 PolarHBondContact O-N 2.98Å; V773-M776 HydrophobicContact CB-CB 4.22Å; V773-M776 VanDerWaalsContact O-CB 3.31Å; V773-M776 WeakPolarHBondContact O-CB 3.34Å; V773-M776 PolarHBondContact O-N 3.46Å
774	K	91.8	Very high	94.1	Very high	180 Å²	180	32.5 Å²	32.5	78%	0.783	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	124.4	177.9	-176	-177.8	176.4	-174.3	0	110.7	S753	S753-K774 WeakPolarHBondContact CB-O 3.41Å
775	G	88.2	Confident	94.3	Very high	57 Å²	57	32.5 Å²	32.5	59%	0.588	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.4	4.8	-179.3	0	0	0	0	0	115.1	V773 G777	V773-G775 PolarHBondContact O-N 2.98Å; G775-G777 PolarHBondContact O-N 2.91Å
776	M	93	Very high	94.4	Very high	11 Å²	11	30.2 Å²	30.2	5%	0.054	17%	0.168	C	C	.	.			trans	-86	98.3	168.6	-165.6	66	70.1	0	0	110.2	L746 I754 L770 V773	L746-M776 HydrophobicContact CD2-CE 3.88Å; L746-M776 HydrophobicContact CD2-SD 4.46Å; I754-M776 HydrophobicContact CD1-CE 3.84Å; I754-M776 HydrophobicContact CG1-CE 4.19Å; L770-M776 WeakPolarHBondContact O-CB 3.46Å; L770-M776 WeakPolarHBondContact O-CG 3.46Å; V773-M776 HydrophobicContact CB-CB 4.22Å; V773-M776 VanDerWaalsContact O-CB 3.31Å; V773-M776 WeakPolarHBondContact O-CB 3.34Å; V773-M776 PolarHBondContact O-N 3.46Å
777	G	92.5	Very high	94.5	Very high	26 Å²	26	30 Å²	30	27%	0.268	17%	0.167	S	C	.	.			trans	-85.4	166.1	172.3	0	0	0	0	0	112.7	G775 K779 S780 Y781	G775-G777 PolarHBondContact O-N 2.91Å; G777-K779 VanDerWaalsContact C-N 3.32Å; G777-K779 PolarHBondContact O-N 2.86Å; G777-S780 PolarHBondContact O-N 3.21Å; G777-Y781 PolarHBondContact O-N 3.47Å
778	P	93.4	Very high	94.6	Very high	37 Å²	37	30 Å²	30	24%	0.24	17%	0.167	C	C	.	.	H	α-helix	trans	-52.4	-46.5	-178.2	-24.5	31.4	0	0	0	113	F178 S780 Y781 Q782	F178-P778 HydrophobicContact CD1-CB 4.11Å; F178-P778 HydrophobicContact CD1-CG 3.99Å; F178-P778 HydrophobicContact CD2-CG 4.16Å; F178-P778 HydrophobicContact CE1-CB 4.07Å; F178-P778 HydrophobicContact CE1-CG 3.71Å; F178-P778 HydrophobicContact CE2-CG 3.87Å; F178-P778 HydrophobicContact CG-CG 4.24Å; F178-P778 HydrophobicContact CZ-CG 3.66Å; P778-S780 PolarHBondContact O-N 3.4Å; P778-Y781 PolarHBondContact O-N 2.83Å; P778-Q782 PolarHBondContact O-N 2.74Å
779	K	94.3	Very high	94.6	Very high	53 Å²	53	29.4 Å²	29.4	23%	0.23	16%	0.162	C	C	.	.	H	α-helix	trans	-63.2	-42	177.2	-171.5	72.5	-151.4	-176.6	0	112.8	E243 E244 N245 G777 Y781 Q782 Q783	E243-K779 WeakPolarHBondContact O-CD 3.17Å; E243-K779 WeakPolarHBondContact O-CE 3.41Å; E243-K779 PolarHBondContact O-NZ 2.68Å; E244-K779 HydrophobicContact CB-CG 4.39Å; E244-K779 WeakPolarHBondContact O-CE 3.17Å; N245-K779 VanDerWaalsContact CG-NZ 3.31Å; N245-K779 PolarHBondContact ND2-NZ 2.81Å; N245-K779 PolarHBondContact OD1-NZ 2.78Å; G777-K779 VanDerWaalsContact C-N 3.32Å; G777-K779 PolarHBondContact O-N 2.86Å; K779-Y781 VanDerWaalsContact C-N 3.34Å; K779-Y781 PolarHBondContact O-N 3.5Å; K779-Q782 WeakPolarHBondContact O-CB 3.26Å; K779-Q782 PolarHBondContact O-N 2.61Å; K779-Q783 VanDerWaalsContact CE-NE2 3.35Å; K779-Q783 VanDerWaalsContact O-CG 3.32Å; K779-Q783 WeakPolarHBondContact O-CG 3.25Å; K779-Q783 PolarHBondContact O-N 3.39Å
780	S	95.1	Very high	94.5	Very high	15 Å²	15	28.5 Å²	28.5	11%	0.105	16%	0.158	C	C	.	.	H	α-helix	trans	-65.5	-39.3	178.4	-59.7	0	0	0	0	111.6	R750 G777 P778 Q783 C784	R750-S780 PolarHBondContact NE-OG 2.85Å; R750-S780 PolarHBondContact NH2-OG 2.92Å; G777-S780 PolarHBondContact O-N 3.21Å; P778-S780 PolarHBondContact O-N 3.4Å; S780-Q783 PolarHBondContact O-N 2.89Å; S780-C784 PolarHBondContact O-N 3.43Å; S780-C784 VanDerWaalsContact O-N 3.17Å; S780-C784 PolarHBondContact O-SG 3.16Å
781	Y	97	Very high	94.1	Very high	1 Å²	1	29.6 Å²	29.6	0%	0.004	16%	0.164	C	C	.	.	H	α-helix	trans	-62.5	-48.7	173.1	179.9	-111.2	0	0	0	111.5	F180 R767 E768 L770 K771 G777 P778 K779 Q783 C784 A785	F180-Y781 HydrophobicContact CE2-CD1 4.24Å; F180-Y781 AromaticContact CE2-CE1 3.87Å; F180-Y781 HydrophobicContact CE2-CE1 3.87Å; F180-Y781 AromaticContact CZ-CD1 3.74Å; F180-Y781 HydrophobicContact CZ-CD1 3.74Å; F180-Y781 AromaticContact CZ-CE1 3.78Å; F180-Y781 HydrophobicContact CZ-CE1 3.78Å; R767-Y781 VanDerWaalsContact O-CE2 3.31Å; R767-Y781 WeakPolarHBondContact O-CE2 3.49Å; E768-Y781 PolarHBondContact OE1-OH 3.26Å; L770-Y781 HydrophobicContact CB-CD2 3.97Å; L770-Y781 HydrophobicContact CB-CE2 3.97Å; L770-Y781 HydrophobicContact CD1-CD2 4.47Å; L770-Y781 HydrophobicContact CD1-CE2 4.16Å; K771-Y781 HydrophobicContact CD-CD1 4.44Å; K771-Y781 HydrophobicContact CD-CE1 4.31Å; K771-Y781 VanDerWaalsContact CE-CD1 3.46Å; K771-Y781 HydrophobicContact CG-CD1 4.15Å; K771-Y781 HydrophobicContact CG-CD2 4.19Å; K771-Y781 HydrophobicContact CG-CE1 4.26Å; K771-Y781 HydrophobicContact CG-CE2 4.31Å; K771-Y781 HydrophobicContact CG-CG 4.11Å; G777-Y781 PolarHBondContact O-N 3.47Å; P778-Y781 PolarHBondContact O-N 2.83Å; K779-Y781 VanDerWaalsContact C-N 3.34Å; K779-Y781 PolarHBondContact O-N 3.5Å; Y781-Q783 VanDerWaalsContact C-N 3.29Å; Y781-Q783 PolarHBondContact O-N 3.04Å; Y781-C784 PolarHBondContact O-N 3.22Å; Y781-A785 HydrophobicContact CD2-CB 4.09Å; Y781-A785 HydrophobicContact CE1-CB 4.4Å; Y781-A785 HydrophobicContact CE2-CB 3.75Å; Y781-A785 WeakPolarHBondContact O-CB 3.23Å; Y781-A785 PolarHBondContact O-N 3.31Å
782	Q	96.5	Very high	93.4	Very high	37 Å²	37	29.7 Å²	29.7	17%	0.173	17%	0.169	C	C	.	.	H	α-helix	trans	-53.2	-46.2	174.3	-173.9	-179	51.9	0	0	111.9	F180 F249 P778 K779 C784 H835	F180-Q782 HydrophobicContact CE1-CB 3.85Å; F180-Q782 HydrophobicContact CE1-CG 3.88Å; F249-Q782 WeakPolarHBondContact CD2-O 3.33Å; F249-Q782 HydrophobicContact CE2-CG 3.94Å; F249-Q782 WeakPolarHBondContact CE2-O 3.34Å; F249-Q782 HydrophobicContact CZ-CG 3.67Å; P778-Q782 PolarHBondContact O-N 2.74Å; K779-Q782 WeakPolarHBondContact O-CB 3.26Å; K779-Q782 PolarHBondContact O-N 2.61Å; Q782-C784 PolarHBondContact O-N 2.88Å; Q782-H835 PolarHBondContact O-NE2 3.02Å
783	Q	96.6	Very high	92.5	Very high	4 Å²	4	32.8 Å²	32.8	2%	0.019	18%	0.18	C	C	.	.	H	α-helix	trans	-70.2	-30.7	-175.7	-68.1	-54.1	-67.1	0	0	113.5	N245 T246 F249 A744 K779 S780 Y781 F787	N245-Q783 PolarHBondContact OD1-NE2 2.88Å; N245-Q783 VanDerWaalsContact OD1-NE2 3.11Å; T246-Q783 HydrophobicContact CG2-CB 4.47Å; T246-Q783 HydrophobicContact CG2-CG 4.39Å; T246-Q783 PolarHBondContact OG1-OE1 3.06Å; F249-Q783 VanDerWaalsContact CD1-NE2 3.28Å; F249-Q783 VanDerWaalsContact CG-OE1 3.31Å; A744-Q783 CarbonylContact O-C 3.52Å; K779-Q783 VanDerWaalsContact CE-NE2 3.35Å; K779-Q783 VanDerWaalsContact O-CG 3.32Å; K779-Q783 WeakPolarHBondContact O-CG 3.25Å; K779-Q783 PolarHBondContact O-N 3.39Å; S780-Q783 PolarHBondContact O-N 2.89Å; Y781-Q783 VanDerWaalsContact C-N 3.29Å; Y781-Q783 PolarHBondContact O-N 3.04Å; Q783-F787 VanDerWaalsContact O-CD2 3.25Å; Q783-F787 WeakPolarHBondContact O-CD2 3.26Å; Q783-F787 VanDerWaalsContact O-CE2 3.28Å; Q783-F787 WeakPolarHBondContact O-CE2 3.44Å
784	C	96.8	Very high	91.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-101.7	-27.4	-173.7	74.7	0	0	0	0	115.4	V743 A744 L746 S780 Y781 Q782 G786 F787 I788	V743-C784 HydrophobicContact CG1-CB 4.23Å; A744-C784 WeakPolarHBondContact O-CA 3.25Å; A744-C784 WeakPolarHBondContact O-CB 3.47Å; A744-C784 PolarHBondContact O-N 3.13Å; L746-C784 HydrophobicContact CD2-CB 3.78Å; L746-C784 HydrophobicContact CG-CB 3.87Å; S780-C784 PolarHBondContact O-N 3.43Å; S780-C784 VanDerWaalsContact O-N 3.17Å; S780-C784 PolarHBondContact O-SG 3.16Å; Y781-C784 PolarHBondContact O-N 3.22Å; Q782-C784 PolarHBondContact O-N 2.88Å; C784-G786 PolarHBondContact O-N 2.74Å; C784-F787 PolarHBondContact O-N 3.13Å; C784-I788 HydrophobicContact CB-CD1 4.01Å; C784-I788 PolarHBondContact O-N 2.76Å
785	A	96.9	Very high	90.4	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-60.2	-43	-162.7	0	0	0	0	0	113.8	R767 Y781 F787 I788 P836	R767-A785 WeakPolarHBondContact CD-O 3.38Å; R767-A785 VanDerWaalsContact CZ-O 3.3Å; R767-A785 PolarHBondContact NE-O 3.49Å; Y781-A785 HydrophobicContact CD2-CB 4.09Å; Y781-A785 HydrophobicContact CE1-CB 4.4Å; Y781-A785 HydrophobicContact CE2-CB 3.75Å; Y781-A785 WeakPolarHBondContact O-CB 3.23Å; Y781-A785 PolarHBondContact O-N 3.31Å; A785-F787 PolarHBondContact O-N 3.48Å; A785-I788 PolarHBondContact O-N 2.83Å; A785-P836 HydrophobicContact CB-CG 3.87Å
786	G	95.4	Very high	89.1	Confident	3 Å²	3	30.6 Å²	30.6	3%	0.031	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-70.6	-11	178.2	0	0	0	0	0	115.4	Y253 C784	Y253-G786 VanDerWaalsContact OH-CA 3.25Å; Y253-G786 WeakPolarHBondContact OH-CA 3.23Å; Y253-G786 PolarHBondContact OH-O 3.11Å; C784-G786 PolarHBondContact O-N 2.74Å
787	F	96.8	Very high	87.1	Confident	1 Å²	1	34.2 Å²	34.2	0%	0.004	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-98.5	-10.7	174.7	-55.9	-58.5	0	0	0	113	P248 F249 R252 Y253 S726 F727 G729 V730 V743 A744 Q783 C784 A785	P248-F787 HydrophobicContact CB-CE1 4.44Å; P248-F787 HydrophobicContact CB-CE2 4.3Å; P248-F787 HydrophobicContact CB-CZ 3.85Å; F249-F787 HydrophobicContact CB-CE2 4.26Å; R252-F787 HydrophobicContact CB-CE1 4.41Å; Y253-F787 HydrophobicContact CD2-CZ 4.31Å; Y253-F787 AromaticContact CE2-CE1 3.9Å; Y253-F787 HydrophobicContact CE2-CE1 3.9Å; Y253-F787 HydrophobicContact CE2-CE2 4.08Å; Y253-F787 AromaticContact CE2-CZ 3.62Å; Y253-F787 HydrophobicContact CE2-CZ 3.62Å; S726-F787 WeakPolarHBondContact O-CD1 3.39Å; F727-F787 HydrophobicContact CD1-CE1 4.19Å; F727-F787 HydrophobicContact CE1-CE1 4.46Å; G729-F787 CarbonylContact C-O 3.55Å; G729-F787 WeakPolarHBondContact CA-O 3.33Å; V730-F787 PolarHBondContact N-O 3.2Å; V743-F787 HydrophobicContact CG1-CB 3.72Å; A744-F787 HydrophobicContact CB-CD2 3.85Å; A744-F787 HydrophobicContact CB-CE2 3.67Å; Q783-F787 VanDerWaalsContact O-CD2 3.25Å; Q783-F787 WeakPolarHBondContact O-CD2 3.26Å; Q783-F787 VanDerWaalsContact O-CE2 3.28Å; Q783-F787 WeakPolarHBondContact O-CE2 3.44Å; C784-F787 PolarHBondContact O-N 3.13Å; A785-F787 PolarHBondContact O-N 3.48Å
788	I	95.9	Very high	85	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	129.2	177.6	-70.4	169.7	0	0	0	109.3	V730 I732 V743 L746 R767 L770 C784 A785	V730-I788 HydrophobicContact CG2-CG1 4.41Å; I732-I788 HydrophobicContact CB-CG2 3.74Å; I732-I788 HydrophobicContact CD1-CD1 4.04Å; I732-I788 HydrophobicContact CD1-CG1 4.13Å; I732-I788 HydrophobicContact CD1-CG2 4.09Å; I732-I788 HydrophobicContact CG1-CG2 4.19Å; I732-I788 HydrophobicContact CG2-CG2 4.21Å; V743-I788 HydrophobicContact CG1-CG1 4.46Å; L746-I788 HydrophobicContact CD1-CD1 4.42Å; R767-I788 PolarHBondContact NE-O 3.48Å; R767-I788 PolarHBondContact NH2-O 2.62Å; L770-I788 HydrophobicContact CD1-CB 4.48Å; L770-I788 HydrophobicContact CD1-CD1 3.65Å; L770-I788 HydrophobicContact CD1-CG2 4.11Å; C784-I788 HydrophobicContact CB-CD1 4.01Å; C784-I788 PolarHBondContact O-N 2.76Å; A785-I788 PolarHBondContact O-N 2.83Å
789	R	93.7	Very high	82.3	Confident	38 Å²	38	42.8 Å²	42.8	14%	0.143	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	151.7	176.1	-65.1	-176.5	-74.2	178.8	-6.3	111.2	V728 G729 V730 D731 I732 D830 Q831 F901	V728-R789 PolarHBondContact O-NH2 3.23Å; G729-R789 PolarHBondContact O-NH2 3.32Å; V730-R789 PolarHBondContact O-N 2.67Å; D731-R789 WeakPolarHBondContact CA-O 3.34Å; I732-R789 PolarHBondContact N-O 2.93Å; I732-R789 VanDerWaalsContact N-O 3.08Å; R789-D830 VanDerWaalsContact CA-O 3.32Å; R789-D830 WeakPolarHBondContact CA-O 3.38Å; R789-Q831 WeakPolarHBondContact CD-O 3.41Å; R789-F901 PolarHBondContact NH1-O 3.26Å
790	I	92.3	Very high	79.4	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.015	26%	0.255	C	S	.	.			trans	-130	109	171.9	-65.9	170.1	0	0	0	107.4	I732 F764 N766 R767 L795 D830 Q831	I732-I790 HydrophobicContact CG2-CD1 4.47Å; I732-I790 HydrophobicContact CG2-CG1 3.91Å; F764-I790 HydrophobicContact CB-CD1 3.95Å; F764-I790 HydrophobicContact CB-CG1 4.49Å; F764-I790 VanDerWaalsContact O-CG2 3.31Å; F764-I790 WeakPolarHBondContact O-CG2 3.45Å; N766-I790 VanDerWaalsContact CA-CD1 3.47Å; N766-I790 WeakPolarHBondContact O-CD1 3.35Å; R767-I790 HydrophobicContact CG-CD1 4.36Å; I790-L795 HydrophobicContact CG2-CD1 3.89Å; I790-D830 HydrophobicContact CB-CB 4.3Å; I790-D830 PolarHBondContact N-O 3.35Å; I790-D830 VanDerWaalsContact N-O 3.1Å; I790-Q831 WeakPolarHBondContact O-CG 2.99Å
791	N	87.5	Confident	76.4	Confident	23 Å²	23	52.7 Å²	52.7	12%	0.123	29%	0.287	C	S	.	.			trans	-95.8	133	-176.9	-63	-60.8	0	0	0	111.4	D731 Q793 T794 L795	D731-N791 WeakPolarHBondContact OD2-CB 3.49Å; D731-N791 PolarHBondContact OD2-ND2 2.84Å; N791-Q793 PolarHBondContact O-N 3.49Å; N791-Q793 VanDerWaalsContact O-N 3.13Å; N791-T794 PolarHBondContact O-N 3.23Å; N791-T794 PolarHBondContact O-OG1 3.07Å; N791-L795 PolarHBondContact O-N 3.33Å
792	P	80.2	Confident	73.3	Confident	38 Å²	38	57.6 Å²	57.6	25%	0.247	32%	0.319	C	S	.	.	H	α-helix	trans	-56	-31	174.3	-26.9	34.1	0	0	0	113.7	T794 L795 N796 L826	P792-T794 VanDerWaalsContact C-N 3.35Å; P792-T794 PolarHBondContact O-N 3.29Å; P792-L795 PolarHBondContact O-N 3.47Å; P792-N796 VanDerWaalsContact O-CG 3.29Å; P792-N796 PolarHBondContact O-N 2.94Å; P792-L826 HydrophobicContact CG-CD1 4.18Å
793	Q	74.2	Confident	70.1	Confident	155 Å²	155	62 Å²	62	72%	0.724	35%	0.351	S	S	*	.	H	α-helix	trans	-66.2	-33.9	177.5	-62.8	178.7	-0.3	0	0	112.8	N791 S797	N791-Q793 PolarHBondContact O-N 3.49Å; N791-Q793 VanDerWaalsContact O-N 3.13Å; Q793-S797 PolarHBondContact O-N 3.21Å; Q793-S797 PolarHBondContact O-OG 3.41Å
794	T	72	Confident	66.9	Low	23 Å²	23	67.8 Å²	67.8	14%	0.141	39%	0.39	C	S	.	.	H	α-helix	trans	-81.2	-27.4	177.6	54.1	0	0	0	0	112.2	D731 I734 N791 P792 S797	D731-T794 WeakPolarHBondContact OD2-CG2 3.46Å; D731-T794 PolarHBondContact OD2-OG1 3.23Å; I734-T794 HydrophobicContact CD1-CG2 4.05Å; I734-T794 HydrophobicContact CG1-CG2 4.31Å; I734-T794 HydrophobicContact CG2-CG2 3.72Å; N791-T794 PolarHBondContact O-N 3.23Å; N791-T794 PolarHBondContact O-OG1 3.07Å; P792-T794 VanDerWaalsContact C-N 3.35Å; P792-T794 PolarHBondContact O-N 3.29Å; T794-S797 WeakPolarHBondContact CA-OG 3.38Å; T794-S797 PolarHBondContact O-OG 2.73Å
795	L	70.9	Confident	63.7	Low	31 Å²	31	71.9 Å²	71.9	16%	0.162	42%	0.424	C	S	.	.	H	α-helix	trans	-64.6	-48.1	167.3	-77.4	159.7	0	0	0	112.2	P763 I765 I790 N791 P792 S797 A798 L826	P763-L795 HydrophobicContact CB-CD2 3.9Å; P763-L795 HydrophobicContact CG-CD2 3.9Å; I765-L795 HydrophobicContact CG1-CD2 4.47Å; I790-L795 HydrophobicContact CG2-CD1 3.89Å; N791-L795 PolarHBondContact O-N 3.33Å; P792-L795 PolarHBondContact O-N 3.47Å; L795-S797 VanDerWaalsContact C-N 3.3Å; L795-S797 PolarHBondContact O-N 2.95Å; L795-A798 PolarHBondContact O-N 3.17Å; L795-L826 HydrophobicContact CD1-CD1 3.42Å; L795-L826 VanDerWaalsContact CD1-CD1 3.42Å
796	N	59.3	Low	60.6	Low	144 Å²	144	77.6 Å²	77.6	77%	0.77	46%	0.461	S	S	*	.	H	α-helix	trans	-74.2	-15	-175.5	-68.1	-12.5	0	0	0	114.6	P792	P792-N796 VanDerWaalsContact O-CG 3.29Å; P792-N796 PolarHBondContact O-N 2.94Å
797	S	52.5	Low	57.6	Low	86 Å²	86	86.5 Å²	86.5	60%	0.601	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-8.5	179.2	45.5	0	0	0	0	113.7	Q793 T794 L795 K799	Q793-S797 PolarHBondContact O-N 3.21Å; Q793-S797 PolarHBondContact O-OG 3.41Å; T794-S797 WeakPolarHBondContact CA-OG 3.38Å; T794-S797 PolarHBondContact O-OG 2.73Å; L795-S797 VanDerWaalsContact C-N 3.3Å; L795-S797 PolarHBondContact O-N 2.95Å; S797-K799 PolarHBondContact O-N 2.83Å; S797-K799 VanDerWaalsContact O-N 3.16Å
798	A	47.4	Very low	54.3	Low	52 Å²	52	93.9 Å²	93.9	43%	0.43	54%	0.542	S	S	.	.			trans	-72	104.4	170.7	0	0	0	0	0	109.9	L795	L795-A798 PolarHBondContact O-N 3.17Å
799	K	36.8	Very low	51.3	Low	192 Å²	192	99.6 Å²	99.6	84%	0.835	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-55.3	136.4	166.9	-82.7	-174.7	174.9	-178.9	0	109.2	S797 L801	S797-K799 PolarHBondContact O-N 2.83Å; S797-K799 VanDerWaalsContact O-N 3.16Å; K799-L801 PolarHBondContact O-N 2.93Å; K799-L801 VanDerWaalsContact O-N 3.15Å
800	P	32.9	Very low	48.3	Very low	126 Å²	126	101.8 Å²	101.8	82%	0.818	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-59	121.4	170.6	-19.3	30.8	0	0	0	109.4
801	L	33.1	Very low	45.4	Very low	150 Å²	150	108 Å²	108	79%	0.785	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-64.6	143.5	160.4	-79.4	160.9	0	0	0	107.9	K799	K799-L801 PolarHBondContact O-N 2.93Å; K799-L801 VanDerWaalsContact O-N 3.15Å
802	P	31	Very low	42.7	Very low	104 Å²	104	116.2 Å²	116.2	68%	0.675	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-59.4	139	176.2	26.2	-33.7	0	0	0	109.3	C804	P802-C804 PolarHBondContact O-N 3.48Å
803	P	30.8	Very low	40.4	Very low	129 Å²	129	124.8 Å²	124.8	84%	0.838	71%	0.713	S	S	*	*			trans	-64.5	113	-178.4	25.6	-33.3	0	0	0	109.9	A805	P803-A805 PolarHBondContact O-N 2.69Å
804	C	28.1	Very low	38.2	Very low	125 Å²	125	122.7 Å²	122.7	85%	0.845	72%	0.716	S	S	*	*			trans	-58.8	130.3	163	-74.7	0	0	0	0	108.4	P802	P802-C804 PolarHBondContact O-N 3.48Å
805	A	29.4	Very low	36.2	Very low	87 Å²	87	131.6 Å²	131.6	72%	0.719	75%	0.752	S	S	*	*			trans	-57.4	143	-177.2	0	0	0	0	0	111.3	P803 E807	P803-A805 PolarHBondContact O-N 2.69Å; A805-E807 PolarHBondContact O-N 2.95Å; A805-E807 VanDerWaalsContact O-N 3.08Å
806	P	32.8	Very low	34.1	Very low	120 Å²	120	134 Å²	134	78%	0.779	79%	0.785	S	S	*	*			trans	-70.4	106.2	177.7	28.4	-33.4	0	0	0	110.4	N808	P806-N808 PolarHBondContact O-N 2.86Å
807	E	32.3	Very low	32.7	Very low	189 Å²	189	137 Å²	137	88%	0.883	79%	0.791	S	S	*	*			trans	-67.7	121.1	162.6	-73.6	-167.5	147.1	0	0	109.4	A805 P809	A805-E807 PolarHBondContact O-N 2.95Å; A805-E807 VanDerWaalsContact O-N 3.08Å; E807-P809 VanDerWaalsContact O-CD 3.3Å; E807-P809 WeakPolarHBondContact O-CD 3.24Å
808	N	28	Very low	31.6	Very low	157 Å²	157	137.8 Å²	137.8	84%	0.84	80%	0.804	S	S	*	*			trans	-61.7	118.8	178.9	-75.7	-49.5	0	0	0	111.4	P806 A810	P806-N808 PolarHBondContact O-N 2.86Å; N808-A810 PolarHBondContact O-N 3.42Å
809	P	32.8	Very low	30.8	Very low	119 Å²	119	138.9 Å²	138.9	77%	0.773	82%	0.82	S	S	*	*			trans	-78.8	114.9	172.7	30.8	-31.1	0	0	0	110.3	E807	E807-P809 VanDerWaalsContact O-CD 3.3Å; E807-P809 WeakPolarHBondContact O-CD 3.24Å
810	A	29.5	Very low	30.8	Very low	85 Å²	85	134 Å²	134	70%	0.702	81%	0.809	S	S	*	*			trans	-60.7	140.9	171.2	0	0	0	0	0	111.2	N808 K812	N808-A810 PolarHBondContact O-N 3.42Å; A810-K812 PolarHBondContact O-N 3.29Å
811	P	32.2	Very low	31.3	Very low	132 Å²	132	133.5 Å²	133.5	86%	0.857	81%	0.808	S	S	*	*			trans	-76.5	99.5	-167.9	30	-35.7	0	0	0	112.3
812	K	30.6	Very low	32.6	Very low	197 Å²	197	127.7 Å²	127.7	86%	0.857	78%	0.779	S	S	*	*			trans	-94.2	114.9	161.6	-78.2	-174.7	176.5	178	0	109.9	A810 S814	A810-K812 PolarHBondContact O-N 3.29Å; K812-S814 PolarHBondContact O-N 3.46Å
813	K	32.1	Very low	34.1	Very low	217 Å²	217	126.1 Å²	126.1	94%	0.943	77%	0.769	S	S	*	*			trans	-60.3	99.5	174.7	-68.7	177	175.9	177.6	0	110.9
814	S	27.3	Very low	35.9	Very low	111 Å²	111	125.7 Å²	125.7	78%	0.776	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-95.4	136.5	154.6	46.5	0	0	0	0	109	K812	K812-S814 PolarHBondContact O-N 3.46Å
815	K	29.4	Very low	38.5	Very low	210 Å²	210	123.6 Å²	123.6	91%	0.913	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-66	148.7	176	-74.7	-177.5	173.5	-177	0	110.1
816	G	27.1	Very low	41.1	Very low	83 Å²	83	122.6 Å²	122.6	86%	0.856	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-58.7	137.4	-164.8	0	0	0	0	0	114.3
817	K	29.7	Very low	43.8	Very low	205 Å²	205	118.8 Å²	118.8	89%	0.891	71%	0.706	S	S	*	*			trans	-109.9	123.3	157.5	-163.1	177.2	-172.1	-174.8	0	105.3	G819	K817-G819 PolarHBondContact O-N 3.26Å
818	A	30.3	Very low	46.6	Very low	104 Å²	104	111 Å²	111	86%	0.86	67%	0.672	S	S	*	*			trans	-58.4	126.9	-177.9	0	0	0	0	0	109.8	C820	A818-C820 PolarHBondContact O-N 3.26Å
819	G	29.9	Very low	49.7	Very low	75 Å²	75	103.5 Å²	103.5	77%	0.773	63%	0.632	S	S	*	*			trans	-77.5	106	-175.9	0	0	0	0	0	110.7	K817 S821	K817-G819 PolarHBondContact O-N 3.26Å; G819-S821 PolarHBondContact O-N 3.21Å; G819-S821 VanDerWaalsContact O-N 3.09Å
820	C	37.9	Very low	52.5	Low	90 Å²	90	98 Å²	98	61%	0.608	60%	0.596	S	S	*	*			trans	-62.2	110.9	167.2	-173.8	0	0	0	0	108.7	A818 V822	A818-C820 PolarHBondContact O-N 3.26Å; C820-V822 VanDerWaalsContact C-N 3.32Å; C820-V822 PolarHBondContact O-N 2.78Å
821	S	43.4	Very low	55.5	Low	114 Å²	114	96 Å²	96	80%	0.797	57%	0.572	S	S	*	*			trans	-76.9	82	-177.3	59.1	0	0	0	0	110.3	G819	G819-S821 PolarHBondContact O-N 3.21Å; G819-S821 VanDerWaalsContact O-N 3.09Å
822	V	59.8	Low	58.4	Low	29 Å²	29	90.1 Å²	90.1	18%	0.176	53%	0.534	C	S	.	.			trans	-62.8	127.2	177.4	178	0	0	0	0	109.6	E768 Q769 L772 C820	E768-V822 HydrophobicContact CB-CG1 3.9Å; Q769-V822 HydrophobicContact CG-CG1 3.75Å; L772-V822 HydrophobicContact CD1-CB 4.44Å; L772-V822 HydrophobicContact CD1-CG2 4.08Å; L772-V822 HydrophobicContact CD2-CG2 3.91Å; L772-V822 HydrophobicContact CG-CG2 4.04Å; C820-V822 VanDerWaalsContact C-N 3.32Å; C820-V822 PolarHBondContact O-N 2.78Å
823	P	63.9	Low	61.4	Low	71 Å²	71	81.6 Å²	81.6	46%	0.461	50%	0.499	S	S	.	.			trans	-57.1	139.4	176.8	-25.2	34.3	0	0	0	111.9	N766	N766-P823 PolarHBondContact ND2-O 3.3Å
824	T	67.9	Low	64.4	Low	120 Å²	120	71.3 Å²	71.3	74%	0.736	45%	0.454	S	S	*	.			trans	-89.9	-4.9	177.6	8.9	0	0	0	0	114
825	S	82.1	Confident	67.7	Low	81 Å²	81	66.1 Å²	66.1	57%	0.566	42%	0.417	S	S	*	.	S	Bend	trans	-85	149.3	178.9	54.8	0	0	0	0	112.6	N766	N766-S825 PolarHBondContact ND2-O 2.95Å
826	L	85.1	Confident	70.9	Confident	65 Å²	65	56.8 Å²	56.8	34%	0.34	38%	0.378	S	S	.	.			trans	-66.9	134.5	167.4	179.9	132.5	0	0	0	110.1	I765 P792 L795 P828	I765-L826 HydrophobicContact CG2-CB 4.25Å; P792-L826 HydrophobicContact CG-CD1 4.18Å; L795-L826 HydrophobicContact CD1-CD1 3.42Å; L795-L826 VanDerWaalsContact CD1-CD1 3.42Å; L826-P828 HydrophobicContact CD2-CG 4.13Å
827	N	89.4	Confident	74.1	Confident	40 Å²	40	54.5 Å²	54.5	21%	0.214	35%	0.345	C	S	.	.			trans	-104.3	114.3	170.3	-179.5	-6.6	0	0	0	108.9	L829 D830 Y839	N827-L829 PolarHBondContact O-N 3Å; N827-L829 VanDerWaalsContact O-N 3.13Å; N827-L829 WeakPolarHBondContact OD1-CB 3.5Å; N827-L829 PolarHBondContact OD1-N 2.93Å; N827-L829 VanDerWaalsContact OD1-N 3.1Å; N827-D830 WeakPolarHBondContact O-CB 3.25Å; N827-D830 PolarHBondContact O-N 3.44Å; N827-Y839 VanDerWaalsContact ND2-CD2 3.35Å; N827-Y839 WeakPolarHBondContact ND2-CD2 3.44Å; N827-Y839 WeakPolarHBondContact ND2-CE2 3.48Å
828	P	89.5	Confident	77.3	Confident	26 Å²	26	45.3 Å²	45.3	17%	0.169	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-64	-21.4	-176	-17.4	28.3	0	0	0	113.8	L826 D830 Q831 V853 I856	L826-P828 HydrophobicContact CD2-CG 4.13Å; P828-D830 PolarHBondContact O-N 2.56Å; P828-Q831 WeakPolarHBondContact O-CB 3.39Å; P828-Q831 PolarHBondContact O-N 3.27Å; P828-Q831 PolarHBondContact O-NE2 2.68Å; P828-V853 HydrophobicContact CB-CG1 3.94Å; P828-V853 HydrophobicContact CG-CG1 3.88Å; P828-I856 HydrophobicContact CB-CD1 4.16Å
829	L	92.9	Very high	80.4	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-63.4	-22.5	174.1	-63.1	172.9	0	0	0	113	N827 Q831 T832 I834 Y839 A842 V853 I856 L895	N827-L829 PolarHBondContact O-N 3Å; N827-L829 VanDerWaalsContact O-N 3.13Å; N827-L829 WeakPolarHBondContact OD1-CB 3.5Å; N827-L829 PolarHBondContact OD1-N 2.93Å; N827-L829 VanDerWaalsContact OD1-N 3.1Å; L829-Q831 PolarHBondContact O-N 3.35Å; L829-Q831 VanDerWaalsContact O-N 3.11Å; L829-T832 WeakPolarHBondContact O-CB 3.36Å; L829-T832 PolarHBondContact O-N 2.87Å; L829-T832 PolarHBondContact O-OG1 2.83Å; L829-I834 HydrophobicContact CD2-CD1 4.19Å; L829-Y839 HydrophobicContact CB-CD1 4.14Å; L829-Y839 HydrophobicContact CB-CE1 3.77Å; L829-Y839 HydrophobicContact CB-CE2 4.44Å; L829-Y839 HydrophobicContact CD1-CD1 3.84Å; L829-Y839 HydrophobicContact CD1-CD2 4.37Å; L829-Y839 HydrophobicContact CD1-CE1 4.34Å; L829-Y839 HydrophobicContact CD1-CG 3.84Å; L829-A842 HydrophobicContact CD1-CB 4.46Å; L829-A842 HydrophobicContact CD2-CB 4.43Å; L829-V853 HydrophobicContact CD2-CG1 4.38Å; L829-V853 HydrophobicContact CG-CG1 4.16Å; L829-I856 HydrophobicContact CD2-CD1 3.86Å; L829-L895 HydrophobicContact CD2-CD2 3.86Å
830	D	93.4	Very high	83.4	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.021	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-66.5	-10	178	-67	-11.1	0	0	0	113.3	N766 R767 R789 I790 N827 P828 Y839	N766-D830 WeakPolarHBondContact CA-OD2 3.38Å; N766-D830 WeakPolarHBondContact CB-OD2 3.45Å; R767-D830 WeakPolarHBondContact CD-OD1 3.24Å; R767-D830 HydrophobicContact CG-CB 4.07Å; R767-D830 PolarHBondContact N-OD2 2.8Å; R767-D830 PolarHBondContact NH2-O 2.87Å; R789-D830 VanDerWaalsContact CA-O 3.32Å; R789-D830 WeakPolarHBondContact CA-O 3.38Å; I790-D830 HydrophobicContact CB-CB 4.3Å; I790-D830 PolarHBondContact N-O 3.35Å; I790-D830 VanDerWaalsContact N-O 3.1Å; N827-D830 WeakPolarHBondContact O-CB 3.25Å; N827-D830 PolarHBondContact O-N 3.44Å; P828-D830 PolarHBondContact O-N 2.56Å; D830-Y839 PolarHBondContact OD1-OH 3.2Å
831	Q	91.3	Very high	86.2	Confident	43 Å²	43	37.7 Å²	37.7	20%	0.201	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-80.1	-20.4	171.4	-67.5	170.3	82.1	0	0	113	R789 I790 P828 L829	R789-Q831 WeakPolarHBondContact CD-O 3.41Å; I790-Q831 WeakPolarHBondContact O-CG 2.99Å; P828-Q831 WeakPolarHBondContact O-CB 3.39Å; P828-Q831 PolarHBondContact O-N 3.27Å; P828-Q831 PolarHBondContact O-NE2 2.68Å; L829-Q831 PolarHBondContact O-N 3.35Å; L829-Q831 VanDerWaalsContact O-N 3.11Å
832	T	93.2	Very high	88.7	Confident	8 Å²	8	32.3 Å²	32.3	5%	0.049	19%	0.185	C	C	.	.	S	Bend	trans	-96.3	172.1	-168.2	75.6	0	0	0	0	112.4	R767 L829 I834 I856 G894	R767-T832 PolarHBondContact NH2-O 3.26Å; L829-T832 WeakPolarHBondContact O-CB 3.36Å; L829-T832 PolarHBondContact O-N 2.87Å; L829-T832 PolarHBondContact O-OG1 2.83Å; T832-I834 PolarHBondContact O-N 3.21Å; T832-I834 VanDerWaalsContact OG1-CB 3.32Å; T832-I834 WeakPolarHBondContact OG1-CB 3Å; T832-I834 VanDerWaalsContact OG1-CG1 3.32Å; T832-I834 WeakPolarHBondContact OG1-CG1 3.41Å; T832-I834 PolarHBondContact OG1-N 3Å; T832-I856 HydrophobicContact CG2-CD1 4.33Å; T832-I856 HydrophobicContact CG2-CG2 3.97Å; T832-G894 VanDerWaalsContact CG2-O 3.24Å; T832-G894 WeakPolarHBondContact CG2-O 3.48Å
833	C	93.1	Very high	90.3	Very high	18 Å²	18	35.7 Å²	35.7	12%	0.122	20%	0.199	C	C	.	.	S	Bend	trans	-77.8	-3	171.4	61.1	0	0	0	0	114.4	Y253	Y253-C833 WeakPolarHBondContact CE1-O 3.47Å; Y253-C833 PolarHBondContact OH-O 2.83Å
834	I	95.7	Very high	91.8	Very high	1 Å²	1	37 Å²	37	1%	0.005	20%	0.195	C	C	.	.			trans	-67.1	132.3	-177.4	-56.8	173.1	0	0	0	108.8	R767 L829 T832 Y839 A842 I891 L895	R767-I834 PolarHBondContact NH1-O 3.22Å; L829-I834 HydrophobicContact CD2-CD1 4.19Å; T832-I834 PolarHBondContact O-N 3.21Å; T832-I834 VanDerWaalsContact OG1-CB 3.32Å; T832-I834 WeakPolarHBondContact OG1-CB 3Å; T832-I834 VanDerWaalsContact OG1-CG1 3.32Å; T832-I834 WeakPolarHBondContact OG1-CG1 3.41Å; T832-I834 PolarHBondContact OG1-N 3Å; I834-Y839 HydrophobicContact CB-CE1 4.45Å; I834-Y839 HydrophobicContact CG2-CD1 3.99Å; I834-Y839 HydrophobicContact CG2-CE1 4.2Å; I834-A842 HydrophobicContact CD1-CB 4.25Å; I834-A842 HydrophobicContact CG2-CB 4.41Å; I834-I891 HydrophobicContact CD1-CB 4.45Å; I834-I891 HydrophobicContact CD1-CG2 4.2Å; I834-I891 HydrophobicContact CG1-CG1 4.46Å; I834-I891 HydrophobicContact CG2-CG1 4.18Å; I834-L895 HydrophobicContact CD1-CD2 4.05Å; I834-L895 HydrophobicContact CD1-CG 3.97Å
835	H	96.9	Very high	93.1	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	16%	0.16	C	C	.	.			trans	-77.5	145.3	178.2	-165.9	-100	0	0	0	111.2	F180 F249 Y253 Q782 E837 S838 Y839	F180-H835 AromaticContact CZ-CE1 3.99Å; F249-H835 AromaticContact CE2-NE2 3.99Å; Y253-H835 HydrophobicContact CD1-CB 3.8Å; Y253-H835 HydrophobicContact CE1-CB 3.64Å; Y253-H835 HydrophobicContact CG-CB 4.48Å; Q782-H835 PolarHBondContact O-NE2 3.02Å; H835-E837 HydrophobicContact CB-CG 4.15Å; H835-E837 IonicContact CE1-OE2 3.87Å; H835-E837 IonicContact CG-OE1 2.81Å; H835-E837 WeakPolarHBondContact ND1-CB 3.33Å; H835-E837 WeakPolarHBondContact ND1-CG 3.01Å; H835-E837 PolarHBondContact ND1-N 2.83Å; H835-E837 IonicContact ND1-OE1 2.79Å; H835-E837 IonicContact ND1-OE2 3.01Å; H835-E837 PolarHBondContact ND1-OE2 2.84Å; H835-E837 PolarHBondContact O-N 3.29Å; H835-E837 VanDerWaalsContact O-N 3.14Å; H835-S838 PolarHBondContact O-N 2.87Å; H835-Y839 WeakPolarHBondContact O-CD1 3.36Å
836	P	96.2	Very high	93.6	Very high	14 Å²	14	27.6 Å²	27.6	9%	0.091	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-51.5	-34.6	175.8	-31.5	37.7	0	0	0	115.1	F180 A785 S838 Y839	F180-P836 HydrophobicContact CE2-CB 4.37Å; A785-P836 HydrophobicContact CB-CG 3.87Å; P836-S838 PolarHBondContact O-N 2.87Å; P836-S838 VanDerWaalsContact O-N 3.16Å; P836-Y839 HydrophobicContact CB-CD2 4.37Å; P836-Y839 HydrophobicContact CB-CE2 4.12Å; P836-Y839 HydrophobicContact CG-CE1 4.47Å; P836-Y839 HydrophobicContact CG-CE2 4.27Å; P836-Y839 WeakPolarHBondContact O-CB 3.49Å; P836-Y839 PolarHBondContact O-N 3Å
837	E	94.9	Very high	94	Very high	36 Å²	36	29.3 Å²	29.3	17%	0.168	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-57.2	-29.8	175.2	80.3	-160	169.7	0	0	112.6	F180 R254 H835 H840	F180-E837 HydrophobicContact CB-CB 4.09Å; F180-E837 HydrophobicContact CD1-CB 4.3Å; F180-E837 HydrophobicContact CD2-CB 4.33Å; F180-E837 HydrophobicContact CG-CB 4.01Å; R254-E837 IonicContact CZ-OE1 3.41Å; R254-E837 IonicContact CZ-OE2 3.6Å; R254-E837 IonicContact NH1-OE1 3.52Å; R254-E837 PolarHBondContact NH1-OE1 2.86Å; R254-E837 IonicContact NH1-OE2 2.67Å; R254-E837 VanDerWaalsContact NH2-CD 3.33Å; R254-E837 IonicContact NH2-OE1 3.67Å; R254-E837 PolarHBondContact NH2-OE1 2.86Å; R254-E837 IonicContact NH2-OE2 3.63Å; R254-E837 PolarHBondContact NH2-OE2 3.29Å; H835-E837 HydrophobicContact CB-CG 4.15Å; H835-E837 IonicContact CE1-OE2 3.87Å; H835-E837 IonicContact CG-OE1 2.81Å; H835-E837 WeakPolarHBondContact ND1-CB 3.33Å; H835-E837 WeakPolarHBondContact ND1-CG 3.01Å; H835-E837 PolarHBondContact ND1-N 2.83Å; H835-E837 IonicContact ND1-OE1 2.79Å; H835-E837 IonicContact ND1-OE2 3.01Å; H835-E837 PolarHBondContact ND1-OE2 2.84Å; H835-E837 PolarHBondContact O-N 3.29Å; H835-E837 VanDerWaalsContact O-N 3.14Å; E837-H840 PolarHBondContact O-CE1 2.92Å; E837-H840 VanDerWaalsContact O-CE1 3.25Å; E837-H840 PolarHBondContact O-ND1 2.83Å
838	S	96.1	Very high	94.1	Very high	11 Å²	11	29.9 Å²	29.9	8%	0.077	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-99.1	5.4	-177.6	-44.8	0	0	0	0	114.1	H835 P836 H840 V841 A842	H835-S838 PolarHBondContact O-N 2.87Å; P836-S838 PolarHBondContact O-N 2.87Å; P836-S838 VanDerWaalsContact O-N 3.16Å; S838-H840 VanDerWaalsContact C-N 3.3Å; S838-H840 PolarHBondContact O-N 3.33Å; S838-V841 WeakPolarHBondContact O-CB 3.25Å; S838-V841 PolarHBondContact O-N 3.12Å; S838-V841 VanDerWaalsContact O-N 3.13Å; S838-A842 PolarHBondContact O-N 3.01Å
839	Y	95.3	Very high	94.2	Very high	28 Å²	28	29.4 Å²	29.4	11%	0.11	15%	0.151	C	C	.	.	H	α-helix	trans	-60.3	-40.4	-178.7	-76.2	0.3	0	0	0	113	R767 N827 L829 D830 I834 H835 P836 V841 A842 Q843	R767-Y839 WeakPolarHBondContact CD-OH 3.06Å; R767-Y839 PolarHBondContact NH1-OH 2.88Å; N827-Y839 VanDerWaalsContact ND2-CD2 3.35Å; N827-Y839 WeakPolarHBondContact ND2-CD2 3.44Å; N827-Y839 WeakPolarHBondContact ND2-CE2 3.48Å; L829-Y839 HydrophobicContact CB-CD1 4.14Å; L829-Y839 HydrophobicContact CB-CE1 3.77Å; L829-Y839 HydrophobicContact CB-CE2 4.44Å; L829-Y839 HydrophobicContact CD1-CD1 3.84Å; L829-Y839 HydrophobicContact CD1-CD2 4.37Å; L829-Y839 HydrophobicContact CD1-CE1 4.34Å; L829-Y839 HydrophobicContact CD1-CG 3.84Å; D830-Y839 PolarHBondContact OD1-OH 3.2Å; I834-Y839 HydrophobicContact CB-CE1 4.45Å; I834-Y839 HydrophobicContact CG2-CD1 3.99Å; I834-Y839 HydrophobicContact CG2-CE1 4.2Å; H835-Y839 WeakPolarHBondContact O-CD1 3.36Å; P836-Y839 HydrophobicContact CB-CD2 4.37Å; P836-Y839 HydrophobicContact CB-CE2 4.12Å; P836-Y839 HydrophobicContact CG-CE1 4.47Å; P836-Y839 HydrophobicContact CG-CE2 4.27Å; P836-Y839 WeakPolarHBondContact O-CB 3.49Å; P836-Y839 PolarHBondContact O-N 3Å; Y839-V841 VanDerWaalsContact C-N 3.31Å; Y839-V841 PolarHBondContact O-N 2.89Å; Y839-A842 PolarHBondContact O-N 2.85Å; Y839-Q843 WeakPolarHBondContact O-CG 3.44Å; Y839-Q843 PolarHBondContact O-N 2.85Å
840	H	94.5	Very high	93.9	Very high	80 Å²	80	32.5 Å²	32.5	37%	0.37	18%	0.183	S	C	.	.	H	α-helix	trans	-64.6	-36.2	177.7	77.7	-74.9	0	0	0	111.7	E837 S838 R844	E837-H840 PolarHBondContact O-CE1 2.92Å; E837-H840 VanDerWaalsContact O-CE1 3.25Å; E837-H840 PolarHBondContact O-ND1 2.83Å; S838-H840 VanDerWaalsContact C-N 3.3Å; S838-H840 PolarHBondContact O-N 3.33Å; H840-R844 PolarHBondContact CD2-NH1 3.43Å; H840-R844 PolarHBondContact NE2-NH2 3.03Å; H840-R844 WeakPolarHBondContact O-CG 3.08Å; H840-R844 PolarHBondContact O-N 2.81Å; H840-R844 VanDerWaalsContact O-N 3.14Å
841	V	95.7	Very high	93.7	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.012	19%	0.19	C	C	.	.	H	α-helix	trans	-65.5	-45.9	171.3	-171.1	0	0	0	0	111.2	S838 Y839 Q843 R844 F845 V881 T883 I891	S838-V841 WeakPolarHBondContact O-CB 3.25Å; S838-V841 PolarHBondContact O-N 3.12Å; S838-V841 VanDerWaalsContact O-N 3.13Å; Y839-V841 VanDerWaalsContact C-N 3.31Å; Y839-V841 PolarHBondContact O-N 2.89Å; V841-Q843 VanDerWaalsContact C-N 3.32Å; V841-Q843 PolarHBondContact O-N 2.93Å; V841-R844 PolarHBondContact O-N 2.94Å; V841-F845 PolarHBondContact O-N 3.04Å; V841-V881 HydrophobicContact CG1-CB 4.3Å; V841-V881 HydrophobicContact CG1-CG2 3.75Å; V841-T883 HydrophobicContact CG1-CG2 3.73Å; V841-I891 HydrophobicContact CB-CD1 3.8Å; V841-I891 HydrophobicContact CG1-CD1 3.61Å
842	A	95.1	Very high	93.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.5	-39.2	-179.8	0	0	0	0	0	112.1	L829 I834 S838 Y839 F845 L846 I891	L829-A842 HydrophobicContact CD1-CB 4.46Å; L829-A842 HydrophobicContact CD2-CB 4.43Å; I834-A842 HydrophobicContact CD1-CB 4.25Å; I834-A842 HydrophobicContact CG2-CB 4.41Å; S838-A842 PolarHBondContact O-N 3.01Å; Y839-A842 PolarHBondContact O-N 2.85Å; A842-F845 PolarHBondContact O-N 2.99Å; A842-L846 WeakPolarHBondContact O-CG 3.45Å; A842-L846 PolarHBondContact O-N 2.88Å; A842-I891 HydrophobicContact CB-CD1 4.43Å; A842-I891 HydrophobicContact CB-CG2 3.81Å
843	Q	94.2	Very high	93.1	Very high	100 Å²	100	34.8 Å²	34.8	47%	0.467	21%	0.205	S	C	.	.	H	α-helix	trans	-63.2	-47.4	173	-72.1	171.5	-8	0	0	111.9	Y839 V841 F845 L846 S847	Y839-Q843 WeakPolarHBondContact O-CG 3.44Å; Y839-Q843 PolarHBondContact O-N 2.85Å; V841-Q843 VanDerWaalsContact C-N 3.32Å; V841-Q843 PolarHBondContact O-N 2.93Å; Q843-F845 VanDerWaalsContact C-N 3.28Å; Q843-F845 PolarHBondContact O-N 2.96Å; Q843-L846 PolarHBondContact O-N 3.1Å; Q843-S847 PolarHBondContact O-N 2.72Å; Q843-S847 VanDerWaalsContact O-N 3.08Å; Q843-S847 PolarHBondContact O-OG 3.17Å
844	R	94.7	Very high	92.7	Very high	98 Å²	98	40.4 Å²	40.4	37%	0.37	23%	0.234	S	C	.	.	H	α-helix	trans	-56.2	-42.3	173.7	-72.9	-167.3	-66.3	-109.1	5	112.1	H840 V841 S847 L848 V881	H840-R844 PolarHBondContact CD2-NH1 3.43Å; H840-R844 PolarHBondContact NE2-NH2 3.03Å; H840-R844 WeakPolarHBondContact O-CG 3.08Å; H840-R844 PolarHBondContact O-N 2.81Å; H840-R844 VanDerWaalsContact O-N 3.14Å; V841-R844 PolarHBondContact O-N 2.94Å; R844-S847 PolarHBondContact O-N 3.07Å; R844-L848 PolarHBondContact O-N 3.1Å; R844-L848 VanDerWaalsContact O-N 3.12Å; R844-V881 HydrophobicContact CB-CB 4.32Å; R844-V881 HydrophobicContact CB-CG1 4.31Å; R844-V881 VanDerWaalsContact CZ-O 3.23Å; R844-V881 PolarHBondContact NE-O 3.16Å; R844-V881 PolarHBondContact NH2-O 3.28Å
845	F	94.9	Very high	92.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.9	-41.5	179	-176.6	-109	0	0	0	112.7	V841 A842 Q843 S847 L848 V849 V865 L877 V881 L888 I891 I892 L895	V841-F845 PolarHBondContact O-N 3.04Å; A842-F845 PolarHBondContact O-N 2.99Å; Q843-F845 VanDerWaalsContact C-N 3.28Å; Q843-F845 PolarHBondContact O-N 2.96Å; F845-S847 VanDerWaalsContact C-N 3.34Å; F845-S847 PolarHBondContact O-N 3.42Å; F845-L848 WeakPolarHBondContact O-CB 3.48Å; F845-L848 PolarHBondContact O-N 3.33Å; F845-V849 HydrophobicContact CD1-CG1 4.47Å; F845-V849 HydrophobicContact CD2-CG1 4.38Å; F845-V849 HydrophobicContact CE1-CG1 3.96Å; F845-V849 HydrophobicContact CE2-CG1 3.85Å; F845-V849 HydrophobicContact CZ-CG1 3.62Å; F845-V849 PolarHBondContact O-N 3.05Å; F845-V849 VanDerWaalsContact O-N 3.07Å; F845-V865 HydrophobicContact CE1-CG1 4.24Å; F845-V865 HydrophobicContact CE1-CG2 4.07Å; F845-V865 HydrophobicContact CZ-CG1 4.2Å; F845-L877 HydrophobicContact CE2-CD1 4.44Å; F845-V881 HydrophobicContact CB-CG1 4.25Å; F845-V881 HydrophobicContact CD2-CG1 4.37Å; F845-L888 HydrophobicContact CB-CD1 4.36Å; F845-L888 HydrophobicContact CD1-CD1 4.28Å; F845-L888 HydrophobicContact CD2-CD1 3.6Å; F845-L888 HydrophobicContact CE2-CD1 3.89Å; F845-L888 HydrophobicContact CE2-CD2 4.45Å; F845-L888 HydrophobicContact CG-CD1 3.81Å; F845-L888 HydrophobicContact CZ-CD1 4.35Å; F845-I891 HydrophobicContact CD1-CG2 4.33Å; F845-I892 HydrophobicContact CD1-CG1 4.49Å; F845-I892 HydrophobicContact CE1-CD1 4.37Å; F845-I892 HydrophobicContact CE1-CG1 3.59Å; F845-I892 HydrophobicContact CZ-CD1 3.89Å; F845-I892 HydrophobicContact CZ-CG1 3.61Å; F845-L895 HydrophobicContact CD1-CD1 3.9Å; F845-L895 HydrophobicContact CE1-CD1 4.41Å
846	L	93.6	Very high	91.9	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.021	26%	0.258	C	S	.	.	H	α-helix	trans	-57.7	-45.1	174	-78.4	170.8	0	0	0	111.9	A842 Q843 L848 V849 G850 G851 V853 L861 L895	A842-L846 WeakPolarHBondContact O-CG 3.45Å; A842-L846 PolarHBondContact O-N 2.88Å; Q843-L846 PolarHBondContact O-N 3.1Å; L846-L848 VanDerWaalsContact C-N 3.29Å; L846-L848 PolarHBondContact O-N 3.44Å; L846-V849 WeakPolarHBondContact O-CG2 3.44Å; L846-V849 PolarHBondContact O-N 2.95Å; L846-G850 PolarHBondContact O-N 3.06Å; L846-G851 PolarHBondContact O-N 3.14Å; L846-V853 HydrophobicContact CD1-CB 4.42Å; L846-V853 HydrophobicContact CD1-CG2 3.9Å; L846-L861 HydrophobicContact CD2-CD1 3.73Å; L846-L861 HydrophobicContact CD2-CD2 4.08Å; L846-L895 HydrophobicContact CD1-CD2 4.1Å; L846-L895 HydrophobicContact CD2-CD1 3.91Å; L846-L895 HydrophobicContact CD2-CD2 4.24Å; L846-L895 HydrophobicContact CG-CD1 3.96Å; L846-L895 HydrophobicContact CG-CD2 4.32Å
847	S	92.9	Very high	91.4	Very high	101 Å²	101	45.6 Å²	45.6	71%	0.706	26%	0.263	S	S	*	.	H	α-helix	trans	-61.5	-34.5	173.7	-54.4	0	0	0	0	113	Q843 R844 F845	Q843-S847 PolarHBondContact O-N 2.72Å; Q843-S847 VanDerWaalsContact O-N 3.08Å; Q843-S847 PolarHBondContact O-OG 3.17Å; R844-S847 PolarHBondContact O-N 3.07Å; F845-S847 VanDerWaalsContact C-N 3.34Å; F845-S847 PolarHBondContact O-N 3.42Å
848	L	91.6	Very high	91.2	Very high	53 Å²	53	45.9 Å²	45.9	28%	0.277	27%	0.268	S	S	.	.	H	α-helix	trans	-73	-29.2	-179.9	-176.1	63.5	0	0	0	113.8	R844 F845 L846 K868 L877 K880 V881	R844-L848 PolarHBondContact O-N 3.1Å; R844-L848 VanDerWaalsContact O-N 3.12Å; F845-L848 WeakPolarHBondContact O-CB 3.48Å; F845-L848 PolarHBondContact O-N 3.33Å; L846-L848 VanDerWaalsContact C-N 3.29Å; L846-L848 PolarHBondContact O-N 3.44Å; L848-K868 WeakPolarHBondContact O-CE 3.46Å; L848-K868 PolarHBondContact O-NZ 3.29Å; L848-L877 HydrophobicContact CD2-CD2 3.8Å; L848-K880 HydrophobicContact CD2-CB 4.33Å; L848-V881 HydrophobicContact CD2-CG1 3.98Å
849	V	91.8	Very high	90.9	Very high	16 Å²	16	49.4 Å²	49.4	10%	0.097	30%	0.298	C	S	.	.	H	α-helix	trans	-93.7	-9.1	175.8	-54	0	0	0	0	113.5	F845 L846 L861 V865 K868	F845-V849 HydrophobicContact CD1-CG1 4.47Å; F845-V849 HydrophobicContact CD2-CG1 4.38Å; F845-V849 HydrophobicContact CE1-CG1 3.96Å; F845-V849 HydrophobicContact CE2-CG1 3.85Å; F845-V849 HydrophobicContact CZ-CG1 3.62Å; F845-V849 PolarHBondContact O-N 3.05Å; F845-V849 VanDerWaalsContact O-N 3.07Å; L846-V849 WeakPolarHBondContact O-CG2 3.44Å; L846-V849 PolarHBondContact O-N 2.95Å; V849-L861 HydrophobicContact CG2-CD1 4.25Å; V849-V865 HydrophobicContact CG1-CG2 4.35Å; V849-V865 HydrophobicContact CG2-CG2 4.12Å; V849-K868 HydrophobicContact CG1-CB 3.86Å; V849-K868 HydrophobicContact CG1-CG 4.03Å
850	G	87.6	Confident	90.6	Very high	65 Å²	65	50.1 Å²	50.1	67%	0.67	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	26.4	-179.3	0	0	0	0	0	114.6	L846	L846-G850 PolarHBondContact O-N 3.06Å
851	G	87.8	Confident	90.4	Very high	17 Å²	17	46.3 Å²	46.3	18%	0.175	30%	0.297	C	S	.	.			trans	-105	158.7	-179.6	0	0	0	0	0	114	L846	L846-G851 PolarHBondContact O-N 3.14Å
852	S	88.8	Confident	90.2	Very high	47 Å²	47	50.8 Å²	50.8	33%	0.329	32%	0.316	S	S	.	.			trans	-99.5	157.6	169.9	-168.4	0	0	0	0	112.4	D854 Q855	S852-D854 PolarHBondContact O-N 3.25Å; S852-D854 PolarHBondContact OG-OD2 3.2Å; S852-Q855 WeakPolarHBondContact O-CB 3.29Å; S852-Q855 PolarHBondContact O-N 2.82Å; S852-Q855 VanDerWaalsContact O-N 3.12Å
853	V	84.4	Confident	90	Very high	38 Å²	38	56.8 Å²	56.8	23%	0.23	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-63.4	-26.7	172.8	-161.7	0	0	0	0	111.4	P828 L829 L846 Q855 I856	P828-V853 HydrophobicContact CB-CG1 3.94Å; P828-V853 HydrophobicContact CG-CG1 3.88Å; L829-V853 HydrophobicContact CD2-CG1 4.38Å; L829-V853 HydrophobicContact CG-CG1 4.16Å; L846-V853 HydrophobicContact CD1-CB 4.42Å; L846-V853 HydrophobicContact CD1-CG2 3.9Å; V853-Q855 PolarHBondContact O-N 3.39Å; V853-I856 HydrophobicContact CG1-CD1 3.94Å; V853-I856 VanDerWaalsContact O-CD1 3.26Å; V853-I856 WeakPolarHBondContact O-CD1 3.34Å; V853-I856 VanDerWaalsContact O-CG1 3.24Å; V853-I856 WeakPolarHBondContact O-CG1 3.43Å
854	D	84.5	Confident	89.8	Confident	137 Å²	137	54.2 Å²	54.2	73%	0.733	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-73.1	-12.7	176.4	-43.1	-72.7	0	0	0	113.3	S852	S852-D854 PolarHBondContact O-N 3.25Å; S852-D854 PolarHBondContact OG-OD2 3.2Å
855	Q	87	Confident	89.6	Confident	82 Å²	82	49.7 Å²	49.7	38%	0.383	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-96.6	8.7	-176.7	-63.2	175.3	-32.3	0	0	113.2	S852 V853 G857 S858 L861	S852-Q855 WeakPolarHBondContact O-CB 3.29Å; S852-Q855 PolarHBondContact O-N 2.82Å; S852-Q855 VanDerWaalsContact O-N 3.12Å; V853-Q855 PolarHBondContact O-N 3.39Å; Q855-G857 PolarHBondContact O-N 3.03Å; Q855-S858 WeakPolarHBondContact O-CB 3.35Å; Q855-S858 PolarHBondContact O-N 3Å; Q855-S858 PolarHBondContact O-OG 3.19Å; Q855-L861 HydrophobicContact CB-CB 4Å; Q855-L861 HydrophobicContact CB-CD2 4.42Å; Q855-L861 VanDerWaalsContact O-CB 3.31Å; Q855-L861 WeakPolarHBondContact O-CB 3.39Å; Q855-L861 WeakPolarHBondContact O-CD2 3.2Å
856	I	88.9	Confident	89.4	Confident	24 Å²	24	54 Å²	54	12%	0.123	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	130.1	179.2	-71.6	167.9	0	0	0	110.9	P828 L829 T832 V853 S858 L895	P828-I856 HydrophobicContact CB-CD1 4.16Å; L829-I856 HydrophobicContact CD2-CD1 3.86Å; T832-I856 HydrophobicContact CG2-CD1 4.33Å; T832-I856 HydrophobicContact CG2-CG2 3.97Å; V853-I856 HydrophobicContact CG1-CD1 3.94Å; V853-I856 VanDerWaalsContact O-CD1 3.26Å; V853-I856 WeakPolarHBondContact O-CD1 3.34Å; V853-I856 VanDerWaalsContact O-CG1 3.24Å; V853-I856 WeakPolarHBondContact O-CG1 3.43Å; I856-S858 PolarHBondContact O-N 2.99Å; I856-L895 HydrophobicContact CD1-CD2 4.14Å; I856-L895 HydrophobicContact CG1-CD2 3.87Å
857	G	86.1	Confident	89.2	Confident	19 Å²	19	56.6 Å²	56.6	20%	0.196	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	4.1	-177.8	0	0	0	0	0	115.8	Q855 L895 Q897	Q855-G857 PolarHBondContact O-N 3.03Å; G857-L895 PolarHBondContact N-O 2.94Å; G857-Q897 WeakPolarHBondContact CA-O 3.48Å
858	S	89.7	Confident	89.1	Confident	41 Å²	41	55 Å²	55	29%	0.287	34%	0.339	S	S	.	.			trans	-77.5	150.2	174.7	75.5	0	0	0	0	112	Q855 I856 G860 L861 K862	Q855-S858 WeakPolarHBondContact O-CB 3.35Å; Q855-S858 PolarHBondContact O-N 3Å; Q855-S858 PolarHBondContact O-OG 3.19Å; I856-S858 PolarHBondContact O-N 2.99Å; S858-G860 PolarHBondContact O-N 3.38Å; S858-L861 PolarHBondContact O-N 2.91Å; S858-L861 PolarHBondContact OG-N 3.38Å; S858-K862 PolarHBondContact O-N 2.89Å
859	A	89.2	Confident	88.9	Confident	85 Å²	85	54.3 Å²	54.3	70%	0.702	34%	0.337	S	S	*	.	H	α-helix	trans	-60.9	-33.2	175.2	0	0	0	0	0	112.6	K862 H863	A859-K862 PolarHBondContact O-N 3.09Å; A859-H863 WeakPolarHBondContact O-CB 3.49Å; A859-H863 PolarHBondContact O-N 2.82Å
860	G	89.8	Confident	88.7	Confident	44 Å²	44	60.1 Å²	60.1	45%	0.454	37%	0.367	S	S	.	.	H	α-helix	trans	-63.7	-51.5	176.5	0	0	0	0	0	112.2	S858 K862 H863 C864	S858-G860 PolarHBondContact O-N 3.38Å; G860-K862 VanDerWaalsContact C-N 3.32Å; G860-K862 PolarHBondContact O-N 3.14Å; G860-H863 PolarHBondContact O-N 3.43Å; G860-C864 PolarHBondContact O-N 3.29Å; G860-C864 PolarHBondContact O-SG 2.89Å
861	L	90.5	Very high	88.8	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-61.4	-42.1	176.7	179.6	62	0	0	0	111.5	L846 V849 Q855 S858 H863 C864 V865 L895	L846-L861 HydrophobicContact CD2-CD1 3.73Å; L846-L861 HydrophobicContact CD2-CD2 4.08Å; V849-L861 HydrophobicContact CG2-CD1 4.25Å; Q855-L861 HydrophobicContact CB-CB 4Å; Q855-L861 HydrophobicContact CB-CD2 4.42Å; Q855-L861 VanDerWaalsContact O-CB 3.31Å; Q855-L861 WeakPolarHBondContact O-CB 3.39Å; Q855-L861 WeakPolarHBondContact O-CD2 3.2Å; S858-L861 PolarHBondContact O-N 2.91Å; S858-L861 PolarHBondContact OG-N 3.38Å; L861-H863 PolarHBondContact O-N 3.4Å; L861-C864 PolarHBondContact O-N 3.16Å; L861-V865 HydrophobicContact CD1-CG2 4.21Å; L861-V865 HydrophobicContact CG-CG2 4.41Å; L861-V865 WeakPolarHBondContact O-CG2 3.01Å; L861-V865 PolarHBondContact O-N 3.31Å; L861-L895 HydrophobicContact CD2-CB 4.35Å
862	K	91.2	Very high	88.7	Confident	96 Å²	96	62.4 Å²	62.4	42%	0.417	37%	0.365	S	S	.	.	H	α-helix	trans	-57.1	-47.3	176.7	-178.5	174.5	171.6	177.7	0	111.7	S858 A859 G860 C864 V865 E866 T896	S858-K862 PolarHBondContact O-N 2.89Å; A859-K862 PolarHBondContact O-N 3.09Å; G860-K862 VanDerWaalsContact C-N 3.32Å; G860-K862 PolarHBondContact O-N 3.14Å; K862-C864 PolarHBondContact O-N 3.37Å; K862-V865 PolarHBondContact O-N 3.16Å; K862-E866 WeakPolarHBondContact CE-OE1 3.19Å; K862-E866 HydrophobicContact CG-CG 4.4Å; K862-E866 IonicContact NZ-OE1 2.68Å; K862-E866 WeakPolarHBondContact O-CB 3.37Å; K862-E866 WeakPolarHBondContact O-CG 3.02Å; K862-E866 PolarHBondContact O-N 3.41Å; K862-T896 HydrophobicContact CB-CG2 4.43Å; K862-T896 HydrophobicContact CG-CG2 4.42Å
863	H	89.9	Confident	88.7	Confident	126 Å²	126	62.9 Å²	62.9	58%	0.583	37%	0.368	S	S	*	.	H	α-helix	trans	-62.3	-41.1	176.3	-178.8	-89.3	0	0	0	112.7	A859 G860 L861 V865 E866 S867	A859-H863 WeakPolarHBondContact O-CB 3.49Å; A859-H863 PolarHBondContact O-N 2.82Å; G860-H863 PolarHBondContact O-N 3.43Å; L861-H863 PolarHBondContact O-N 3.4Å; H863-V865 PolarHBondContact O-N 3.17Å; H863-E866 PolarHBondContact O-N 3.17Å; H863-S867 VanDerWaalsContact O-CB 3.23Å; H863-S867 WeakPolarHBondContact O-CB 3.2Å; H863-S867 PolarHBondContact O-N 3Å
864	C	91	Very high	89	Confident	46 Å²	46	63.3 Å²	63.3	31%	0.311	37%	0.369	S	S	.	.	H	α-helix	trans	-61.1	-43	175.3	-66.9	0	0	0	0	112.3	G860 L861 K862 K868	G860-C864 PolarHBondContact O-N 3.29Å; G860-C864 PolarHBondContact O-SG 2.89Å; L861-C864 PolarHBondContact O-N 3.16Å; K862-C864 PolarHBondContact O-N 3.37Å; C864-K868 PolarHBondContact O-N 3.35Å; C864-K868 VanDerWaalsContact O-N 3.08Å
865	V	90.8	Very high	89.3	Confident	3 Å²	3	62 Å²	62	2%	0.018	36%	0.358	C	S	.	.	H	α-helix	trans	-66.4	-48.5	176.7	172.7	0	0	0	0	111.3	F845 V849 L861 K862 H863 S867 K868 V869 I892 T896	F845-V865 HydrophobicContact CE1-CG1 4.24Å; F845-V865 HydrophobicContact CE1-CG2 4.07Å; F845-V865 HydrophobicContact CZ-CG1 4.2Å; V849-V865 HydrophobicContact CG1-CG2 4.35Å; V849-V865 HydrophobicContact CG2-CG2 4.12Å; L861-V865 HydrophobicContact CD1-CG2 4.21Å; L861-V865 HydrophobicContact CG-CG2 4.41Å; L861-V865 WeakPolarHBondContact O-CG2 3.01Å; L861-V865 PolarHBondContact O-N 3.31Å; K862-V865 PolarHBondContact O-N 3.16Å; H863-V865 PolarHBondContact O-N 3.17Å; V865-S867 PolarHBondContact O-N 3.42Å; V865-K868 PolarHBondContact O-N 2.65Å; V865-V869 HydrophobicContact CG1-CG2 4.3Å; V865-V869 WeakPolarHBondContact O-CG2 3.44Å; V865-V869 PolarHBondContact O-N 3.23Å; V865-I892 HydrophobicContact CG1-CG1 4.13Å; V865-I892 HydrophobicContact CG1-CG2 3.85Å; V865-T896 HydrophobicContact CB-CG2 4.12Å; V865-T896 HydrophobicContact CG1-CG2 4.08Å; V865-T896 HydrophobicContact CG2-CG2 4.24Å
866	E	89.9	Confident	89.6	Confident	90 Å²	90	62.6 Å²	62.6	42%	0.421	36%	0.361	S	S	.	.	H	α-helix	trans	-60	-44.7	177.9	-73.9	173.7	166.3	0	0	111.6	K862 H863 K868 V869 N870	K862-E866 WeakPolarHBondContact CE-OE1 3.19Å; K862-E866 HydrophobicContact CG-CG 4.4Å; K862-E866 IonicContact NZ-OE1 2.68Å; K862-E866 WeakPolarHBondContact O-CB 3.37Å; K862-E866 WeakPolarHBondContact O-CG 3.02Å; K862-E866 PolarHBondContact O-N 3.41Å; H863-E866 PolarHBondContact O-N 3.17Å; E866-K868 VanDerWaalsContact C-N 3.34Å; E866-K868 PolarHBondContact O-N 2.9Å; E866-V869 PolarHBondContact O-N 3.36Å; E866-N870 WeakPolarHBondContact O-CB 3.44Å; E866-N870 PolarHBondContact O-N 2.8Å; E866-N870 PolarHBondContact O-ND2 2.88Å
867	S	89.9	Confident	89.7	Confident	59 Å²	59	61.5 Å²	61.5	41%	0.413	36%	0.355	S	S	.	.	H	α-helix	trans	-57.9	-44.3	174.4	179.4	0	0	0	0	112.1	H863 V865 T871	H863-S867 VanDerWaalsContact O-CB 3.23Å; H863-S867 WeakPolarHBondContact O-CB 3.2Å; H863-S867 PolarHBondContact O-N 3Å; V865-S867 PolarHBondContact O-N 3.42Å; S867-T871 WeakPolarHBondContact O-CB 3.31Å; S867-T871 PolarHBondContact O-N 2.87Å; S867-T871 VanDerWaalsContact O-N 3.14Å; S867-T871 PolarHBondContact O-OG1 3.24Å
868	K	90.1	Very high	90	Very high	68 Å²	68	60.6 Å²	60.6	30%	0.296	35%	0.346	S	S	.	.	H	α-helix	trans	-67.3	-43.8	178.5	-158.2	80.6	-179.6	-155.2	0	112.7	L848 V849 C864 V865 E866 N870 T871 S872 L877	L848-K868 WeakPolarHBondContact O-CE 3.46Å; L848-K868 PolarHBondContact O-NZ 3.29Å; V849-K868 HydrophobicContact CG1-CB 3.86Å; V849-K868 HydrophobicContact CG1-CG 4.03Å; C864-K868 PolarHBondContact O-N 3.35Å; C864-K868 VanDerWaalsContact O-N 3.08Å; V865-K868 PolarHBondContact O-N 2.65Å; E866-K868 VanDerWaalsContact C-N 3.34Å; E866-K868 PolarHBondContact O-N 2.9Å; K868-N870 VanDerWaalsContact C-N 3.32Å; K868-N870 PolarHBondContact O-N 2.99Å; K868-T871 CarbonylContact O-C 3.56Å; K868-T871 PolarHBondContact O-N 3.31Å; K868-T871 VanDerWaalsContact O-N 3.12Å; K868-S872 PolarHBondContact O-N 2.86Å; K868-L877 HydrophobicContact CG-CD1 4.47Å; K868-L877 HydrophobicContact CG-CD2 4.04Å
869	V	88.6	Confident	90.2	Very high	38 Å²	38	66.8 Å²	66.8	23%	0.23	37%	0.368	C	S	.	.	H	α-helix	trans	-67.5	-32.4	179.6	172.9	0	0	0	0	111.8	V865 E866 T871 S872 I874 L877 I892	V865-V869 HydrophobicContact CG1-CG2 4.3Å; V865-V869 WeakPolarHBondContact O-CG2 3.44Å; V865-V869 PolarHBondContact O-N 3.23Å; E866-V869 PolarHBondContact O-N 3.36Å; V869-T871 VanDerWaalsContact C-N 3.32Å; V869-S872 CarbonylContact C-O 3.55Å; V869-S872 WeakPolarHBondContact CA-O 3.37Å; V869-S872 CarbonylContact O-C 3.53Å; V869-I874 HydrophobicContact CG1-CD1 4.45Å; V869-I874 HydrophobicContact CG1-CG1 4.04Å; V869-L877 HydrophobicContact CG2-CD1 3.99Å; V869-I892 HydrophobicContact CG2-CD1 4Å
870	N	87.6	Confident	90.4	Very high	138 Å²	138	68.3 Å²	68.3	74%	0.738	36%	0.359	S	S	*	.	H	α-helix	trans	-71.8	-26.3	172.2	-69.2	-21.9	0	0	0	112.8	E866 K868	E866-N870 WeakPolarHBondContact O-CB 3.44Å; E866-N870 PolarHBondContact O-N 2.8Å; E866-N870 PolarHBondContact O-ND2 2.88Å; K868-N870 VanDerWaalsContact C-N 3.32Å; K868-N870 PolarHBondContact O-N 2.99Å
871	T	88.3	Confident	90.5	Very high	107 Å²	107	66.4 Å²	66.4	66%	0.656	34%	0.338	S	S	*	.	H	α-helix	trans	-91.6	-20.1	-179.4	-50.5	0	0	0	0	113.1	S867 K868 V869	S867-T871 WeakPolarHBondContact O-CB 3.31Å; S867-T871 PolarHBondContact O-N 2.87Å; S867-T871 VanDerWaalsContact O-N 3.14Å; S867-T871 PolarHBondContact O-OG1 3.24Å; K868-T871 CarbonylContact O-C 3.56Å; K868-T871 PolarHBondContact O-N 3.31Å; K868-T871 VanDerWaalsContact O-N 3.12Å; V869-T871 VanDerWaalsContact C-N 3.32Å
872	S	86.6	Confident	90.6	Very high	22 Å²	22	72.2 Å²	72.2	15%	0.154	37%	0.369	C	S	.	.	S	Bend	trans	-149.7	129.1	178.7	-63.7	0	0	0	0	109.4	K868 V869 L877	K868-S872 PolarHBondContact O-N 2.86Å; V869-S872 CarbonylContact C-O 3.55Å; V869-S872 WeakPolarHBondContact CA-O 3.37Å; V869-S872 CarbonylContact O-C 3.53Å; S872-L877 VanDerWaalsContact O-CD1 3.29Å; S872-L877 WeakPolarHBondContact O-CD1 3.17Å
873	C	88.6	Confident	90.7	Very high	57 Å²	57	68.6 Å²	68.6	39%	0.385	36%	0.356	S	S	.	.			trans	-62.5	157.3	-178.3	65.6	0	0	0	0	112.5	E875 E876 L877	C873-E875 PolarHBondContact O-N 2.88Å; C873-E876 PolarHBondContact O-N 2.92Å; C873-E876 VanDerWaalsContact O-N 3.12Å; C873-L877 WeakPolarHBondContact O-CG 3.47Å; C873-L877 PolarHBondContact O-N 2.91Å
874	I	90.4	Very high	90.8	Very high	48 Å²	48	64.9 Å²	64.9	25%	0.246	34%	0.341	C	S	.	.	H	α-helix	trans	-59.4	-35.8	-176.4	-63.6	172.4	0	0	0	110.6	V869 L877 A878 P885 L888	V869-I874 HydrophobicContact CG1-CD1 4.45Å; V869-I874 HydrophobicContact CG1-CG1 4.04Å; I874-L877 PolarHBondContact O-N 2.99Å; I874-A878 VanDerWaalsContact O-CB 3.23Å; I874-A878 WeakPolarHBondContact O-CB 3.25Å; I874-A878 PolarHBondContact O-N 3.42Å; I874-P885 HydrophobicContact CG2-CB 4.3Å; I874-L888 HydrophobicContact CG2-CD2 4.3Å
875	E	91.9	Very high	90.9	Very high	110 Å²	110	64.9 Å²	64.9	51%	0.514	34%	0.341	S	S	.	.	H	α-helix	trans	-65.3	-36.9	178.9	-63.3	80.6	178.6	0	0	113	C873 K879 P885	C873-E875 PolarHBondContact O-N 2.88Å; E875-K879 WeakPolarHBondContact O-CG 3.44Å; E875-K879 PolarHBondContact O-N 3.39Å; E875-P885 HydrophobicContact CG-CG 4.28Å
876	E	91.9	Very high	91	Very high	94 Å²	94	66.9 Å²	66.9	44%	0.439	35%	0.35	S	S	.	.	H	α-helix	trans	-73.1	-42.5	173.1	-82.2	-176.4	-152.5	0	0	112.1	C873 A878 K879 K880	C873-E876 PolarHBondContact O-N 2.92Å; C873-E876 VanDerWaalsContact O-N 3.12Å; E876-A878 VanDerWaalsContact C-N 3.3Å; E876-A878 PolarHBondContact O-N 2.82Å; E876-K879 PolarHBondContact O-N 3.11Å; E876-K880 VanDerWaalsContact O-CG 3.3Å; E876-K880 WeakPolarHBondContact O-CG 3.33Å; E876-K880 PolarHBondContact O-N 3.13Å; E876-K880 IonicContact OE2-NZ 3.7Å; E876-K880 PolarHBondContact OE2-NZ 2.86Å
877	L	92.1	Very high	91.2	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-62.9	-40.6	178.4	-67.9	172.5	0	0	0	110.7	F845 L848 K868 V869 S872 C873 I874 K880 V881 L888	F845-L877 HydrophobicContact CE2-CD1 4.44Å; L848-L877 HydrophobicContact CD2-CD2 3.8Å; K868-L877 HydrophobicContact CG-CD1 4.47Å; K868-L877 HydrophobicContact CG-CD2 4.04Å; V869-L877 HydrophobicContact CG2-CD1 3.99Å; S872-L877 VanDerWaalsContact O-CD1 3.29Å; S872-L877 WeakPolarHBondContact O-CD1 3.17Å; C873-L877 WeakPolarHBondContact O-CG 3.47Å; C873-L877 PolarHBondContact O-N 2.91Å; I874-L877 PolarHBondContact O-N 2.99Å; L877-K880 PolarHBondContact O-N 3.45Å; L877-K880 VanDerWaalsContact O-N 3.16Å; L877-V881 WeakPolarHBondContact O-CG2 3.38Å; L877-V881 PolarHBondContact O-N 2.83Å; L877-V881 VanDerWaalsContact O-N 3.08Å; L877-L888 HydrophobicContact CB-CD2 3.55Å
878	A	92.8	Very high	91.5	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.008	32%	0.32	C	S	.	.	H	α-helix	trans	-61.1	-45.7	176.7	0	0	0	0	0	111.6	I874 E876 K880 V881 D882 T883 P885 L888	I874-A878 VanDerWaalsContact O-CB 3.23Å; I874-A878 WeakPolarHBondContact O-CB 3.25Å; I874-A878 PolarHBondContact O-N 3.42Å; E876-A878 VanDerWaalsContact C-N 3.3Å; E876-A878 PolarHBondContact O-N 2.82Å; A878-K880 VanDerWaalsContact C-N 3.35Å; A878-K880 PolarHBondContact O-N 3.35Å; A878-V881 PolarHBondContact O-N 2.86Å; A878-D882 PolarHBondContact O-N 3.4Å; A878-D882 VanDerWaalsContact O-N 3.1Å; A878-T883 CarbonylContact C-O 3.49Å; A878-T883 HydrophobicContact CB-CG2 4.24Å; A878-T883 WeakPolarHBondContact CB-O 3.42Å; A878-T883 PolarHBondContact O-N 3.34Å; A878-P885 HydrophobicContact CB-CG 4.32Å; A878-L888 HydrophobicContact CB-CB 4.21Å; A878-L888 HydrophobicContact CB-CD2 3.98Å; A878-L888 VanDerWaalsContact N-CD2 3.31Å
879	K	93.6	Very high	91.7	Very high	170 Å²	170	62.8 Å²	62.8	74%	0.739	33%	0.326	S	S	*	.	H	α-helix	trans	-61.1	-39.2	172.5	-71.4	172.8	-178.1	178.9	0	112.9	E875 E876 V881 D882	E875-K879 WeakPolarHBondContact O-CG 3.44Å; E875-K879 PolarHBondContact O-N 3.39Å; E876-K879 PolarHBondContact O-N 3.11Å; K879-V881 VanDerWaalsContact C-N 3.32Å; K879-V881 PolarHBondContact O-N 2.92Å; K879-D882 PolarHBondContact O-N 3.44Å
880	K	92.8	Very high	92	Very high	117 Å²	117	62.4 Å²	62.4	51%	0.509	32%	0.323	S	S	.	.	H	α-helix	trans	-67	-29.8	179.4	-73.9	164.9	-171.7	159.5	0	112.8	L848 E876 L877 A878	L848-K880 HydrophobicContact CD2-CB 4.33Å; E876-K880 VanDerWaalsContact O-CG 3.3Å; E876-K880 WeakPolarHBondContact O-CG 3.33Å; E876-K880 PolarHBondContact O-N 3.13Å; E876-K880 IonicContact OE2-NZ 3.7Å; E876-K880 PolarHBondContact OE2-NZ 2.86Å; L877-K880 PolarHBondContact O-N 3.45Å; L877-K880 VanDerWaalsContact O-N 3.16Å; A878-K880 VanDerWaalsContact C-N 3.35Å; A878-K880 PolarHBondContact O-N 3.35Å
881	V	92.8	Very high	92.3	Very high	4 Å²	4	56 Å²	56	2%	0.024	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	10	177.6	-54.1	0	0	0	0	114	V841 R844 F845 L848 L877 A878 K879 T883 L888	V841-V881 HydrophobicContact CG1-CB 4.3Å; V841-V881 HydrophobicContact CG1-CG2 3.75Å; R844-V881 HydrophobicContact CB-CB 4.32Å; R844-V881 HydrophobicContact CB-CG1 4.31Å; R844-V881 VanDerWaalsContact CZ-O 3.23Å; R844-V881 PolarHBondContact NE-O 3.16Å; R844-V881 PolarHBondContact NH2-O 3.28Å; F845-V881 HydrophobicContact CB-CG1 4.25Å; F845-V881 HydrophobicContact CD2-CG1 4.37Å; L848-V881 HydrophobicContact CD2-CG1 3.98Å; L877-V881 WeakPolarHBondContact O-CG2 3.38Å; L877-V881 PolarHBondContact O-N 2.83Å; L877-V881 VanDerWaalsContact O-N 3.08Å; A878-V881 PolarHBondContact O-N 2.86Å; K879-V881 VanDerWaalsContact C-N 3.32Å; K879-V881 PolarHBondContact O-N 2.92Å; V881-T883 HydrophobicContact CG2-CG2 3.57Å; V881-L888 HydrophobicContact CG2-CD1 4.35Å
882	D	92	Very high	92.6	Very high	122 Å²	122	51.9 Å²	51.9	65%	0.652	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	64	-178.4	-153	20.3	0	0	0	112.4	A878 K879	A878-D882 PolarHBondContact O-N 3.4Å; A878-D882 VanDerWaalsContact O-N 3.1Å; K879-D882 PolarHBondContact O-N 3.44Å
883	T	93.9	Very high	92.9	Very high	21 Å²	21	53.9 Å²	53.9	13%	0.129	27%	0.271	C	S	.	.	S	Bend	trans	-154.7	178.4	177.6	-157.1	0	0	0	0	111.6	V841 A878 V881 T887 L888	V841-T883 HydrophobicContact CG1-CG2 3.73Å; A878-T883 CarbonylContact C-O 3.49Å; A878-T883 HydrophobicContact CB-CG2 4.24Å; A878-T883 WeakPolarHBondContact CB-O 3.42Å; A878-T883 PolarHBondContact O-N 3.34Å; V881-T883 HydrophobicContact CG2-CG2 3.57Å; T883-T887 WeakPolarHBondContact OG1-CG2 3.4Å; T883-L888 HydrophobicContact CG2-CB 3.85Å
884	T	92.3	Very high	93.1	Very high	47 Å²	47	51.3 Å²	51.3	29%	0.288	25%	0.254	S	S	.	.			trans	-91.5	152.9	179.5	87.7	0	0	0	0	112.7	E256 E886 T887 L888	E256-T884 VanDerWaalsContact CD-CB 3.44Å; E256-T884 VanDerWaalsContact CD-OG1 3.23Å; E256-T884 WeakPolarHBondContact OE1-CB 3.27Å; E256-T884 PolarHBondContact OE1-OG1 3.06Å; E256-T884 VanDerWaalsContact OE2-CB 3.3Å; E256-T884 WeakPolarHBondContact OE2-CB 3.43Å; T884-E886 PolarHBondContact O-N 3.42Å; T884-T887 PolarHBondContact O-N 3.44Å; T884-T887 VanDerWaalsContact O-N 3.16Å; T884-T887 WeakPolarHBondContact OG1-CB 3.47Å; T884-T887 PolarHBondContact OG1-N 2.8Å; T884-T887 PolarHBondContact OG1-OG1 2.8Å; T884-L888 PolarHBondContact O-N 2.92Å
885	P	93.2	Very high	93.2	Very high	47 Å²	47	49 Å²	49	31%	0.305	24%	0.242	S	C	.	.	H	α-helix	trans	-58.3	-38.8	-178	-26.4	35.9	0	0	0	114.8	E256 I874 E875 A878 K889	E256-P885 WeakPolarHBondContact OE1-CD 3.49Å; I874-P885 HydrophobicContact CG2-CB 4.3Å; E875-P885 HydrophobicContact CG-CG 4.28Å; A878-P885 HydrophobicContact CB-CG 4.32Å; P885-K889 WeakPolarHBondContact O-CB 3.36Å; P885-K889 PolarHBondContact O-N 2.81Å
886	E	92.4	Very high	93.2	Very high	44 Å²	44	45.3 Å²	45.3	21%	0.206	23%	0.227	C	C	.	.	H	α-helix	trans	-70.9	-35.9	177	-66.3	-74.2	179.8	0	0	111.8	K255 E256 H260 T884 K889 L890	K255-E886 HydrophobicContact CD-CB 4.49Å; K255-E886 HydrophobicContact CD-CG 4.29Å; K255-E886 WeakPolarHBondContact CE-OE2 3.39Å; K255-E886 IonicContact NZ-OE1 3.39Å; K255-E886 PolarHBondContact NZ-OE1 2.57Å; K255-E886 IonicContact NZ-OE2 3.83Å; K255-E886 PolarHBondContact NZ-OE2 2.89Å; E256-E886 HydrophobicContact CG-CB 3.91Å; E256-E886 HydrophobicContact CG-CG 3.61Å; E256-E886 VanDerWaalsContact OE1-CB 3.28Å; E256-E886 WeakPolarHBondContact OE1-CB 3.43Å; E256-E886 WeakPolarHBondContact OE1-CG 3.41Å; E256-E886 PolarHBondContact OE1-N 2.99Å; H260-E886 IonicContact CE1-OE1 3.79Å; H260-E886 PolarHBondContact CE1-OE1 3.22Å; H260-E886 IonicContact ND1-OE1 2.75Å; H260-E886 PolarHBondContact ND1-OE1 2.85Å; T884-E886 PolarHBondContact O-N 3.42Å; E886-K889 PolarHBondContact O-N 3.33Å; E886-L890 PolarHBondContact O-N 2.92Å
887	T	94.2	Very high	93.1	Very high	32 Å²	32	43.3 Å²	43.3	20%	0.196	22%	0.218	C	C	.	.	H	α-helix	trans	-66.8	-44.6	176.5	-54.2	0	0	0	0	110.5	T883 T884 K889 L890 I891	T883-T887 WeakPolarHBondContact OG1-CG2 3.4Å; T884-T887 PolarHBondContact O-N 3.44Å; T884-T887 VanDerWaalsContact O-N 3.16Å; T884-T887 WeakPolarHBondContact OG1-CB 3.47Å; T884-T887 PolarHBondContact OG1-N 2.8Å; T884-T887 PolarHBondContact OG1-OG1 2.8Å; T887-K889 VanDerWaalsContact C-N 3.33Å; T887-K889 PolarHBondContact O-N 2.92Å; T887-L890 PolarHBondContact O-N 3.49Å; T887-I891 HydrophobicContact CG2-CD1 4.43Å; T887-I891 WeakPolarHBondContact O-CG1 3.23Å; T887-I891 PolarHBondContact O-N 2.8Å
888	L	95.3	Very high	92.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.6	-39.9	173.6	179.4	58.6	0	0	0	111.8	F845 I874 L877 A878 V881 T883 T884 L890 I891 I892	F845-L888 HydrophobicContact CB-CD1 4.36Å; F845-L888 HydrophobicContact CD1-CD1 4.28Å; F845-L888 HydrophobicContact CD2-CD1 3.6Å; F845-L888 HydrophobicContact CE2-CD1 3.89Å; F845-L888 HydrophobicContact CE2-CD2 4.45Å; F845-L888 HydrophobicContact CG-CD1 3.81Å; F845-L888 HydrophobicContact CZ-CD1 4.35Å; I874-L888 HydrophobicContact CG2-CD2 4.3Å; L877-L888 HydrophobicContact CB-CD2 3.55Å; A878-L888 HydrophobicContact CB-CB 4.21Å; A878-L888 HydrophobicContact CB-CD2 3.98Å; A878-L888 VanDerWaalsContact N-CD2 3.31Å; V881-L888 HydrophobicContact CG2-CD1 4.35Å; T883-L888 HydrophobicContact CG2-CB 3.85Å; T884-L888 PolarHBondContact O-N 2.92Å; L888-L890 PolarHBondContact O-N 3.39Å; L888-I891 WeakPolarHBondContact O-CB 3.29Å; L888-I891 PolarHBondContact O-N 2.76Å; L888-I892 HydrophobicContact CD1-CD1 4.27Å; L888-I892 HydrophobicContact CD1-CG1 4.34Å; L888-I892 HydrophobicContact CD2-CD1 4.48Å; L888-I892 HydrophobicContact CG-CD1 3.93Å; L888-I892 HydrophobicContact CG-CG1 4.47Å; L888-I892 WeakPolarHBondContact O-CG1 3.31Å; L888-I892 PolarHBondContact O-N 2.93Å
889	K	94.2	Very high	92.3	Very high	99 Å²	99	50.3 Å²	50.3	43%	0.43	26%	0.263	S	S	.	.	H	α-helix	trans	-61.5	-43.2	176	-175.2	173.6	-179.9	172.9	0	112	P885 E886 T887 I891 I892 D893	P885-K889 WeakPolarHBondContact O-CB 3.36Å; P885-K889 PolarHBondContact O-N 2.81Å; E886-K889 PolarHBondContact O-N 3.33Å; T887-K889 VanDerWaalsContact C-N 3.33Å; T887-K889 PolarHBondContact O-N 2.92Å; K889-I891 VanDerWaalsContact C-N 3.29Å; K889-I891 PolarHBondContact O-N 3.35Å; K889-I892 PolarHBondContact O-N 2.88Å; K889-D893 WeakPolarHBondContact O-CB 3.29Å; K889-D893 VanDerWaalsContact O-CG 3.31Å; K889-D893 PolarHBondContact O-N 2.98Å
890	L	94.4	Very high	91.5	Very high	31 Å²	31	44.2 Å²	44.2	16%	0.162	25%	0.248	C	C	.	.	H	α-helix	trans	-61.7	-37.1	174.5	-176.3	67.2	0	0	0	112.3	R252 Y253 E886 T887 L888 G894	R252-L890 HydrophobicContact CG-CD1 4.12Å; R252-L890 HydrophobicContact CG-CD2 3.92Å; Y253-L890 HydrophobicContact CD1-CD2 3.57Å; Y253-L890 HydrophobicContact CE1-CD2 3.55Å; E886-L890 PolarHBondContact O-N 2.92Å; T887-L890 PolarHBondContact O-N 3.49Å; L888-L890 PolarHBondContact O-N 3.39Å; L890-G894 PolarHBondContact O-N 3.32Å
891	I	95.6	Very high	91.2	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-64.8	-47.3	173.4	-68.9	169.6	0	0	0	111	I834 V841 A842 F845 T887 L888 K889 D893 G894 L895	I834-I891 HydrophobicContact CD1-CB 4.45Å; I834-I891 HydrophobicContact CD1-CG2 4.2Å; I834-I891 HydrophobicContact CG1-CG1 4.46Å; I834-I891 HydrophobicContact CG2-CG1 4.18Å; V841-I891 HydrophobicContact CB-CD1 3.8Å; V841-I891 HydrophobicContact CG1-CD1 3.61Å; A842-I891 HydrophobicContact CB-CD1 4.43Å; A842-I891 HydrophobicContact CB-CG2 3.81Å; F845-I891 HydrophobicContact CD1-CG2 4.33Å; T887-I891 HydrophobicContact CG2-CD1 4.43Å; T887-I891 WeakPolarHBondContact O-CG1 3.23Å; T887-I891 PolarHBondContact O-N 2.8Å; L888-I891 WeakPolarHBondContact O-CB 3.29Å; L888-I891 PolarHBondContact O-N 2.76Å; K889-I891 VanDerWaalsContact C-N 3.29Å; K889-I891 PolarHBondContact O-N 3.35Å; I891-D893 PolarHBondContact O-N 3.45Å; I891-G894 PolarHBondContact O-N 2.91Å; I891-L895 HydrophobicContact CG2-CD1 3.75Å; I891-L895 HydrophobicContact CG2-CG 4.26Å; I891-L895 WeakPolarHBondContact O-CB 3.47Å; I891-L895 VanDerWaalsContact O-CG 3.28Å; I891-L895 WeakPolarHBondContact O-CG 3.38Å; I891-L895 PolarHBondContact O-N 2.89Å
892	I	94.4	Very high	91	Very high	21 Å²	21	40.6 Å²	40.6	11%	0.108	23%	0.233	C	C	.	.	H	α-helix	trans	-57.7	-49	175.9	-74.4	164.5	0	0	0	110.8	F845 V865 V869 L888 K889 G894 L895 T896	F845-I892 HydrophobicContact CD1-CG1 4.49Å; F845-I892 HydrophobicContact CE1-CD1 4.37Å; F845-I892 HydrophobicContact CE1-CG1 3.59Å; F845-I892 HydrophobicContact CZ-CD1 3.89Å; F845-I892 HydrophobicContact CZ-CG1 3.61Å; V865-I892 HydrophobicContact CG1-CG1 4.13Å; V865-I892 HydrophobicContact CG1-CG2 3.85Å; V869-I892 HydrophobicContact CG2-CD1 4Å; L888-I892 HydrophobicContact CD1-CD1 4.27Å; L888-I892 HydrophobicContact CD1-CG1 4.34Å; L888-I892 HydrophobicContact CD2-CD1 4.48Å; L888-I892 HydrophobicContact CG-CD1 3.93Å; L888-I892 HydrophobicContact CG-CG1 4.47Å; L888-I892 WeakPolarHBondContact O-CG1 3.31Å; L888-I892 PolarHBondContact O-N 2.93Å; K889-I892 PolarHBondContact O-N 2.88Å; I892-G894 VanDerWaalsContact C-N 3.34Å; I892-G894 PolarHBondContact O-N 3.25Å; I892-L895 PolarHBondContact O-N 3.21Å; I892-T896 WeakPolarHBondContact O-CB 3.47Å; I892-T896 WeakPolarHBondContact O-CG2 3.33Å; I892-T896 PolarHBondContact O-N 3.06Å; I892-T896 PolarHBondContact O-OG1 3.3Å
893	D	91.9	Very high	90.9	Very high	65 Å²	65	36.9 Å²	36.9	35%	0.348	21%	0.213	S	C	.	.	H	α-helix	trans	-58.7	-46.5	177.3	-71.1	-18.5	0	0	0	110.5	K889 I891 L895 T896 Q897	K889-D893 WeakPolarHBondContact O-CB 3.29Å; K889-D893 VanDerWaalsContact O-CG 3.31Å; K889-D893 PolarHBondContact O-N 2.98Å; I891-D893 PolarHBondContact O-N 3.45Å; D893-L895 PolarHBondContact O-N 3.03Å; D893-T896 PolarHBondContact O-N 2.72Å; D893-Q897 WeakPolarHBondContact O-CB 3.1Å; D893-Q897 VanDerWaalsContact O-CD 3.22Å; D893-Q897 WeakPolarHBondContact O-CG 3.44Å; D893-Q897 PolarHBondContact O-N 3.35Å; D893-Q897 PolarHBondContact O-NE2 2.66Å
894	G	92.2	Very high	90.7	Very high	2 Å²	2	36.1 Å²	36.1	2%	0.021	21%	0.207	C	C	.	.	H	α-helix	trans	-66.8	-33.2	179.6	0	0	0	0	0	115	T832 L890 I891 I892	T832-G894 VanDerWaalsContact CG2-O 3.24Å; T832-G894 WeakPolarHBondContact CG2-O 3.48Å; L890-G894 PolarHBondContact O-N 3.32Å; I891-G894 PolarHBondContact O-N 2.91Å; I892-G894 VanDerWaalsContact C-N 3.34Å; I892-G894 PolarHBondContact O-N 3.25Å
895	L	93.5	Very high	90.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-79.7	-29.1	178.1	-69.9	174.9	0	0	0	113.2	L829 I834 F845 L846 I856 G857 L861 I891 I892 D893	L829-L895 HydrophobicContact CD2-CD2 3.86Å; I834-L895 HydrophobicContact CD1-CD2 4.05Å; I834-L895 HydrophobicContact CD1-CG 3.97Å; F845-L895 HydrophobicContact CD1-CD1 3.9Å; F845-L895 HydrophobicContact CE1-CD1 4.41Å; L846-L895 HydrophobicContact CD1-CD2 4.1Å; L846-L895 HydrophobicContact CD2-CD1 3.91Å; L846-L895 HydrophobicContact CD2-CD2 4.24Å; L846-L895 HydrophobicContact CG-CD1 3.96Å; L846-L895 HydrophobicContact CG-CD2 4.32Å; I856-L895 HydrophobicContact CD1-CD2 4.14Å; I856-L895 HydrophobicContact CG1-CD2 3.87Å; G857-L895 PolarHBondContact N-O 2.94Å; L861-L895 HydrophobicContact CD2-CB 4.35Å; I891-L895 HydrophobicContact CG2-CD1 3.75Å; I891-L895 HydrophobicContact CG2-CG 4.26Å; I891-L895 WeakPolarHBondContact O-CB 3.47Å; I891-L895 VanDerWaalsContact O-CG 3.28Å; I891-L895 WeakPolarHBondContact O-CG 3.38Å; I891-L895 PolarHBondContact O-N 2.89Å; I892-L895 PolarHBondContact O-N 3.21Å; D893-L895 PolarHBondContact O-N 3.03Å
896	T	91.8	Very high	89.6	Confident	32 Å²	32	43.5 Å²	43.5	20%	0.196	24%	0.239	C	C	.	.	H	α-helix	trans	-97.2	-15.4	-175	59.1	0	0	0	0	114.1	K862 V865 I892 D893	K862-T896 HydrophobicContact CB-CG2 4.43Å; K862-T896 HydrophobicContact CG-CG2 4.42Å; V865-T896 HydrophobicContact CB-CG2 4.12Å; V865-T896 HydrophobicContact CG1-CG2 4.08Å; V865-T896 HydrophobicContact CG2-CG2 4.24Å; I892-T896 WeakPolarHBondContact O-CB 3.47Å; I892-T896 WeakPolarHBondContact O-CG2 3.33Å; I892-T896 PolarHBondContact O-N 3.06Å; I892-T896 PolarHBondContact O-OG1 3.3Å; D893-T896 PolarHBondContact O-N 2.72Å
897	Q	90.3	Very high	89.2	Confident	53 Å²	53	44.3 Å²	44.3	25%	0.248	24%	0.242	C	C	.	.	S	Bend	trans	-65.4	139.1	172.4	-82.6	163.1	22.6	0	0	111.7	G857 D893 F901	G857-Q897 WeakPolarHBondContact CA-O 3.48Å; D893-Q897 WeakPolarHBondContact O-CB 3.1Å; D893-Q897 VanDerWaalsContact O-CD 3.22Å; D893-Q897 WeakPolarHBondContact O-CG 3.44Å; D893-Q897 PolarHBondContact O-N 3.35Å; D893-Q897 PolarHBondContact O-NE2 2.66Å; Q897-F901 HydrophobicContact CB-CB 4.03Å; Q897-F901 HydrophobicContact CB-CD1 4.11Å; Q897-F901 HydrophobicContact CB-CG 4.03Å; Q897-F901 VanDerWaalsContact CD-CE1 3.4Å; Q897-F901 HydrophobicContact CG-CB 4.43Å; Q897-F901 HydrophobicContact CG-CD1 3.62Å; Q897-F901 HydrophobicContact CG-CD2 4.32Å; Q897-F901 HydrophobicContact CG-CE1 3.82Å; Q897-F901 HydrophobicContact CG-CG 3.88Å; Q897-F901 HydrophobicContact CG-CZ 4.26Å
898	P	86.9	Confident	88.1	Confident	67 Å²	67	44.4 Å²	44.4	44%	0.435	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-66.6	154.3	179.4	28.3	-35.1	0	0	0	111.9	G900 F901	P898-G900 PolarHBondContact O-N 3.31Å; P898-F901 HydrophobicContact CG-CB 4.23Å; P898-F901 HydrophobicContact CG-CD2 4.18Å; P898-F901 VanDerWaalsContact O-CB 3.26Å; P898-F901 WeakPolarHBondContact O-CB 3.34Å; P898-F901 PolarHBondContact O-N 3.41Å
899	P	80	Confident	87.4	Confident	81 Å²	81	48.9 Å²	48.9	53%	0.526	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	132.9	174.6	-25.8	35.4	0	0	0	111.9	F901	P899-F901 VanDerWaalsContact C-N 3.31Å; P899-F901 PolarHBondContact O-N 2.77Å
900	G	78.4	Confident	86.8	Confident	41 Å²	41	45.1 Å²	45.1	42%	0.423	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	14.6	-177.1	0	0	0	0	0	115.5	P898 D902	P898-G900 PolarHBondContact O-N 3.31Å; G900-D902 PolarHBondContact O-N 3.14Å
901	F	85.9	Confident	86	Confident	40 Å²	40	46.7 Å²	46.7	18%	0.175	27%	0.266	C	S	.	.			trans	-47.9	137.2	174.5	179.9	-108.5	0	0	0	112.5	R789 Q897 P898 P899 I903	R789-F901 PolarHBondContact NH1-O 3.26Å; Q897-F901 HydrophobicContact CB-CB 4.03Å; Q897-F901 HydrophobicContact CB-CD1 4.11Å; Q897-F901 HydrophobicContact CB-CG 4.03Å; Q897-F901 VanDerWaalsContact CD-CE1 3.4Å; Q897-F901 HydrophobicContact CG-CB 4.43Å; Q897-F901 HydrophobicContact CG-CD1 3.62Å; Q897-F901 HydrophobicContact CG-CD2 4.32Å; Q897-F901 HydrophobicContact CG-CE1 3.82Å; Q897-F901 HydrophobicContact CG-CG 3.88Å; Q897-F901 HydrophobicContact CG-CZ 4.26Å; P898-F901 HydrophobicContact CG-CB 4.23Å; P898-F901 HydrophobicContact CG-CD2 4.18Å; P898-F901 VanDerWaalsContact O-CB 3.26Å; P898-F901 WeakPolarHBondContact O-CB 3.34Å; P898-F901 PolarHBondContact O-N 3.41Å; P899-F901 VanDerWaalsContact C-N 3.31Å; P899-F901 PolarHBondContact O-N 2.77Å; F901-I903 HydrophobicContact CE1-CG2 3.84Å
902	D	88.5	Confident	85.4	Confident	5 Å²	5	49.2 Å²	49.2	3%	0.027	28%	0.276	C	S	.	.			trans	-132.4	117.6	-179.5	-166.6	-38.4	0	0	0	107.8	R557 G900 R904 Q905	R557-D902 IonicContact CZ-OD2 2.88Å; R557-D902 IonicContact NH1-OD2 3.9Å; R557-D902 IonicContact NH2-OD2 2.74Å; R557-D902 PolarHBondContact NH2-OD2 3.38Å; G900-D902 PolarHBondContact O-N 3.14Å; D902-R904 PolarHBondContact O-N 3.08Å; D902-R904 VanDerWaalsContact OD1-CB 3.3Å; D902-R904 WeakPolarHBondContact OD1-CB 3.37Å; D902-R904 WeakPolarHBondContact OD1-CG 3.11Å; D902-R904 IonicContact OD1-CZ 2.66Å; D902-R904 PolarHBondContact OD1-N 3.28Å; D902-R904 VanDerWaalsContact OD1-N 3.15Å; D902-R904 IonicContact OD1-NE 3.13Å; D902-R904 PolarHBondContact OD1-NE 2.84Å; D902-R904 IonicContact OD1-NH2 2.65Å; D902-R904 IonicContact OD2-CZ 2.76Å; D902-R904 IonicContact OD2-NE 2.69Å; D902-R904 PolarHBondContact OD2-NE 2.86Å; D902-R904 IonicContact OD2-NH2 3.2Å; D902-R904 PolarHBondContact OD2-NH2 3.08Å; D902-Q905 WeakPolarHBondContact O-CB 3.22Å; D902-Q905 VanDerWaalsContact O-CG 3.31Å; D902-Q905 WeakPolarHBondContact O-CG 3.43Å; D902-Q905 PolarHBondContact O-N 3.39Å
903	I	88.9	Confident	84.8	Confident	45 Å²	45	50.4 Å²	50.4	23%	0.231	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-58.3	-19.5	-176.7	63.1	170.8	0	0	0	112.9	F727 V728 F901 Q905 N906 F907	F727-I903 HydrophobicContact CB-CD1 3.89Å; V728-I903 HydrophobicContact CB-CG1 4.47Å; V728-I903 HydrophobicContact CG2-CD1 3.88Å; V728-I903 HydrophobicContact CG2-CG1 3.75Å; F901-I903 HydrophobicContact CE1-CG2 3.84Å; I903-Q905 PolarHBondContact O-N 3.06Å; I903-N906 PolarHBondContact O-N 3.48Å; I903-F907 WeakPolarHBondContact O-CD2 3.31Å
904	R	90.9	Very high	84.1	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.015	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-70.5	-11.2	177.9	-61	178.3	-69.5	171.9	-0.8	113.4	L552 C554 D686 L688 V728 D902 N906 F907	L552-R904 HydrophobicContact CB-CG 4.36Å; L552-R904 HydrophobicContact CD2-CG 4.1Å; L552-R904 WeakPolarHBondContact O-CB 3.08Å; L552-R904 WeakPolarHBondContact O-CG 3.23Å; C554-R904 VanDerWaalsContact CB-O 3.27Å; C554-R904 WeakPolarHBondContact CB-O 3.41Å; D686-R904 VanDerWaalsContact CG-NH1 3.34Å; D686-R904 IonicContact OD1-CZ 3.09Å; D686-R904 IonicContact OD1-NH1 2.76Å; D686-R904 PolarHBondContact OD1-NH1 2.82Å; D686-R904 IonicContact OD1-NH2 3.48Å; D686-R904 IonicContact OD2-CZ 3.98Å; D686-R904 IonicContact OD2-NH1 3.42Å; D686-R904 PolarHBondContact OD2-NH1 2.76Å; D686-R904 IonicContact OD2-NH2 3.16Å; D686-R904 PolarHBondContact OD2-NH2 2.82Å; L688-R904 VanDerWaalsContact CB-NH1 3.29Å; V728-R904 HydrophobicContact CG2-CG 3.84Å; D902-R904 PolarHBondContact O-N 3.08Å; D902-R904 VanDerWaalsContact OD1-CB 3.3Å; D902-R904 WeakPolarHBondContact OD1-CB 3.37Å; D902-R904 WeakPolarHBondContact OD1-CG 3.11Å; D902-R904 IonicContact OD1-CZ 2.66Å; D902-R904 PolarHBondContact OD1-N 3.28Å; D902-R904 VanDerWaalsContact OD1-N 3.15Å; D902-R904 IonicContact OD1-NE 3.13Å; D902-R904 PolarHBondContact OD1-NE 2.84Å; D902-R904 IonicContact OD1-NH2 2.65Å; D902-R904 IonicContact OD2-CZ 2.76Å; D902-R904 IonicContact OD2-NE 2.69Å; D902-R904 PolarHBondContact OD2-NE 2.86Å; D902-R904 IonicContact OD2-NH2 3.2Å; D902-R904 PolarHBondContact OD2-NH2 3.08Å; R904-N906 PolarHBondContact O-N 3.26Å; R904-F907 WeakPolarHBondContact O-CB 3.23Å; R904-F907 PolarHBondContact O-N 2.81Å
905	Q	85.4	Confident	82.9	Confident	118 Å²	118	54.5 Å²	54.5	55%	0.551	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-59	-25.4	169.4	-69.3	176.6	7.5	0	0	112.6	D902 I903 F907	D902-Q905 WeakPolarHBondContact O-CB 3.22Å; D902-Q905 VanDerWaalsContact O-CG 3.31Å; D902-Q905 WeakPolarHBondContact O-CG 3.43Å; D902-Q905 PolarHBondContact O-N 3.39Å; I903-Q905 PolarHBondContact O-N 3.06Å; Q905-F907 PolarHBondContact O-N 2.88Å
906	N	77.6	Confident	81.5	Confident	131 Å²	131	58.3 Å²	58.3	70%	0.701	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-82.4	5.5	175.9	-61.1	-33.9	0	0	0	113.7	I903 R904	I903-N906 PolarHBondContact O-N 3.48Å; R904-N906 PolarHBondContact O-N 3.26Å
907	F	82.3	Confident	80.2	Confident	62 Å²	62	59.7 Å²	59.7	27%	0.272	33%	0.33	S	S	.	.	S	Bend	trans	-119	154.2	-177.1	-66	-109	0	0	0	110	L552 C554 I903 R904 Q905 Q909	L552-F907 HydrophobicContact CB-CD1 3.7Å; L552-F907 HydrophobicContact CB-CD2 4.4Å; L552-F907 HydrophobicContact CB-CE1 3.55Å; L552-F907 HydrophobicContact CB-CE2 4.26Å; L552-F907 HydrophobicContact CB-CG 4.13Å; L552-F907 HydrophobicContact CB-CZ 3.85Å; L552-F907 HydrophobicContact CD1-CE1 3.74Å; L552-F907 HydrophobicContact CD1-CE2 4.35Å; L552-F907 HydrophobicContact CD1-CZ 3.53Å; L552-F907 HydrophobicContact CG-CE1 4.3Å; L552-F907 HydrophobicContact CG-CZ 4.29Å; L552-F907 WeakPolarHBondContact O-CB 3.37Å; L552-F907 VanDerWaalsContact O-CG 3.3Å; L552-F907 WeakPolarHBondContact O-CG 3.31Å; C554-F907 WeakPolarHBondContact CB-O 3.1Å; I903-F907 WeakPolarHBondContact O-CD2 3.31Å; R904-F907 WeakPolarHBondContact O-CB 3.23Å; R904-F907 PolarHBondContact O-N 2.81Å; Q905-F907 PolarHBondContact O-N 2.88Å; F907-Q909 PolarHBondContact O-N 2.87Å
908	G	72.6	Confident	79.2	Confident	33 Å²	33	59 Å²	59	34%	0.34	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-62.9	130.7	-178.1	0	0	0	0	0	113	C554 R931	C554-G908 PolarHBondContact N-O 3.44Å; G908-R931 VanDerWaalsContact C-NH2 3.3Å; G908-R931 PolarHBondContact O-NH2 2.83Å
909	Q	80	Confident	78.5	Confident	94 Å²	94	57.6 Å²	57.6	44%	0.439	32%	0.319	S	S	.	.	B	Isolated β-bridge	trans	-76.5	165.8	170.1	-169.1	168.1	62.2	0	0	111.2	C554 P555 V556 F907 R931	C554-Q909 HydrophobicContact CB-CB 4.02Å; C554-Q909 HydrophobicContact CB-CG 4.49Å; P555-Q909 PolarHBondContact O-NE2 3.15Å; V556-Q909 HydrophobicContact CG2-CG 3.78Å; F907-Q909 PolarHBondContact O-N 2.87Å; Q909-R931 VanDerWaalsContact O-CZ 3.3Å; Q909-R931 PolarHBondContact O-NH1 3.38Å; Q909-R931 PolarHBondContact O-NH2 3.47Å
910	A	81.1	Confident	78.2	Confident	20 Å²	20	58.9 Å²	58.9	17%	0.165	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-62.4	132.3	172	0	0	0	0	0	112.1	V556 V684 F912	V556-A910 HydrophobicContact CG2-CB 4.43Å; V684-A910 HydrophobicContact CG1-CB 4.07Å; A910-F912 HydrophobicContact CB-CE2 4.18Å; A910-F912 WeakPolarHBondContact O-CD2 3.36Å
911	D	77.9	Confident	78	Confident	65 Å²	65	61.9 Å²	61.9	35%	0.348	34%	0.336	S	S	.	.			trans	-84.5	114.4	-178.8	-60.2	-78.5	0	0	0	110.9	C647 R931	C647-D911 WeakPolarHBondContact CB-O 3.41Å; D911-R931 VanDerWaalsContact OD2-CD 3.25Å; D911-R931 WeakPolarHBondContact OD2-CD 3.27Å; D911-R931 IonicContact OD2-CZ 2.69Å; D911-R931 IonicContact OD2-NE 2.76Å; D911-R931 IonicContact OD2-NH1 3.2Å; D911-R931 PolarHBondContact OD2-NH1 2.69Å
912	F	83.3	Confident	77.8	Confident	54 Å²	54	61 Å²	61	24%	0.237	33%	0.333	C	S	.	.			trans	-90.1	113	178.9	-76.6	-90.2	0	0	0	111.5	V556 K614 Y646 C647 V684 A910	V556-F912 HydrophobicContact CG1-CE2 4.32Å; V556-F912 HydrophobicContact CG2-CE2 4.17Å; K614-F912 HydrophobicContact CB-CD1 4.47Å; K614-F912 HydrophobicContact CB-CE1 3.72Å; K614-F912 HydrophobicContact CB-CZ 4.19Å; K614-F912 HydrophobicContact CD-CE1 4.01Å; K614-F912 HydrophobicContact CD-CE2 4.25Å; K614-F912 HydrophobicContact CD-CZ 3.79Å; K614-F912 HydrophobicContact CG-CD1 4.18Å; K614-F912 HydrophobicContact CG-CE1 3.74Å; K614-F912 HydrophobicContact CG-CZ 4.07Å; Y646-F912 CarbonylContact O-C 3.6Å; Y646-F912 WeakPolarHBondContact O-CA 3.25Å; C647-F912 HydrophobicContact CB-CD1 3.99Å; C647-F912 HydrophobicContact CB-CE1 4.01Å; C647-F912 HydrophobicContact CB-CG 4.24Å; C647-F912 HydrophobicContact CB-CZ 4.29Å; V684-F912 HydrophobicContact CG1-CZ 4.09Å; A910-F912 HydrophobicContact CB-CE2 4.18Å; A910-F912 WeakPolarHBondContact O-CD2 3.36Å
913	K	82.3	Confident	77.5	Confident	47 Å²	47	70.3 Å²	70.3	20%	0.204	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-88.8	161.8	179.5	-60.1	175.7	-175.5	172.9	0	111	Y646 D943	Y646-K913 HydrophobicContact CD1-CB 4.3Å; Y646-K913 WeakPolarHBondContact CD1-O 3.23Å; Y646-K913 HydrophobicContact CE1-CB 3.75Å; Y646-K913 HydrophobicContact CE2-CB 4.11Å; Y646-K913 HydrophobicContact CE2-CD 4.29Å; Y646-K913 PolarHBondContact N-O 2.92Å; Y646-K913 PolarHBondContact O-N 3.04Å; K913-D943 IonicContact NZ-OD2 3.47Å; K913-D943 PolarHBondContact NZ-OD2 2.84Å
914	R	75.6	Confident	77.5	Confident	117 Å²	117	72.8 Å²	72.8	44%	0.442	39%	0.385	S	S	.	.	S	Bend	trans	-126	-7.3	173.9	-62	-175.2	-174.3	-128.3	-4.8	114	I634 D643	I634-R914 HydrophobicContact CG2-CB 4.17Å; D643-R914 IonicContact OD1-CZ 2.84Å; D643-R914 IonicContact OD1-NH1 2.76Å; D643-R914 PolarHBondContact OD1-NH1 3.17Å; D643-R914 IonicContact OD1-NH2 3.12Å; D643-R914 IonicContact OD2-CZ 3.54Å; D643-R914 IonicContact OD2-NH1 2.68Å; D643-R914 PolarHBondContact OD2-NH1 2.77Å; D643-R914 IonicContact OD2-NH2 3.63Å; D643-R914 PolarHBondContact OD2-NH2 2.92Å
915	G	67.6	Low	77.3	Confident	35 Å²	35	74.5 Å²	74.5	36%	0.361	40%	0.404	S	S	.	.	S	Bend	trans	-160.8	162.8	-176.5	0	0	0	0	0	111.1	Y646	Y646-G915 PolarHBondContact OH-O 3.06Å
916	I	63.7	Low	77.3	Confident	80 Å²	80	70.3 Å²	70.3	41%	0.41	39%	0.39	S	S	.	.			trans	-90.5	150	-175.1	-35.1	166.5	0	0	0	110	A631	A631-I916 HydrophobicContact CB-CD1 4.08Å; A631-I916 HydrophobicContact CB-CG1 3.41Å; A631-I916 VanDerWaalsContact CB-CG1 3.41Å
917	V	64.6	Low	77.6	Confident	62 Å²	62	67.4 Å²	67.4	38%	0.376	38%	0.376	S	S	.	.			trans	-115.3	134.4	157.5	-170.4	0	0	0	0	107	D921 V946	V917-D921 HydrophobicContact CG1-CB 4.4Å; V917-V946 HydrophobicContact CB-CG1 4.24Å; V917-V946 HydrophobicContact CG1-CG1 3.96Å; V917-V946 WeakPolarHBondContact O-CA 3.22Å
918	S	69.7	Low	77.7	Confident	38 Å²	38	66.6 Å²	66.6	27%	0.266	38%	0.375	S	S	.	.			trans	-100.8	158.1	-180	80	0	0	0	0	112.1	S920 D921	S918-S920 PolarHBondContact O-N 2.95Å; S918-S920 PolarHBondContact OG-N 3.37Å; S918-S920 PolarHBondContact OG-OG 3.48Å; S918-D921 WeakPolarHBondContact CA-OD2 3.49Å; S918-D921 VanDerWaalsContact CB-OD2 3.24Å; S918-D921 WeakPolarHBondContact CB-OD2 3.4Å; S918-D921 PolarHBondContact N-OD2 3.05Å; S918-D921 WeakPolarHBondContact O-CB 3.48Å; S918-D921 PolarHBondContact O-N 3.36Å; S918-D921 PolarHBondContact OG-N 3Å; S918-D921 PolarHBondContact OG-OD1 2.78Å; S918-D921 PolarHBondContact OG-OD2 3.41Å
919	M	73.1	Confident	78.3	Confident	38 Å²	38	69.1 Å²	69.1	19%	0.187	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-62.1	-28.6	175	-165.8	-172.7	-172.2	0	0	111.9	D921 L922 V986 I993	M919-D921 VanDerWaalsContact C-N 3.27Å; M919-D921 PolarHBondContact O-N 3.04Å; M919-L922 HydrophobicContact CG-CD1 4.12Å; M919-L922 WeakPolarHBondContact O-CB 3.36Å; M919-L922 PolarHBondContact O-N 3.43Å; M919-V986 HydrophobicContact CE-CG1 3.8Å; M919-V986 HydrophobicContact CG-CG1 4.4Å; M919-I993 HydrophobicContact CE-CD1 4.16Å; M919-I993 HydrophobicContact CE-CG1 3.68Å; M919-I993 HydrophobicContact CG-CD1 4.42Å
920	S	72.7	Confident	78.5	Confident	108 Å²	108	65.2 Å²	65.2	76%	0.755	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-68.2	-20.2	174	22.8	0	0	0	0	114.1	S918 L922	S918-S920 PolarHBondContact O-N 2.95Å; S918-S920 PolarHBondContact OG-N 3.37Å; S918-S920 PolarHBondContact OG-OG 3.48Å; S920-L922 VanDerWaalsContact C-N 3.3Å
921	D	74.5	Confident	78.6	Confident	104 Å²	104	66.1 Å²	66.1	56%	0.556	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-83.7	-10.8	177.1	-52.8	-46	0	0	0	112.1	V917 S918 M919	V917-D921 HydrophobicContact CG1-CB 4.4Å; S918-D921 WeakPolarHBondContact CA-OD2 3.49Å; S918-D921 VanDerWaalsContact CB-OD2 3.24Å; S918-D921 WeakPolarHBondContact CB-OD2 3.4Å; S918-D921 PolarHBondContact N-OD2 3.05Å; S918-D921 WeakPolarHBondContact O-CB 3.48Å; S918-D921 PolarHBondContact O-N 3.36Å; S918-D921 PolarHBondContact OG-N 3Å; S918-D921 PolarHBondContact OG-OD1 2.78Å; S918-D921 PolarHBondContact OG-OD2 3.41Å; M919-D921 VanDerWaalsContact C-N 3.27Å; M919-D921 PolarHBondContact O-N 3.04Å
922	L	81.3	Confident	79	Confident	20 Å²	20	63.1 Å²	63.1	11%	0.105	35%	0.351	C	S	.	.			trans	-72.1	131.5	178.7	-62.6	-179.7	0	0	0	111.6	M919 S920 L928 I944 V946 V983 V986 I993	M919-L922 HydrophobicContact CG-CD1 4.12Å; M919-L922 WeakPolarHBondContact O-CB 3.36Å; M919-L922 PolarHBondContact O-N 3.43Å; S920-L922 VanDerWaalsContact C-N 3.3Å; L922-L928 HydrophobicContact CD2-CD1 3.37Å; L922-I944 HydrophobicContact CD1-CD1 4Å; L922-I944 HydrophobicContact CD2-CD1 3.85Å; L922-V946 HydrophobicContact CD1-CG1 4.16Å; L922-V946 HydrophobicContact CD1-CG2 4.22Å; L922-V946 HydrophobicContact CD2-CG1 3.86Å; L922-V946 HydrophobicContact CG-CG1 4.03Å; L922-V983 HydrophobicContact CD2-CG2 4.4Å; L922-V986 HydrophobicContact CB-CG2 4.25Å; L922-I993 HydrophobicContact CD1-CD1 3.69Å; L922-I993 HydrophobicContact CD1-CG1 4.15Å; L922-I993 HydrophobicContact CD1-CG2 4.42Å
923	R	81.9	Confident	78.9	Confident	201 Å²	201	63.5 Å²	63.5	76%	0.758	36%	0.356	S	S	*	.			trans	-116.7	138.9	169.5	-59.9	-175	-178.4	-159.3	-0.8	109.3	G925 A926	R923-G925 PolarHBondContact O-N 3.36Å; R923-A926 HydrophobicContact CB-CB 4.48Å; R923-A926 WeakPolarHBondContact O-CB 3.3Å; R923-A926 PolarHBondContact O-N 3.34Å
924	V	90.1	Very high	78.9	Confident	97 Å²	97	62.5 Å²	62.5	59%	0.588	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	135.3	169.8	175.2	0	0	0	0	108.9	A926 L984 V986	V924-A926 VanDerWaalsContact C-N 3.32Å; V924-L984 VanDerWaalsContact CG1-O 3.31Å; V924-L984 WeakPolarHBondContact CG1-O 3.41Å; V924-V986 HydrophobicContact CG2-CG2 4.33Å
925	G	86.8	Confident	79.3	Confident	41 Å²	41	57 Å²	57	42%	0.423	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.3	-12.2	-172.1	0	0	0	0	0	115.2	R923 V983	R923-G925 PolarHBondContact O-N 3.36Å; G925-V983 PolarHBondContact N-O 3.04Å
926	A	83.6	Confident	80.1	Confident	30 Å²	30	55.7 Å²	55.7	25%	0.248	32%	0.317	C	S	.	.			trans	-60.9	138.8	175.8	0	0	0	0	0	111.2	R923 V924 R982 V983	R923-A926 HydrophobicContact CB-CB 4.48Å; R923-A926 WeakPolarHBondContact O-CB 3.3Å; R923-A926 PolarHBondContact O-N 3.34Å; V924-A926 VanDerWaalsContact C-N 3.32Å; A926-R982 WeakPolarHBondContact O-CA 3.43Å; A926-V983 HydrophobicContact CB-CG2 4.35Å; A926-V983 PolarHBondContact O-N 3.05Å
927	V	85.5	Confident	80.9	Confident	69 Å²	69	52.8 Å²	52.8	42%	0.418	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	126.7	172.9	178.2	0	0	0	0	108.5	E980 V981 R982 I998	V927-E980 HydrophobicContact CG1-CG 3.6Å; V927-V981 WeakPolarHBondContact CA-O 3.47Å; V927-R982 HydrophobicContact CG2-CG 4.46Å; V927-I998 HydrophobicContact CB-CD1 4.25Å; V927-I998 HydrophobicContact CG1-CD1 3.58Å; V927-I998 HydrophobicContact CG2-CD1 3.68Å
928	L	84.7	Confident	81.8	Confident	46 Å²	46	52.2 Å²	52.2	24%	0.241	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	152.2	-175.8	-63.6	171.4	0	0	0	109.6	L922 I944 E980 V981 V983	L922-L928 HydrophobicContact CD2-CD1 3.37Å; L928-I944 HydrophobicContact CD1-CB 4.4Å; L928-I944 HydrophobicContact CD1-CD1 3.9Å; L928-E980 WeakPolarHBondContact O-CA 3.18Å; L928-V981 HydrophobicContact CB-CG2 4.43Å; L928-V981 PolarHBondContact N-O 2.84Å; L928-V981 WeakPolarHBondContact O-CG2 3.48Å; L928-V981 PolarHBondContact O-N 3.34Å; L928-V983 HydrophobicContact CD1-CG2 3.94Å
929	T	84	Confident	82.7	Confident	86 Å²	86	50.4 Å²	50.4	53%	0.528	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	137.9	165.5	60.1	0	0	0	0	109.3	V979 L1001	T929-V979 CarbonylContact C-O 3.43Å; T929-V979 WeakPolarHBondContact CA-O 3.45Å; T929-L1001 HydrophobicContact CG2-CD1 3.77Å
930	G	83.6	Confident	83.5	Confident	11 Å²	11	48.6 Å²	48.6	11%	0.113	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	-179.3	176.8	0	0	0	0	0	111.8	D943 V979	G930-D943 CarbonylContact C-O 3.54Å; G930-D943 WeakPolarHBondContact CA-O 3.46Å; G930-V979 PolarHBondContact N-O 2.92Å; G930-V979 PolarHBondContact O-N 3.34Å
931	R	84.4	Confident	84.3	Confident	39 Å²	39	46.2 Å²	46.2	15%	0.147	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	136.9	-180	-166.3	171.1	-169.9	-176.9	-6	110.9	G908 Q909 D911 D933 V942 D943 G976 E977	G908-R931 VanDerWaalsContact C-NH2 3.3Å; G908-R931 PolarHBondContact O-NH2 2.83Å; Q909-R931 VanDerWaalsContact O-CZ 3.3Å; Q909-R931 PolarHBondContact O-NH1 3.38Å; Q909-R931 PolarHBondContact O-NH2 3.47Å; D911-R931 VanDerWaalsContact OD2-CD 3.25Å; D911-R931 WeakPolarHBondContact OD2-CD 3.27Å; D911-R931 IonicContact OD2-CZ 2.69Å; D911-R931 IonicContact OD2-NE 2.76Å; D911-R931 IonicContact OD2-NH1 3.2Å; D911-R931 PolarHBondContact OD2-NH1 2.69Å; R931-D933 PolarHBondContact O-N 3.08Å; R931-V942 CarbonylContact O-C 3.59Å; R931-V942 VanDerWaalsContact O-CA 3.23Å; R931-V942 WeakPolarHBondContact O-CA 3.4Å; R931-V942 WeakPolarHBondContact O-CG1 3.44Å; R931-D943 PolarHBondContact N-O 3.49Å; R931-D943 PolarHBondContact O-N 3.35Å; R931-G976 PolarHBondContact NE-O 3.27Å; R931-G976 PolarHBondContact NH2-O 3.49Å; R931-E977 WeakPolarHBondContact CA-O 3.38Å
932	V	86.8	Confident	85	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.012	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	118.7	179.2	-177	0	0	0	0	109.5	A940 F941 V942 L973 G974 P975 G976 E977 V979	V932-A940 HydrophobicContact CG1-CB 4.16Å; V932-F941 CarbonylContact C-O 3.49Å; V932-F941 WeakPolarHBondContact CA-O 3.38Å; V932-V942 HydrophobicContact CG2-CG2 4.19Å; V932-L973 HydrophobicContact CG2-CB 4.24Å; V932-L973 HydrophobicContact CG2-CD1 4.42Å; V932-G974 VanDerWaalsContact CB-O 3.29Å; V932-G974 WeakPolarHBondContact CB-O 3.27Å; V932-G974 WeakPolarHBondContact CG1-O 3.43Å; V932-P975 CarbonylContact O-C 3.57Å; V932-P975 VanDerWaalsContact O-CA 3.3Å; V932-P975 WeakPolarHBondContact O-CA 3.34Å; V932-G976 PolarHBondContact O-N 2.73Å; V932-E977 HydrophobicContact CG2-CB 4.42Å; V932-E977 PolarHBondContact N-O 3.29Å; V932-V979 HydrophobicContact CG2-CG1 4.14Å; V932-V979 HydrophobicContact CG2-CG2 4.39Å
933	D	80.7	Confident	85.2	Confident	62 Å²	62	41.9 Å²	41.9	33%	0.332	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	-39.8	175.5	-67.4	-37.5	0	0	0	111.6	R931 F941 D943 S949	R931-D933 PolarHBondContact O-N 3.08Å; D933-F941 PolarHBondContact N-O 3.47Å; D933-D943 PolarHBondContact OD2-N 2.68Å; D933-S949 VanDerWaalsContact OD2-CB 3.26Å; D933-S949 WeakPolarHBondContact OD2-CB 3.23Å; D933-S949 PolarHBondContact OD2-OG 3.35Å
934	N	82.5	Confident	85.3	Confident	26 Å²	26	32.8 Å²	32.8	14%	0.139	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	142.5	-172	-163.7	15.7	0	0	0	111.6	N546 F941	N546-N934 PolarHBondContact ND2-OD1 3.26Å; N934-F941 HydrophobicContact CB-CB 4.48Å; N934-F941 PolarHBondContact N-O 2.86Å; N934-F941 PolarHBondContact O-N 3.42Å
935	T	84.5	Confident	84.5	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.012	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	139.8	173.2	-54.5	0	0	0	0	110.4	M542 N546 L971 L973	M542-T935 HydrophobicContact CE-CG2 3.81Å; M542-T935 HydrophobicContact SD-CG2 3.9Å; N546-T935 PolarHBondContact ND2-O 3.28Å; T935-L971 HydrophobicContact CG2-CB 3.91Å; T935-L971 HydrophobicContact CG2-CD2 3.79Å; T935-L971 HydrophobicContact CG2-CG 4.46Å; T935-L973 WeakPolarHBondContact CG2-O 3.49Å; T935-L973 PolarHBondContact OG1-O 2.91Å
936	T	83.9	Confident	84	Confident	7 Å²	7	27.1 Å²	27.1	4%	0.043	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	166.6	177.9	68.9	0	0	0	0	111	F938 G939 F941 L971	T936-F938 HydrophobicContact CG2-CE1 4.41Å; T936-F938 HydrophobicContact CG2-CZ 4.25Å; T936-F938 PolarHBondContact O-N 2.84Å; T936-F938 WeakPolarHBondContact OG1-CE2 3.38Å; T936-F938 WeakPolarHBondContact OG1-CZ 3.34Å; T936-G939 PolarHBondContact N-O 3.36Å; T936-G939 PolarHBondContact O-N 2.58Å; T936-G939 VanDerWaalsContact O-N 3.13Å; T936-G939 PolarHBondContact OG1-N 2.74Å; T936-G939 PolarHBondContact OG1-O 3.48Å; T936-F941 HydrophobicContact CG2-CD2 4.15Å; T936-F941 HydrophobicContact CG2-CE2 3.83Å; T936-L971 WeakPolarHBondContact O-CD2 3.43Å
937	L	79.6	Confident	83.3	Confident	20 Å²	20	27.2 Å²	27.2	11%	0.105	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-0.9	-178	-60.7	176.3	0	0	0	115.5	P455 E538 M542	P455-L937 HydrophobicContact CB-CD1 3.55Å; P455-L937 HydrophobicContact CG-CD1 4.27Å; E538-L937 HydrophobicContact CB-CD1 4.36Å; E538-L937 HydrophobicContact CG-CD1 3.81Å; E538-L937 HydrophobicContact CG-CD2 3.57Å; E538-L937 HydrophobicContact CG-CG 4.36Å; E538-L937 WeakPolarHBondContact OE1-CD2 3.29Å; M542-L937 HydrophobicContact CG-CD2 3.31Å; M542-L937 HydrophobicContact CG-CG 3.88Å; M542-L937 HydrophobicContact SD-CD2 3.8Å; M542-L937 HydrophobicContact SD-CG 4.44Å
938	F	84.1	Confident	82.9	Confident	50 Å²	50	27.6 Å²	27.6	22%	0.219	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.9	-4	175	58.1	-98.6	0	0	0	113.5	T936 F941 L951 H953 K954	T936-F938 HydrophobicContact CG2-CE1 4.41Å; T936-F938 HydrophobicContact CG2-CZ 4.25Å; T936-F938 PolarHBondContact O-N 2.84Å; T936-F938 WeakPolarHBondContact OG1-CE2 3.38Å; T936-F938 WeakPolarHBondContact OG1-CZ 3.34Å; F938-F941 HydrophobicContact CE2-CE2 4.01Å; F938-F941 AromaticContact CE2-CZ 3.99Å; F938-F941 HydrophobicContact CE2-CZ 3.99Å; F938-F941 HydrophobicContact CZ-CE2 4.11Å; F938-F941 HydrophobicContact CZ-CZ 4.22Å; F938-L951 HydrophobicContact CD2-CD1 4.28Å; F938-L951 HydrophobicContact CD2-CD2 4.25Å; F938-L951 HydrophobicContact CE2-CD1 4.08Å; F938-L951 HydrophobicContact CE2-CD2 4.05Å; F938-H953 PolarHBondContact O-CD2 2.82Å; F938-K954 PolarHBondContact O-N 3.26Å
939	G	88.9	Confident	82.9	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.6	178.2	-176.9	0	0	0	0	0	114.5	T936 I952	T936-G939 PolarHBondContact N-O 3.36Å; T936-G939 PolarHBondContact O-N 2.58Å; T936-G939 VanDerWaalsContact O-N 3.13Å; T936-G939 PolarHBondContact OG1-N 2.74Å; T936-G939 PolarHBondContact OG1-O 3.48Å; G939-I952 CarbonylContact C-O 3.56Å; G939-I952 WeakPolarHBondContact CA-O 3.28Å
940	A	89.8	Confident	83.2	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	134.7	174.4	0	0	0	0	0	110.4	V932 I952 I957 L973	V932-A940 HydrophobicContact CG1-CB 4.16Å; A940-I952 PolarHBondContact N-O 3.27Å; A940-I952 PolarHBondContact O-N 3.42Å; A940-I957 HydrophobicContact CB-CD1 4.25Å; A940-L973 HydrophobicContact CB-CB 4.05Å; A940-L973 HydrophobicContact CB-CD1 3.81Å
941	F	90	Very high	83.7	Confident	57 Å²	57	25.5 Å²	25.5	25%	0.25	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	132.6	172.7	-70.5	-85.9	0	0	0	109.5	V932 D933 N934 T936 F938 G950 L951	V932-F941 CarbonylContact C-O 3.49Å; V932-F941 WeakPolarHBondContact CA-O 3.38Å; D933-F941 PolarHBondContact N-O 3.47Å; N934-F941 HydrophobicContact CB-CB 4.48Å; N934-F941 PolarHBondContact N-O 2.86Å; N934-F941 PolarHBondContact O-N 3.42Å; T936-F941 HydrophobicContact CG2-CD2 4.15Å; T936-F941 HydrophobicContact CG2-CE2 3.83Å; F938-F941 HydrophobicContact CE2-CE2 4.01Å; F938-F941 AromaticContact CE2-CZ 3.99Å; F938-F941 HydrophobicContact CE2-CZ 3.99Å; F938-F941 HydrophobicContact CZ-CE2 4.11Å; F938-F941 HydrophobicContact CZ-CZ 4.22Å; F941-G950 CarbonylContact C-O 3.46Å; F941-G950 WeakPolarHBondContact CA-O 3.47Å; F941-L951 HydrophobicContact CD1-CB 4.3Å; F941-L951 HydrophobicContact CD1-CD1 4.26Å; F941-L951 HydrophobicContact CD2-CD1 4.27Å; F941-L951 HydrophobicContact CE1-CB 4.09Å; F941-L951 HydrophobicContact CE1-CD1 4.01Å; F941-L951 HydrophobicContact CE1-CG 4.45Å; F941-L951 HydrophobicContact CE2-CD1 4.02Å; F941-L951 HydrophobicContact CG-CD1 4.4Å; F941-L951 HydrophobicContact CZ-CD1 3.89Å
942	V	88.7	Confident	84.1	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	120	-170.8	-178	0	0	0	0	111.1	R931 V932 I944 S949 G950 I952 V979 L995	R931-V942 CarbonylContact O-C 3.59Å; R931-V942 VanDerWaalsContact O-CA 3.23Å; R931-V942 WeakPolarHBondContact O-CA 3.4Å; R931-V942 WeakPolarHBondContact O-CG1 3.44Å; V932-V942 HydrophobicContact CG2-CG2 4.19Å; V942-I944 HydrophobicContact CG1-CG2 4.02Å; V942-I944 PolarHBondContact O-N 3.44Å; V942-S949 CarbonylContact O-C 3.53Å; V942-S949 VanDerWaalsContact O-CA 3.23Å; V942-S949 WeakPolarHBondContact O-CA 3.41Å; V942-G950 PolarHBondContact N-O 3.05Å; V942-G950 PolarHBondContact O-N 3.31Å; V942-I952 HydrophobicContact CG2-CD1 3.67Å; V942-I952 HydrophobicContact CG2-CG1 4.04Å; V942-V979 HydrophobicContact CB-CG2 4.48Å; V942-V979 HydrophobicContact CG1-CG2 3.55Å; V942-V979 HydrophobicContact CG2-CG2 4.04Å; V942-L995 HydrophobicContact CB-CD1 3.97Å; V942-L995 HydrophobicContact CG2-CD1 4.48Å
943	D	85.9	Confident	84.3	Confident	34 Å²	34	27.4 Å²	27.4	18%	0.182	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	115.6	164.4	-179.3	33.9	0	0	0	108.8	K913 G930 R931 D933 G945	K913-D943 IonicContact NZ-OD2 3.47Å; K913-D943 PolarHBondContact NZ-OD2 2.84Å; G930-D943 CarbonylContact C-O 3.54Å; G930-D943 WeakPolarHBondContact CA-O 3.46Å; R931-D943 PolarHBondContact N-O 3.49Å; R931-D943 PolarHBondContact O-N 3.35Å; D933-D943 PolarHBondContact OD2-N 2.68Å; D943-G945 WeakPolarHBondContact OD1-CA 3.27Å; D943-G945 PolarHBondContact OD1-N 2.76Å
944	I	83.5	Confident	84.6	Confident	9 Å²	9	28.2 Å²	28.2	5%	0.046	15%	0.148	C	C	.	.			trans	-100.9	15.7	171.4	58.2	171.7	0	0	0	111.8	L922 L928 V942 V946 V981 I993 L995	L922-I944 HydrophobicContact CD1-CD1 4Å; L922-I944 HydrophobicContact CD2-CD1 3.85Å; L928-I944 HydrophobicContact CD1-CB 4.4Å; L928-I944 HydrophobicContact CD1-CD1 3.9Å; V942-I944 HydrophobicContact CG1-CG2 4.02Å; V942-I944 PolarHBondContact O-N 3.44Å; I944-V946 HydrophobicContact CD1-CG1 4.48Å; I944-V946 HydrophobicContact CD1-CG2 4.09Å; I944-V946 HydrophobicContact CG1-CG1 4.23Å; I944-V946 HydrophobicContact CG1-CG2 3.7Å; I944-V981 HydrophobicContact CG2-CG2 3.66Å; I944-I993 HydrophobicContact CD1-CD1 4.28Å; I944-I993 HydrophobicContact CD1-CG2 4.24Å; I944-L995 HydrophobicContact CD1-CD2 4.41Å; I944-L995 HydrophobicContact CG2-CD1 4.09Å
945	G	73.7	Confident	84.8	Confident	11 Å²	11	30.3 Å²	30.3	11%	0.113	16%	0.164	C	C	.	.	S	Bend	trans	88.6	8.4	176.8	0	0	0	0	0	115.5	D943	D943-G945 WeakPolarHBondContact OD1-CA 3.27Å; D943-G945 PolarHBondContact OD1-N 2.76Å
946	V	75.7	Confident	85	Confident	8 Å²	8	33 Å²	33	5%	0.048	18%	0.177	C	C	.	.	S	Bend	trans	-104.7	10.8	-174.3	-57.1	0	0	0	0	114.8	R624 V917 L922 I944 R948 I993	R624-V946 PolarHBondContact NH2-O 3.38Å; V917-V946 HydrophobicContact CB-CG1 4.24Å; V917-V946 HydrophobicContact CG1-CG1 3.96Å; V917-V946 WeakPolarHBondContact O-CA 3.22Å; L922-V946 HydrophobicContact CD1-CG1 4.16Å; L922-V946 HydrophobicContact CD1-CG2 4.22Å; L922-V946 HydrophobicContact CD2-CG1 3.86Å; L922-V946 HydrophobicContact CG-CG1 4.03Å; I944-V946 HydrophobicContact CD1-CG1 4.48Å; I944-V946 HydrophobicContact CD1-CG2 4.09Å; I944-V946 HydrophobicContact CG1-CG1 4.23Å; I944-V946 HydrophobicContact CG1-CG2 3.7Å; V946-R948 WeakPolarHBondContact CG2-O 3.24Å; V946-R948 PolarHBondContact O-N 3.28Å; V946-R948 VanDerWaalsContact O-N 3.14Å; V946-I993 HydrophobicContact CG2-CD1 3.61Å
947	G	68.8	Low	85.2	Confident	32 Å²	32	33.7 Å²	33.7	33%	0.33	18%	0.18	S	C	.	.	S	Bend	trans	66.8	9.9	179.8	0	0	0	0	0	115	R624	R624-G947 PolarHBondContact NE-O 2.93Å; R624-G947 PolarHBondContact NH2-O 3.15Å
948	R	76.9	Confident	85.3	Confident	78 Å²	78	35 Å²	35	29%	0.294	19%	0.189	S	C	.	.	S	Bend	trans	-134.3	133.4	159.6	-67.4	-151.8	170.7	-163.2	-4.7	108.2	V946 R990 G991 I993	V946-R948 WeakPolarHBondContact CG2-O 3.24Å; V946-R948 PolarHBondContact O-N 3.28Å; V946-R948 VanDerWaalsContact O-N 3.14Å; R948-R990 PolarHBondContact NH1-O 3.26Å; R948-R990 VanDerWaalsContact NH1-O 3.08Å; R948-G991 WeakPolarHBondContact CD-O 3.45Å; R948-G991 VanDerWaalsContact NH1-CA 3.29Å; R948-G991 PolarHBondContact NH1-O 3.45Å; R948-I993 HydrophobicContact CB-CD1 4.47Å
949	S	85.4	Confident	85	Confident	49 Å²	49	37.8 Å²	37.8	34%	0.343	21%	0.205	S	C	.	.			trans	-69.1	130.2	173.8	-33.6	0	0	0	0	110.3	D933 V942	D933-S949 VanDerWaalsContact OD2-CB 3.26Å; D933-S949 WeakPolarHBondContact OD2-CB 3.23Å; D933-S949 PolarHBondContact OD2-OG 3.35Å; V942-S949 CarbonylContact O-C 3.53Å; V942-S949 VanDerWaalsContact O-CA 3.23Å; V942-S949 WeakPolarHBondContact O-CA 3.41Å
950	G	90.4	Very high	84.6	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	149.8	169.7	0	0	0	0	0	111.6	F941 V942 I993	F941-G950 CarbonylContact C-O 3.46Å; F941-G950 WeakPolarHBondContact CA-O 3.47Å; V942-G950 PolarHBondContact N-O 3.05Å; V942-G950 PolarHBondContact O-N 3.31Å; G950-I993 CarbonylContact C-O 3.59Å; G950-I993 WeakPolarHBondContact CA-O 3.42Å
951	L	93.4	Very high	84.2	Confident	50 Å²	50	45.5 Å²	45.5	26%	0.262	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	116	179.7	177.7	62.4	0	0	0	110.6	F938 F941 H953 I993 L995	F938-L951 HydrophobicContact CD2-CD1 4.28Å; F938-L951 HydrophobicContact CD2-CD2 4.25Å; F938-L951 HydrophobicContact CE2-CD1 4.08Å; F938-L951 HydrophobicContact CE2-CD2 4.05Å; F941-L951 HydrophobicContact CD1-CB 4.3Å; F941-L951 HydrophobicContact CD1-CD1 4.26Å; F941-L951 HydrophobicContact CD2-CD1 4.27Å; F941-L951 HydrophobicContact CE1-CB 4.09Å; F941-L951 HydrophobicContact CE1-CD1 4.01Å; F941-L951 HydrophobicContact CE1-CG 4.45Å; F941-L951 HydrophobicContact CE2-CD1 4.02Å; F941-L951 HydrophobicContact CG-CD1 4.4Å; F941-L951 HydrophobicContact CZ-CD1 3.89Å; L951-H953 PolarHBondContact O-N 3.46Å; L951-I993 PolarHBondContact N-O 3.15Å; L951-L995 PolarHBondContact O-N 2.99Å
952	I	93.1	Very high	83.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	102.9	159.4	-49.1	169.9	0	0	0	107.3	G939 A940 V942 H956 I957 L973 V981 L995 L997	G939-I952 CarbonylContact C-O 3.56Å; G939-I952 WeakPolarHBondContact CA-O 3.28Å; A940-I952 PolarHBondContact N-O 3.27Å; A940-I952 PolarHBondContact O-N 3.42Å; V942-I952 HydrophobicContact CG2-CD1 3.67Å; V942-I952 HydrophobicContact CG2-CG1 4.04Å; I952-H956 HydrophobicContact CG2-CB 3.79Å; I952-I957 HydrophobicContact CB-CD1 4.45Å; I952-I957 HydrophobicContact CB-CG1 4.38Å; I952-I957 HydrophobicContact CG2-CD1 4.1Å; I952-I957 HydrophobicContact CG2-CG1 3.52Å; I952-L973 HydrophobicContact CD1-CD1 3.78Å; I952-V981 HydrophobicContact CD1-CG1 3.73Å; I952-V981 HydrophobicContact CG1-CG1 4.27Å; I952-L995 WeakPolarHBondContact CA-O 3.4Å; I952-L995 HydrophobicContact CG1-CB 3.67Å; I952-L995 HydrophobicContact CG1-CD1 4.3Å; I952-L997 HydrophobicContact CD1-CB 4.31Å; I952-L997 HydrophobicContact CD1-CD1 4.24Å; I952-L997 HydrophobicContact CG2-CB 4.21Å
953	H	90.8	Very high	83.1	Confident	81 Å²	81	44.5 Å²	44.5	38%	0.375	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	148	174.4	178.2	-107.2	0	0	0	110.5	F938 L951 S955 H956	F938-H953 PolarHBondContact O-CD2 2.82Å; L951-H953 PolarHBondContact O-N 3.46Å; H953-S955 PolarHBondContact ND1-OG 3.32Å; H953-S955 PolarHBondContact O-N 3.46Å; H953-H956 WeakPolarHBondContact O-CB 3.48Å; H953-H956 PolarHBondContact O-N 2.99Å
954	K	86.6	Confident	82.2	Confident	79 Å²	79	46.6 Å²	46.6	34%	0.343	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-56	-25.4	-172.1	65.5	172.1	-175.4	171.6	0	115.2	F938 H956 I957 L971	F938-K954 PolarHBondContact O-N 3.26Å; K954-H956 PolarHBondContact O-N 3.43Å; K954-I957 PolarHBondContact O-N 3.47Å; K954-L971 HydrophobicContact CB-CD1 4.45Å
955	S	87.6	Confident	81	Confident	69 Å²	69	51.2 Å²	51.2	48%	0.483	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-64.8	-21.7	173.8	54.8	0	0	0	0	113.9	H953	H953-S955 PolarHBondContact ND1-OG 3.32Å; H953-S955 PolarHBondContact O-N 3.46Å
956	H	88.8	Confident	80.5	Confident	60 Å²	60	51.8 Å²	51.8	28%	0.278	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-94.2	-2.8	179.7	-67.3	-73.9	0	0	0	113.1	I952 H953 K954 D996 L997	I952-H956 HydrophobicContact CG2-CB 3.79Å; H953-H956 WeakPolarHBondContact O-CB 3.48Å; H953-H956 PolarHBondContact O-N 2.99Å; K954-H956 PolarHBondContact O-N 3.43Å; H956-D996 VanDerWaalsContact CB-OD1 3.26Å; H956-D996 WeakPolarHBondContact CB-OD1 3.36Å; H956-D996 IonicContact CG-OD1 3.71Å; H956-D996 IonicContact ND1-OD1 3.77Å; H956-D996 PolarHBondContact ND1-OD1 2.86Å; H956-L997 WeakPolarHBondContact O-CB 3.49Å
957	I	87.4	Confident	79.9	Confident	21 Å²	21	57.3 Å²	57.3	11%	0.108	32%	0.318	C	S	.	.			trans	-102.8	76.9	177.7	-53.1	174.6	0	0	0	108.1	A940 I952 K954 L962 L971 L973 L997	A940-I957 HydrophobicContact CB-CD1 4.25Å; I952-I957 HydrophobicContact CB-CD1 4.45Å; I952-I957 HydrophobicContact CB-CG1 4.38Å; I952-I957 HydrophobicContact CG2-CD1 4.1Å; I952-I957 HydrophobicContact CG2-CG1 3.52Å; K954-I957 PolarHBondContact O-N 3.47Å; I957-L962 HydrophobicContact CG2-CD1 4.08Å; I957-L962 HydrophobicContact CG2-CD2 4.23Å; I957-L971 HydrophobicContact CD1-CD2 3.76Å; I957-L971 HydrophobicContact CD1-CG 4.43Å; I957-L973 HydrophobicContact CD1-CD1 3.98Å; I957-L973 HydrophobicContact CD1-CG 4.45Å; I957-L973 HydrophobicContact CG1-CD1 4.28Å; I957-L973 HydrophobicContact CG2-CG 4.33Å; I957-L997 HydrophobicContact CG2-CD2 4.31Å
958	T	82.8	Confident	78.9	Confident	48 Å²	48	67.5 Å²	67.5	29%	0.294	35%	0.347	S	S	.	.			trans	-95.8	152.3	-174.9	59.8	0	0	0	0	112.4	D960 K961 L962	T958-D960 VanDerWaalsContact C-N 3.26Å; T958-D960 WeakPolarHBondContact CB-OD1 2.8Å; T958-D960 PolarHBondContact O-N 2.93Å; T958-D960 PolarHBondContact OG1-OD1 3.19Å; T958-K961 WeakPolarHBondContact O-CB 3.45Å; T958-K961 PolarHBondContact O-N 3.33Å; T958-K961 VanDerWaalsContact OG1-CD 3.25Å; T958-K961 WeakPolarHBondContact OG1-CD 3.37Å; T958-K961 WeakPolarHBondContact OG1-CG 3.41Å; T958-L962 WeakPolarHBondContact O-CD1 3.46Å; T958-L962 WeakPolarHBondContact O-CG 3.47Å
959	L	77.8	Confident	77.8	Confident	108 Å²	108	67.7 Å²	67.7	57%	0.565	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-63	-27.2	-170.2	-69.7	173.9	0	0	0	114.7	L962 R967	L959-L962 HydrophobicContact CD2-CD1 4.43Å; L959-R967 HydrophobicContact CD2-CB 4.13Å; L959-R967 HydrophobicContact CD2-CG 4.33Å; L959-R967 WeakPolarHBondContact CD2-O 3.46Å; L959-R967 PolarHBondContact O-NE 2.93Å
960	D	79.2	Confident	76	Confident	119 Å²	119	69.9 Å²	69.9	64%	0.636	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-67	-37	173.8	55.7	-57.1	0	0	0	112.5	T958 L962	T958-D960 VanDerWaalsContact C-N 3.26Å; T958-D960 WeakPolarHBondContact CB-OD1 2.8Å; T958-D960 PolarHBondContact O-N 2.93Å; T958-D960 PolarHBondContact OG1-OD1 3.19Å; D960-L962 PolarHBondContact O-N 3.28Å
961	K	81.9	Confident	74.3	Confident	42 Å²	42	70.5 Å²	70.5	18%	0.183	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-77.1	-1.9	179.2	-59.5	176.7	175.2	-162.1	0	113.9	T958 D996 L997	T958-K961 WeakPolarHBondContact O-CB 3.45Å; T958-K961 PolarHBondContact O-N 3.33Å; T958-K961 VanDerWaalsContact OG1-CD 3.25Å; T958-K961 WeakPolarHBondContact OG1-CD 3.37Å; T958-K961 WeakPolarHBondContact OG1-CG 3.41Å; K961-D996 IonicContact NZ-OD1 2.81Å; K961-D996 PolarHBondContact NZ-OD1 3.06Å; K961-D996 IonicContact NZ-OD2 2.72Å; K961-D996 PolarHBondContact NZ-OD2 2.96Å; K961-L997 HydrophobicContact CB-CD2 4.06Å; K961-L997 HydrophobicContact CB-CG 4.34Å; K961-L997 HydrophobicContact CD-CB 4.27Å; K961-L997 VanDerWaalsContact CD-O 3.25Å; K961-L997 WeakPolarHBondContact CD-O 3.46Å; K961-L997 WeakPolarHBondContact CE-O 3Å; K961-L997 PolarHBondContact NZ-O 2.94Å
962	L	80.9	Confident	73	Confident	8 Å²	8	68.3 Å²	68.3	4%	0.042	36%	0.355	C	S	.	.	S	Bend	trans	-113.9	140.5	-170	-67.2	165.5	0	0	0	112.2	I957 T958 L959 D960 R967 A972 L973 L997 V1000	I957-L962 HydrophobicContact CG2-CD1 4.08Å; I957-L962 HydrophobicContact CG2-CD2 4.23Å; T958-L962 WeakPolarHBondContact O-CD1 3.46Å; T958-L962 WeakPolarHBondContact O-CG 3.47Å; L959-L962 HydrophobicContact CD2-CD1 4.43Å; D960-L962 PolarHBondContact O-N 3.28Å; L962-R967 HydrophobicContact CB-CG 4.36Å; L962-R967 PolarHBondContact O-NE 3.39Å; L962-R967 VanDerWaalsContact O-NE 3.14Å; L962-R967 PolarHBondContact O-NH2 3.03Å; L962-A972 HydrophobicContact CD1-CB 3.21Å; L962-A972 HydrophobicContact CD2-CB 3.47Å; L962-A972 VanDerWaalsContact CD2-CB 3.47Å; L962-A972 HydrophobicContact CG-CB 3.89Å; L962-L973 HydrophobicContact CD2-CD2 4.26Å; L962-L997 HydrophobicContact CD2-CD2 3.96Å; L962-V1000 HydrophobicContact CD2-CG2 3.93Å
963	P	73.9	Confident	72.3	Confident	29 Å²	29	68.3 Å²	68.3	19%	0.188	36%	0.355	C	S	.	.			trans	-56.5	144.7	173.6	-21.9	31.4	0	0	0	111.7	S965 Q966 R967 V1000	P963-S965 PolarHBondContact O-N 3.36Å; P963-S965 VanDerWaalsContact O-N 3.12Å; P963-Q966 HydrophobicContact CB-CG 4.11Å; P963-Q966 HydrophobicContact CG-CG 4.24Å; P963-Q966 PolarHBondContact O-N 3.47Å; P963-R967 PolarHBondContact O-N 2.86Å; P963-V1000 HydrophobicContact CG-CB 3.89Å; P963-V1000 HydrophobicContact CG-CG1 4.42Å; P963-V1000 HydrophobicContact CG-CG2 4.32Å
964	A	66.9	Low	71.5	Confident	77 Å²	77	64.4 Å²	64.4	64%	0.636	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-55.4	-35.2	-175.2	0	0	0	0	0	113.7	Q966	A964-Q966 VanDerWaalsContact C-N 3.26Å; A964-Q966 PolarHBondContact O-N 3.4Å
965	S	59.5	Low	71	Confident	106 Å²	106	60.8 Å²	60.8	74%	0.741	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-65.5	-23.2	175	51.9	0	0	0	0	114.2	P963	P963-S965 PolarHBondContact O-N 3.36Å; P963-S965 VanDerWaalsContact O-N 3.12Å
966	Q	61.6	Low	70.4	Confident	24 Å²	24	58.3 Å²	58.3	11%	0.112	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-100.4	-8.9	-173.1	-56.1	-170.8	-7.9	0	0	113.5	P963 A964 R968 R969 E977	P963-Q966 HydrophobicContact CB-CG 4.11Å; P963-Q966 HydrophobicContact CG-CG 4.24Å; P963-Q966 PolarHBondContact O-N 3.47Å; A964-Q966 VanDerWaalsContact C-N 3.26Å; A964-Q966 PolarHBondContact O-N 3.4Å; Q966-R968 PolarHBondContact O-N 3.22Å; Q966-R968 VanDerWaalsContact O-N 3.14Å; Q966-R969 VanDerWaalsContact CG-NH2 3.29Å; Q966-R969 WeakPolarHBondContact O-CB 3.33Å; Q966-R969 WeakPolarHBondContact O-CG 3.25Å; Q966-R969 PolarHBondContact O-N 3.05Å; Q966-E977 PolarHBondContact NE2-OE1 3.3Å
967	R	63	Low	70	Confident	123 Å²	123	56.7 Å²	56.7	46%	0.464	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-12.2	-174.4	-71.5	179.2	-175.7	168.3	-0.2	115.9	L959 L962 P963	L959-R967 HydrophobicContact CD2-CB 4.13Å; L959-R967 HydrophobicContact CD2-CG 4.33Å; L959-R967 WeakPolarHBondContact CD2-O 3.46Å; L959-R967 PolarHBondContact O-NE 2.93Å; L962-R967 HydrophobicContact CB-CG 4.36Å; L962-R967 PolarHBondContact O-NE 3.39Å; L962-R967 VanDerWaalsContact O-NE 3.14Å; L962-R967 PolarHBondContact O-NH2 3.03Å; P963-R967 PolarHBondContact O-N 2.86Å
968	R	48.2	Very low	69.9	Low	247 Å²	247	60.8 Å²	60.8	93%	0.932	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	4.1	178	-53.6	-166.9	-152.9	-143.7	7.8	114.4	Q966	Q966-R968 PolarHBondContact O-N 3.22Å; Q966-R968 VanDerWaalsContact O-N 3.14Å
969	R	54.2	Low	70.2	Confident	82 Å²	82	58.5 Å²	58.5	31%	0.309	30%	0.299	S	S	.	.	S	Bend	trans	-100.4	136	-170.1	-59.2	-165.3	-65.3	-164.9	13.8	111.6	Q966 L971 A972 E977	Q966-R969 VanDerWaalsContact CG-NH2 3.29Å; Q966-R969 WeakPolarHBondContact O-CB 3.33Å; Q966-R969 WeakPolarHBondContact O-CG 3.25Å; Q966-R969 PolarHBondContact O-N 3.05Å; R969-L971 PolarHBondContact O-N 3.4Å; R969-A972 HydrophobicContact CB-CB 4.43Å; R969-A972 VanDerWaalsContact CZ-O 3.25Å; R969-A972 PolarHBondContact NE-O 3.43Å; R969-A972 VanDerWaalsContact NE-O 3.15Å; R969-A972 PolarHBondContact NH2-O 2.93Å; R969-E977 IonicContact CZ-OE1 3.92Å; R969-E977 IonicContact NH1-OE1 2.68Å; R969-E977 IonicContact NH2-OE1 3.2Å; R969-E977 PolarHBondContact NH2-OE1 2.93Å; R969-E977 IonicContact NH2-OE2 2.71Å
970	S	46.9	Very low	70.7	Confident	94 Å²	94	55 Å²	55	66%	0.657	28%	0.28	S	S	*	.	S	Bend	trans	-60.1	-46	-171.6	56.5	0	0	0	0	114.7
971	L	56.4	Low	71.4	Confident	13 Å²	13	49.3 Å²	49.3	7%	0.068	25%	0.25	C	C	.	.	S	Bend	trans	-110.9	127.4	146.2	-99.8	88.9	0	0	0	107.4	R545 T935 T936 K954 I957 R969 L973	R545-L971 PolarHBondContact NH1-O 3.35Å; R545-L971 PolarHBondContact NH2-O 3.23Å; T935-L971 HydrophobicContact CG2-CB 3.91Å; T935-L971 HydrophobicContact CG2-CD2 3.79Å; T935-L971 HydrophobicContact CG2-CG 4.46Å; T936-L971 WeakPolarHBondContact O-CD2 3.43Å; K954-L971 HydrophobicContact CB-CD1 4.45Å; I957-L971 HydrophobicContact CD1-CD2 3.76Å; I957-L971 HydrophobicContact CD1-CG 4.43Å; R969-L971 PolarHBondContact O-N 3.4Å; L971-L973 VanDerWaalsContact C-N 3.34Å; L971-L973 PolarHBondContact O-N 2.97Å
972	A	65.3	Low	71.8	Confident	4 Å²	4	52.5 Å²	52.5	3%	0.033	26%	0.261	C	S	.	.			trans	-75.5	-22.2	-174	0	0	0	0	0	114.3	R545 L962 R969	R545-A972 PolarHBondContact NH2-O 3.45Å; L962-A972 HydrophobicContact CD1-CB 3.21Å; L962-A972 HydrophobicContact CD2-CB 3.47Å; L962-A972 VanDerWaalsContact CD2-CB 3.47Å; L962-A972 HydrophobicContact CG-CB 3.89Å; R969-A972 HydrophobicContact CB-CB 4.43Å; R969-A972 VanDerWaalsContact CZ-O 3.25Å; R969-A972 PolarHBondContact NE-O 3.43Å; R969-A972 VanDerWaalsContact NE-O 3.15Å; R969-A972 PolarHBondContact NH2-O 2.93Å
973	L	78.3	Confident	72.4	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.259	C	S	.	.			trans	-82.8	139.5	178.2	-60.1	-179.9	0	0	0	112.8	R545 V932 T935 A940 I952 I957 L962 L971 E977 V979 L997 V1000	R545-L973 PolarHBondContact NH2-O 3.13Å; R545-L973 VanDerWaalsContact NH2-O 3.14Å; V932-L973 HydrophobicContact CG2-CB 4.24Å; V932-L973 HydrophobicContact CG2-CD1 4.42Å; T935-L973 WeakPolarHBondContact CG2-O 3.49Å; T935-L973 PolarHBondContact OG1-O 2.91Å; A940-L973 HydrophobicContact CB-CB 4.05Å; A940-L973 HydrophobicContact CB-CD1 3.81Å; I952-L973 HydrophobicContact CD1-CD1 3.78Å; I957-L973 HydrophobicContact CD1-CD1 3.98Å; I957-L973 HydrophobicContact CD1-CG 4.45Å; I957-L973 HydrophobicContact CG1-CD1 4.28Å; I957-L973 HydrophobicContact CG2-CG 4.33Å; L962-L973 HydrophobicContact CD2-CD2 4.26Å; L971-L973 VanDerWaalsContact C-N 3.34Å; L971-L973 PolarHBondContact O-N 2.97Å; L973-E977 VanDerWaalsContact CA-OE2 3.24Å; L973-E977 WeakPolarHBondContact CA-OE2 3.21Å; L973-V979 HydrophobicContact CD1-CG1 4.33Å; L973-V979 HydrophobicContact CD2-CG1 3.81Å; L973-L997 HydrophobicContact CD1-CD1 4.36Å; L973-L997 HydrophobicContact CD1-CD2 4.34Å; L973-L997 HydrophobicContact CD2-CD2 4.34Å; L973-V1000 HydrophobicContact CD2-CG2 3.56Å
974	G	73.8	Confident	73.3	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.268	C	S	.	.			trans	-124.3	158.4	172.1	0	0	0	0	0	112.3	V932 E977	V932-G974 VanDerWaalsContact CB-O 3.29Å; V932-G974 WeakPolarHBondContact CB-O 3.27Å; V932-G974 WeakPolarHBondContact CG1-O 3.43Å; G974-E977 PolarHBondContact N-OE2 2.99Å; G974-E977 WeakPolarHBondContact O-CB 3.44Å; G974-E977 PolarHBondContact O-N 3.49Å
975	P	76.7	Confident	74.5	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.019	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	146	175.5	-28.1	37.7	0	0	0	112.2	N546 Q549 V932 E977	N546-P975 HydrophobicContact CB-CG 4.04Å; N546-P975 VanDerWaalsContact OD1-CD 3.28Å; N546-P975 WeakPolarHBondContact OD1-CD 3.39Å; N546-P975 VanDerWaalsContact OD1-CG 3.29Å; N546-P975 WeakPolarHBondContact OD1-CG 3.45Å; Q549-P975 HydrophobicContact CB-CB 4.08Å; Q549-P975 VanDerWaalsContact CB-O 3.28Å; Q549-P975 WeakPolarHBondContact CB-O 3.24Å; Q549-P975 WeakPolarHBondContact CG-O 3.39Å; Q549-P975 PolarHBondContact OE1-O 3.11Å; V932-P975 CarbonylContact O-C 3.57Å; V932-P975 VanDerWaalsContact O-CA 3.3Å; V932-P975 WeakPolarHBondContact O-CA 3.34Å; P975-E977 PolarHBondContact O-N 3.39Å
976	G	74.3	Confident	75.8	Confident	17 Å²	17	52 Å²	52	18%	0.175	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	-11.7	-178.6	0	0	0	0	0	115.5	R931 V932	R931-G976 PolarHBondContact NE-O 3.27Å; R931-G976 PolarHBondContact NH2-O 3.49Å; V932-G976 PolarHBondContact O-N 2.73Å
977	E	81.4	Confident	77	Confident	25 Å²	25	52.7 Å²	52.7	12%	0.117	24%	0.243	C	C	.	.			trans	-71.6	138.7	174.7	-69.1	179.5	158.1	0	0	111.1	R931 V932 Q966 R969 L973 G974 P975	R931-E977 WeakPolarHBondContact CA-O 3.38Å; V932-E977 HydrophobicContact CG2-CB 4.42Å; V932-E977 PolarHBondContact N-O 3.29Å; Q966-E977 PolarHBondContact NE2-OE1 3.3Å; R969-E977 IonicContact CZ-OE1 3.92Å; R969-E977 IonicContact NH1-OE1 2.68Å; R969-E977 IonicContact NH2-OE1 3.2Å; R969-E977 PolarHBondContact NH2-OE1 2.93Å; R969-E977 IonicContact NH2-OE2 2.71Å; L973-E977 VanDerWaalsContact CA-OE2 3.24Å; L973-E977 WeakPolarHBondContact CA-OE2 3.21Å; G974-E977 PolarHBondContact N-OE2 2.99Å; G974-E977 WeakPolarHBondContact O-CB 3.44Å; G974-E977 PolarHBondContact O-N 3.49Å; P975-E977 PolarHBondContact O-N 3.39Å
978	R	84.2	Confident	77.8	Confident	108 Å²	108	50.5 Å²	50.5	41%	0.408	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	134.4	177	-63.9	175.2	76.1	-138.3	4.3	109.3	L1001	R978-L1001 HydrophobicContact CB-CB 4.02Å; R978-L1001 PolarHBondContact O-N 2.83Å
979	V	89.3	Confident	79.2	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	145.3	-175.8	-70.3	0	0	0	0	110.8	T929 G930 V932 V942 L973 V981 L997 V1000	T929-V979 CarbonylContact C-O 3.43Å; T929-V979 WeakPolarHBondContact CA-O 3.45Å; G930-V979 PolarHBondContact N-O 2.92Å; G930-V979 PolarHBondContact O-N 3.34Å; V932-V979 HydrophobicContact CG2-CG1 4.14Å; V932-V979 HydrophobicContact CG2-CG2 4.39Å; V942-V979 HydrophobicContact CB-CG2 4.48Å; V942-V979 HydrophobicContact CG1-CG2 3.55Å; V942-V979 HydrophobicContact CG2-CG2 4.04Å; L973-V979 HydrophobicContact CD1-CG1 4.33Å; L973-V979 HydrophobicContact CD2-CG1 3.81Å; V979-V981 HydrophobicContact CB-CG1 4.17Å; V979-V981 HydrophobicContact CG2-CG1 3.79Å; V979-L997 HydrophobicContact CB-CD1 3.9Å; V979-L997 HydrophobicContact CG1-CD1 3.82Å; V979-V1000 HydrophobicContact CG1-CG2 4.5Å
980	E	89.6	Confident	80.4	Confident	33 Å²	33	51.8 Å²	51.8	15%	0.154	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	127.3	164.1	-168.2	-177.3	-125.4	0	0	107.8	V927 L928 I998 R999 L1001	V927-E980 HydrophobicContact CG1-CG 3.6Å; L928-E980 WeakPolarHBondContact O-CA 3.18Å; E980-I998 HydrophobicContact CB-CB 4.42Å; E980-I998 HydrophobicContact CG-CB 4.43Å; E980-I998 HydrophobicContact CG-CD1 4.33Å; E980-I998 WeakPolarHBondContact O-CB 3.42Å; E980-I998 PolarHBondContact O-N 3.3Å; E980-R999 HydrophobicContact CB-CG 4.04Å; E980-R999 PolarHBondContact N-O 2.78Å; E980-R999 PolarHBondContact O-N 2.75Å; E980-R999 IonicContact OE1-CZ 3.54Å; E980-R999 IonicContact OE1-NH2 2.66Å; E980-R999 PolarHBondContact OE1-NH2 3.26Å; E980-R999 IonicContact OE2-CZ 3.73Å; E980-R999 VanDerWaalsContact OE2-CZ 3.23Å; E980-R999 IonicContact OE2-NE 3.19Å; E980-R999 PolarHBondContact OE2-NE 2.87Å; E980-R999 IonicContact OE2-NH2 3.41Å; E980-R999 PolarHBondContact OE2-NH2 2.97Å; E980-L1001 HydrophobicContact CB-CD1 4.38Å; E980-L1001 HydrophobicContact CB-CD2 4.24Å; E980-L1001 HydrophobicContact CB-CG 4.34Å
981	V	92.3	Very high	81.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	149.2	-170.7	-66.4	0	0	0	0	111	V927 L928 I944 I952 V979 L995 D996	V927-V981 WeakPolarHBondContact CA-O 3.47Å; L928-V981 HydrophobicContact CB-CG2 4.43Å; L928-V981 PolarHBondContact N-O 2.84Å; L928-V981 WeakPolarHBondContact O-CG2 3.48Å; L928-V981 PolarHBondContact O-N 3.34Å; I944-V981 HydrophobicContact CG2-CG2 3.66Å; I952-V981 HydrophobicContact CD1-CG1 3.73Å; I952-V981 HydrophobicContact CG1-CG1 4.27Å; V979-V981 HydrophobicContact CB-CG1 4.17Å; V979-V981 HydrophobicContact CG2-CG1 3.79Å; V981-L995 HydrophobicContact CB-CB 4.43Å; V981-L995 HydrophobicContact CB-CD1 4.37Å; V981-L995 HydrophobicContact CB-CD2 4.39Å; V981-L995 HydrophobicContact CG1-CD1 4.43Å; V981-L995 HydrophobicContact CG2-CD1 4.14Å; V981-L995 HydrophobicContact CG2-CD2 4.14Å; V981-D996 CarbonylContact C-O 3.44Å; V981-D996 VanDerWaalsContact CA-O 3.24Å; V981-D996 WeakPolarHBondContact CA-O 3.26Å
982	R	92	Very high	83.4	Confident	110 Å²	110	54.9 Å²	54.9	42%	0.415	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	133.8	169.9	-167.9	176.6	-67.6	152	1.5	110	A926 V927 L984 L995 D996 I998	A926-R982 WeakPolarHBondContact O-CA 3.43Å; V927-R982 HydrophobicContact CG2-CG 4.46Å; R982-L984 PolarHBondContact O-N 3.44Å; R982-L995 WeakPolarHBondContact O-CA 3.24Å; R982-D996 HydrophobicContact CB-CB 4.33Å; R982-D996 PolarHBondContact N-O 2.98Å; R982-D996 PolarHBondContact O-N 3.25Å; R982-I998 HydrophobicContact CB-CD1 4.17Å; R982-I998 HydrophobicContact CB-CG1 4.34Å
983	V	92.6	Very high	84.6	Confident	1 Å²	1	55 Å²	55	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	117.6	171.5	-177.1	0	0	0	0	109.2	L922 G925 A926 L928 V986 I993 L995	L922-V983 HydrophobicContact CD2-CG2 4.4Å; G925-V983 PolarHBondContact N-O 3.04Å; A926-V983 HydrophobicContact CB-CG2 4.35Å; A926-V983 PolarHBondContact O-N 3.05Å; L928-V983 HydrophobicContact CD1-CG2 3.94Å; V983-V986 HydrophobicContact CG1-CG2 3.37Å; V983-I993 HydrophobicContact CG1-CG2 4.42Å; V983-L995 HydrophobicContact CG2-CD2 4.26Å
984	L	93.1	Very high	85.3	Confident	72 Å²	72	56 Å²	56	38%	0.377	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-41.4	176	-69.3	177.2	0	0	0	112.4	V924 R982 G994 D996	V924-L984 VanDerWaalsContact CG1-O 3.31Å; V924-L984 WeakPolarHBondContact CG1-O 3.41Å; R982-L984 PolarHBondContact O-N 3.44Å; L984-G994 PolarHBondContact N-O 3.08Å; L984-D996 HydrophobicContact CD1-CB 3.94Å; L984-D996 HydrophobicContact CD2-CB 3.95Å; L984-D996 HydrophobicContact CG-CB 3.89Å
985	D	91.2	Very high	86.3	Confident	97 Å²	97	56 Å²	56	52%	0.519	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	150.1	-174.6	-177.4	33.2	0	0	0	110.6	I993 G994	D985-I993 WeakPolarHBondContact O-CA 3.29Å; D985-G994 PolarHBondContact N-O 3.18Å; D985-G994 PolarHBondContact O-N 2.81Å
986	V	88.5	Confident	87.1	Confident	38 Å²	38	57 Å²	57	23%	0.23	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	91	-177.7	-171.6	0	0	0	0	109.3	M919 L922 V924 V983 A988	M919-V986 HydrophobicContact CE-CG1 3.8Å; M919-V986 HydrophobicContact CG-CG1 4.4Å; L922-V986 HydrophobicContact CB-CG2 4.25Å; V924-V986 HydrophobicContact CG2-CG2 4.33Å; V983-V986 HydrophobicContact CG1-CG2 3.37Å; V986-A988 PolarHBondContact O-N 3.3Å
987	D	86.3	Confident	88	Confident	39 Å²	39	56.2 Å²	56.2	21%	0.209	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	95.3	173	178.6	-14	0	0	0	108.7	Q989 R990 G991 R992	D987-Q989 VanDerWaalsContact C-N 3.32Å; D987-Q989 PolarHBondContact O-N 3.4Å; D987-Q989 PolarHBondContact OD1-N 3.2Å; D987-Q989 VanDerWaalsContact OD1-N 3.08Å; D987-R990 PolarHBondContact OD1-N 2.89Å; D987-R990 VanDerWaalsContact OD2-CB 3.31Å; D987-R990 WeakPolarHBondContact OD2-CB 3.37Å; D987-R990 WeakPolarHBondContact OD2-CD 3.5Å; D987-R990 WeakPolarHBondContact OD2-CG 3.37Å; D987-G991 CarbonylContact O-C 3.49Å; D987-G991 WeakPolarHBondContact O-CA 3.29Å; D987-G991 PolarHBondContact O-N 3.47Å; D987-R992 HydrophobicContact CB-CB 4.29Å; D987-R992 PolarHBondContact N-O 3.1Å; D987-R992 PolarHBondContact O-N 3.17Å
988	A	80.1	Confident	88.5	Confident	78 Å²	78	57.2 Å²	57.2	65%	0.645	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-29.6	179.1	0	0	0	0	0	113.2	V986 G991	V986-A988 PolarHBondContact O-N 3.3Å; A988-G991 PolarHBondContact O-N 3.42Å
989	Q	77.8	Confident	88.6	Confident	193 Å²	193	58.4 Å²	58.4	90%	0.902	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-43.5	-177.4	-66.9	-174.5	-6	0	0	111.8	D987 G991	D987-Q989 VanDerWaalsContact C-N 3.32Å; D987-Q989 PolarHBondContact O-N 3.4Å; D987-Q989 PolarHBondContact OD1-N 3.2Å; D987-Q989 VanDerWaalsContact OD1-N 3.08Å; Q989-G991 VanDerWaalsContact C-N 3.31Å
990	R	77.7	Confident	88.5	Confident	162 Å²	162	59.3 Å²	59.3	61%	0.611	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-7.6	173	-57.1	-174.3	171.4	156.6	-6.9	112.3	R948 D987 R992	R948-R990 PolarHBondContact NH1-O 3.26Å; R948-R990 VanDerWaalsContact NH1-O 3.08Å; D987-R990 PolarHBondContact OD1-N 2.89Å; D987-R990 VanDerWaalsContact OD2-CB 3.31Å; D987-R990 WeakPolarHBondContact OD2-CB 3.37Å; D987-R990 WeakPolarHBondContact OD2-CD 3.5Å; D987-R990 WeakPolarHBondContact OD2-CG 3.37Å; R990-R992 HydrophobicContact CB-CG 4Å
991	G	79.8	Confident	88	Confident	10 Å²	10	59.7 Å²	59.7	10%	0.103	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	53	54.4	-172.9	0	0	0	0	0	111.8	R948 D987 A988 Q989	R948-G991 WeakPolarHBondContact CD-O 3.45Å; R948-G991 VanDerWaalsContact NH1-CA 3.29Å; R948-G991 PolarHBondContact NH1-O 3.45Å; D987-G991 CarbonylContact O-C 3.49Å; D987-G991 WeakPolarHBondContact O-CA 3.29Å; D987-G991 PolarHBondContact O-N 3.47Å; A988-G991 PolarHBondContact O-N 3.42Å; Q989-G991 VanDerWaalsContact C-N 3.31Å
992	R	87.2	Confident	86.5	Confident	162 Å²	162	70.6 Å²	70.6	61%	0.611	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.1	145.7	177.4	-62.4	178	177.1	-173.3	-1.1	109.8	D987 R990	D987-R992 HydrophobicContact CB-CB 4.29Å; D987-R992 PolarHBondContact N-O 3.1Å; D987-R992 PolarHBondContact O-N 3.17Å; R990-R992 HydrophobicContact CB-CG 4Å
993	I	91.1	Very high	86.2	Confident	6 Å²	6	68.7 Å²	68.7	3%	0.031	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	119.9	178.3	-55.8	161.9	0	0	0	107	M919 L922 I944 V946 R948 G950 L951 V983 D985 L995	M919-I993 HydrophobicContact CE-CD1 4.16Å; M919-I993 HydrophobicContact CE-CG1 3.68Å; M919-I993 HydrophobicContact CG-CD1 4.42Å; L922-I993 HydrophobicContact CD1-CD1 3.69Å; L922-I993 HydrophobicContact CD1-CG1 4.15Å; L922-I993 HydrophobicContact CD1-CG2 4.42Å; I944-I993 HydrophobicContact CD1-CD1 4.28Å; I944-I993 HydrophobicContact CD1-CG2 4.24Å; V946-I993 HydrophobicContact CG2-CD1 3.61Å; R948-I993 HydrophobicContact CB-CD1 4.47Å; G950-I993 CarbonylContact C-O 3.59Å; G950-I993 WeakPolarHBondContact CA-O 3.42Å; L951-I993 PolarHBondContact N-O 3.15Å; V983-I993 HydrophobicContact CG1-CG2 4.42Å; D985-I993 WeakPolarHBondContact O-CA 3.29Å; I993-L995 HydrophobicContact CG2-CD2 3.83Å; I993-L995 HydrophobicContact CG2-CG 4.24Å
994	G	92.9	Very high	85.9	Confident	22 Å²	22	72.2 Å²	72.2	23%	0.227	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	132	172.4	0	0	0	0	0	110.1	L984 D985	L984-G994 PolarHBondContact N-O 3.08Å; D985-G994 PolarHBondContact N-O 3.18Å; D985-G994 PolarHBondContact O-N 2.81Å
995	L	94.5	Very high	85.5	Confident	1 Å²	1	72.2 Å²	72.2	1%	0.005	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	142.1	-177.8	-63	178.8	0	0	0	112	V942 I944 L951 I952 V981 R982 V983 I993	V942-L995 HydrophobicContact CB-CD1 3.97Å; V942-L995 HydrophobicContact CG2-CD1 4.48Å; I944-L995 HydrophobicContact CD1-CD2 4.41Å; I944-L995 HydrophobicContact CG2-CD1 4.09Å; L951-L995 PolarHBondContact O-N 2.99Å; I952-L995 WeakPolarHBondContact CA-O 3.4Å; I952-L995 HydrophobicContact CG1-CB 3.67Å; I952-L995 HydrophobicContact CG1-CD1 4.3Å; V981-L995 HydrophobicContact CB-CB 4.43Å; V981-L995 HydrophobicContact CB-CD1 4.37Å; V981-L995 HydrophobicContact CB-CD2 4.39Å; V981-L995 HydrophobicContact CG1-CD1 4.43Å; V981-L995 HydrophobicContact CG2-CD1 4.14Å; V981-L995 HydrophobicContact CG2-CD2 4.14Å; R982-L995 WeakPolarHBondContact O-CA 3.24Å; V983-L995 HydrophobicContact CG2-CD2 4.26Å; I993-L995 HydrophobicContact CG2-CD2 3.83Å; I993-L995 HydrophobicContact CG2-CG 4.24Å
996	D	93.4	Very high	85.2	Confident	24 Å²	24	70.8 Å²	70.8	13%	0.128	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	134.9	162.9	-169.4	43.2	0	0	0	108.9	H956 K961 V981 R982 L984	H956-D996 VanDerWaalsContact CB-OD1 3.26Å; H956-D996 WeakPolarHBondContact CB-OD1 3.36Å; H956-D996 IonicContact CG-OD1 3.71Å; H956-D996 IonicContact ND1-OD1 3.77Å; H956-D996 PolarHBondContact ND1-OD1 2.86Å; K961-D996 IonicContact NZ-OD1 2.81Å; K961-D996 PolarHBondContact NZ-OD1 3.06Å; K961-D996 IonicContact NZ-OD2 2.72Å; K961-D996 PolarHBondContact NZ-OD2 2.96Å; V981-D996 CarbonylContact C-O 3.44Å; V981-D996 VanDerWaalsContact CA-O 3.24Å; V981-D996 WeakPolarHBondContact CA-O 3.26Å; R982-D996 HydrophobicContact CB-CB 4.33Å; R982-D996 PolarHBondContact N-O 2.98Å; R982-D996 PolarHBondContact O-N 3.25Å; L984-D996 HydrophobicContact CD1-CB 3.94Å; L984-D996 HydrophobicContact CD2-CB 3.95Å; L984-D996 HydrophobicContact CG-CB 3.89Å
997	L	93.8	Very high	85	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	140.5	169	-176.5	63.2	0	0	0	108.6	I952 H956 I957 K961 L962 L973 V979	I952-L997 HydrophobicContact CD1-CB 4.31Å; I952-L997 HydrophobicContact CD1-CD1 4.24Å; I952-L997 HydrophobicContact CG2-CB 4.21Å; H956-L997 WeakPolarHBondContact O-CB 3.49Å; I957-L997 HydrophobicContact CG2-CD2 4.31Å; K961-L997 HydrophobicContact CB-CD2 4.06Å; K961-L997 HydrophobicContact CB-CG 4.34Å; K961-L997 HydrophobicContact CD-CB 4.27Å; K961-L997 VanDerWaalsContact CD-O 3.25Å; K961-L997 WeakPolarHBondContact CD-O 3.46Å; K961-L997 WeakPolarHBondContact CE-O 3Å; K961-L997 PolarHBondContact NZ-O 2.94Å; L962-L997 HydrophobicContact CD2-CD2 3.96Å; L973-L997 HydrophobicContact CD1-CD1 4.36Å; L973-L997 HydrophobicContact CD1-CD2 4.34Å; L973-L997 HydrophobicContact CD2-CD2 4.34Å; V979-L997 HydrophobicContact CB-CD1 3.9Å; V979-L997 HydrophobicContact CG1-CD1 3.82Å
998	I	90.3	Very high	84.9	Confident	46 Å²	46	75.1 Å²	75.1	24%	0.236	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-55.5	164.9	-60.3	-179.2	0	0	0	108.8	V927 E980 R982	V927-I998 HydrophobicContact CB-CD1 4.25Å; V927-I998 HydrophobicContact CG1-CD1 3.58Å; V927-I998 HydrophobicContact CG2-CD1 3.68Å; E980-I998 HydrophobicContact CB-CB 4.42Å; E980-I998 HydrophobicContact CG-CB 4.43Å; E980-I998 HydrophobicContact CG-CD1 4.33Å; E980-I998 WeakPolarHBondContact O-CB 3.42Å; E980-I998 PolarHBondContact O-N 3.3Å; R982-I998 HydrophobicContact CB-CD1 4.17Å; R982-I998 HydrophobicContact CB-CG1 4.34Å
999	R	88	Confident	85.2	Confident	132 Å²	132	74.9 Å²	74.9	50%	0.498	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	159.4	176.7	56.3	-177	160.2	178.1	-3.7	111.2	E980 L1001	E980-R999 HydrophobicContact CB-CG 4.04Å; E980-R999 PolarHBondContact N-O 2.78Å; E980-R999 PolarHBondContact O-N 2.75Å; E980-R999 IonicContact OE1-CZ 3.54Å; E980-R999 IonicContact OE1-NH2 2.66Å; E980-R999 PolarHBondContact OE1-NH2 3.26Å; E980-R999 IonicContact OE2-CZ 3.73Å; E980-R999 VanDerWaalsContact OE2-CZ 3.23Å; E980-R999 IonicContact OE2-NE 3.19Å; E980-R999 PolarHBondContact OE2-NE 2.87Å; E980-R999 IonicContact OE2-NH2 3.41Å; E980-R999 PolarHBondContact OE2-NH2 2.97Å; R999-L1001 HydrophobicContact CG-CD2 4.3Å
1000	V	85.8	Confident	85.8	Confident	19 Å²	19	65.8 Å²	65.8	12%	0.115	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	132.8	164	-171.7	0	0	0	0	108.4	L962 P963 L973 V979	L962-V1000 HydrophobicContact CD2-CG2 3.93Å; P963-V1000 HydrophobicContact CG-CB 3.89Å; P963-V1000 HydrophobicContact CG-CG1 4.42Å; P963-V1000 HydrophobicContact CG-CG2 4.32Å; L973-V1000 HydrophobicContact CD2-CG2 3.56Å; V979-V1000 HydrophobicContact CG1-CG2 4.5Å
1001	L	80.8	Confident	86.5	Confident	41 Å²	41	57.8 Å²	57.8	22%	0.215	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	137.5	175	-59	174.2	0	0	0	108.6	T929 R978 E980 R999	T929-L1001 HydrophobicContact CG2-CD1 3.77Å; R978-L1001 HydrophobicContact CB-CB 4.02Å; R978-L1001 PolarHBondContact O-N 2.83Å; E980-L1001 HydrophobicContact CB-CD1 4.38Å; E980-L1001 HydrophobicContact CB-CD2 4.24Å; E980-L1001 HydrophobicContact CB-CG 4.34Å; R999-L1001 HydrophobicContact CG-CD2 4.3Å
1002	Q	60.3	Low	87.1	Confident	230 Å²	230	62.1 Å²	62.1	100%	1.075	29%	0.286	S	S	*	.			trans	-79.9	0	173.4	-68.9	-176.1	-19.5	0	0	111.1

Retrieved 1,002 of 1,002 residues in 553.1 ms (Link to these results)

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