A0A087XD67_POEFO Loading...

Potassium sodium-activated channel subfamily T member 1

AlphaFold DB , UniProt , Accession A0A087XD67, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,248 aa.

						>A0A087XD67_POEFO|A0A087XD67
FVQGPFFLPALYFPSASLLVSSRSCSSSPAPLPTNTSCSSGVILDISSLKMEQMESEVPPLPPRFRFRDLLLGDQNFQNDDRVQVEFYVNENTFKERLKLFFIKNQRSSLRIRVFNFCLKLLTCLLYIIRVMTDRPGQGTGGSHSVDCQWNGSVQDREINWDLIFWVERKAPVWAIQVIVAIISFLETMLLMYLSYKGNIWEQIFQVSFLLEMINTVPFIITIFWPSIKDLFIPVFLNCWLAKCALENMINDVHRAIQRTNSAMFNQVIVLICTLLCLVFTGTCGIQHLERAGQNLSLFNSFYFCIVTFSTVGFGDVTPRIWPSQLLVVIMICVALVVLPLQFEELIYLWMERQKSGGNYSRHRAQTEKHVVLCVSALKIDLLMDFLNEFYAHPRLQDYYVVILCPSEMDLQVRRVLQIPLWSQRVIYLQGSVLKDQDLLRAKMDDAEACFILSSRNEVDRMAADHQTILRAWAVKDFAPNCPLYVQILKPENKFHVKFADQVVCEEEFKYAMLALNCVCPATSTLVTLLVHTSRGRQHKREQQHAILLEGQQSPEQWQRMYGCCSGNEVYHIRLCDSKFFGEYNGKSFTYASFHAHKKYGVCLIGIKREENKSILLNPGPHHIMAATDTCYYINITKEENSAFIFNQEERKGRPAGGIYDGPSQLPVHSIIASMGTVAIDLQNTSPPNISGGKLVPPTVNGTGSRRPSIAPVQEIADSAAILPCDLLSDQSEDDTVFTDEKGSSFTEYVKGYPPNSPYIGSSPTLCHLLAEKAPFCCLRLDQGCMHNSFEDAKAYGFKNKLIIVSAETAGNGLYNFIVPLRAYYRPRKELNPIVLLLDNPPDNHFLEAICCFPMVYYMGGSIDNLDSLLQCGIIYADNLVVVDKESTMSAEEDYMADAKTIVNVQTMFRLFPSLSIITELTHPSNMRFMQFRAKDCYSLALSKLEKKERDKGSNLAFMFRLPFAAGRVFSISMLDTLLYQSFVKDYMILIARLLLGLDTTPGSGFLCAMKIKEEDLWIGTYGRLFQKLCSSSAEIPIGIYRTESHIFTTLEENTNTPVMIKSQVSMSVDDCEDTKDRGEEPRSNEQSDHPLLRKKSMQWARRLSKKSVRWQGGSRDSSKDHAQRIAQQRLNLYRRSEREELSELVRNRMRHLGLPTSGYDDVTNLTASDVMNRVNLGYLQDEQNENQNTLSYVLINPSHDTRLEINDIVYLIRSDPLAHVPEVPPVHSSSLKERHKSSIDTKEDTPL
					

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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	F	27.3	Very low	34.3	Very low	257 Å²	257	151.4 Å²	151.4	100%	1.127	82%	0.823	S	S	*	*				0	139.8	0	-121.1	-92.4	0	0	0	108
2	V	32.3	Very low	33.9	Very low	137 Å²	137	153.6 Å²	153.6	83%	0.83	81%	0.812	S	S	*	*			trans	68.3	145.2	-180	-167.2	0	0	0	0	115.4
3	Q	39.8	Very low	33.4	Very low	186 Å²	186	154.8 Å²	154.8	87%	0.869	81%	0.807	S	S	*	*			trans	-109.2	178.6	-173.7	-66.4	155.3	-55.5	0	0	111.4
4	G	32.6	Very low	33.5	Very low	70 Å²	70	151.3 Å²	151.3	72%	0.722	80%	0.798	S	S	*	*			trans	-73.7	-160.1	178.5	0	0	0	0	0	115.1
5	P	51.6	Low	33	Very low	132 Å²	132	149.5 Å²	149.5	86%	0.857	80%	0.803	S	S	*	*				-138.7	-179.9	68.7	40.7	-26.7	0	0	0	116.1
6	F	29.7	Very low	32.6	Very low	180 Å²	180	145.8 Å²	145.8	79%	0.789	80%	0.799	S	S	*	*			trans	-68.3	152.6	176.5	-78.7	-118.9	0	0	0	113.5
7	F	25.5	Very low	32.3	Very low	214 Å²	214	142.3 Å²	142.3	94%	0.939	79%	0.788	S	S	*	*				-144.1	143	128.7	-118.2	-82.3	0	0	0	110.8
8	L	35.8	Very low	32	Very low	121 Å²	121	142.9 Å²	142.9	63%	0.634	79%	0.789	S	S	*	*			trans	-119.9	152.1	177.7	-112.7	164.1	0	0	0	107.4
9	P	47.5	Very low	31.6	Very low	127 Å²	127	143 Å²	143	83%	0.825	79%	0.787	S	S	*	*				-143	158.7	89.1	36.4	-20.1	0	0	0	116.2
10	A	28.9	Very low	31.4	Very low	65 Å²	65	141.8 Å²	141.8	54%	0.537	78%	0.784	S	S	.	*			trans	-61.4	160.9	-176.9	0	0	0	0	0	116.4	Y12	A10-Y12 HydrophobicContact CB-CD2 4.31Å
11	L	26.5	Very low	31	Very low	176 Å²	176	139.4 Å²	139.4	92%	0.921	78%	0.777	S	S	*	*				-135.8	129.2	121.9	-109.1	168.2	0	0	0	110.4
12	Y	28.7	Very low	30.9	Very low	178 Å²	178	131.8 Å²	131.8	70%	0.698	76%	0.756	S	S	*	*			trans	-77.6	176.1	172.3	-88.4	-89.8	0	0	0	110.2	A10	A10-Y12 HydrophobicContact CB-CD2 4.31Å
13	F	27.4	Very low	30.5	Very low	170 Å²	170	136.5 Å²	136.5	75%	0.746	76%	0.758	S	S	*	*			cis	-166.5	-176.5	21.3	-122.5	-41.1	0	0	0	107.8
14	P	34.8	Very low	29.8	Very low	105 Å²	105	133.1 Å²	133.1	68%	0.682	76%	0.755	S	S	*	*				-110.7	162.8	-65.5	12.5	10.1	0	0	0	113.4
15	S	26.2	Very low	29.4	Very low	125 Å²	125	135.9 Å²	135.9	87%	0.874	76%	0.762	S	S	*	*			trans	-138.8	85.8	149.4	48.1	0	0	0	0	110.2	S17	S15-S17 PolarHBondContact O-N 3Å; S15-S17 VanDerWaalsContact O-N 3.08Å
16	A	26.6	Very low	28.2	Very low	89 Å²	89	135 Å²	135	74%	0.736	76%	0.759	S	S	*	*			trans	-84.1	83.2	-168	0	0	0	0	0	113.8
17	S	27.6	Very low	27.9	Very low	87 Å²	87	131.3 Å²	131.3	61%	0.608	76%	0.756	S	S	*	*				46.1	132.7	115.4	71	0	0	0	0	121.7	S15	S15-S17 PolarHBondContact O-N 3Å; S15-S17 VanDerWaalsContact O-N 3.08Å
18	L	27.5	Very low	27.9	Very low	153 Å²	153	126.3 Å²	126.3	80%	0.801	75%	0.747	S	S	*	*			trans	77.3	155.5	145.8	-61.1	162.8	0	0	0	116.3
19	L	24.9	Very low	28	Very low	145 Å²	145	126 Å²	126	76%	0.759	75%	0.752	S	S	*	*			cis	-163.1	177.5	7.2	-131.4	171.1	0	0	0	112.8
20	V	26	Very low	26.8	Very low	119 Å²	119	124.6 Å²	124.6	72%	0.721	75%	0.752	S	S	*	*			trans	82.3	120.6	156	175.8	0	0	0	0	121.5
21	S	23.4	Very low	27.2	Very low	91 Å²	91	127.4 Å²	127.4	64%	0.636	77%	0.765	S	S	*	*			trans	-38.7	156.8	165	66.3	0	0	0	0	122.8
22	S	25.5	Very low	27.1	Very low	98 Å²	98	126.6 Å²	126.6	69%	0.685	76%	0.76	S	S	*	*			trans	20.5	132.5	136.5	69.8	0	0	0	0	122
23	R	24.6	Very low	27.5	Very low	235 Å²	235	123 Å²	123	89%	0.887	76%	0.759	S	S	*	*				-173.6	142.9	109.4	-107.3	177.3	179.4	-173.2	-1.1	115.3
24	S	25.2	Very low	27.3	Very low	115 Å²	115	120.2 Å²	120.2	80%	0.804	76%	0.756	S	S	*	*			trans	31.4	138.7	147.8	58.7	0	0	0	0	123.2
25	C	24.1	Very low	26.8	Very low	129 Å²	129	122.3 Å²	122.3	87%	0.872	76%	0.761	S	S	*	*			trans	-75.4	152.6	169.3	-60.3	0	0	0	0	114.6
26	S	25.5	Very low	26.8	Very low	112 Å²	112	122.3 Å²	122.3	78%	0.783	76%	0.756	S	S	*	*			trans	-173.7	160	132	54.8	0	0	0	0	113.9
27	S	24.8	Very low	26.8	Very low	104 Å²	104	122.6 Å²	122.6	73%	0.727	75%	0.753	S	S	*	*			trans	60.8	101.9	164.3	51	0	0	0	0	122.2
28	S	23.8	Very low	26.7	Very low	108 Å²	108	124.6 Å²	124.6	76%	0.755	77%	0.765	S	S	*	*				4.4	164.4	121.2	58.5	0	0	0	0	122.1
29	P	37.8	Very low	26.7	Very low	114 Å²	114	122 Å²	122	74%	0.74	76%	0.761	S	S	*	*			cis	-144.3	153	-24.4	35.5	-16	0	0	0	117.5
30	A	23.9	Very low	26.7	Very low	99 Å²	99	121.2 Å²	121.2	82%	0.818	77%	0.767	S	S	*	*			trans	60.7	176.1	155.2	0	0	0	0	0	118.2
31	P	35.6	Very low	26.8	Very low	124 Å²	124	118.5 Å²	118.5	81%	0.805	76%	0.763	S	S	*	*			cis	-126.2	-170.4	-10	42	-25.5	0	0	0	115.5
32	L	25.1	Very low	27	Very low	158 Å²	158	120.3 Å²	120.3	83%	0.827	77%	0.77	S	S	*	*			trans	-39.6	165.8	163.3	-75	156.8	0	0	0	116.1
33	P	36.9	Very low	27	Very low	103 Å²	103	122.3 Å²	122.3	67%	0.669	77%	0.771	S	S	*	*			cis	-157.2	-169.5	41.5	45.3	-22.9	0	0	0	120.5
34	T	23.7	Very low	27.2	Very low	112 Å²	112	117.7 Å²	117.7	69%	0.687	76%	0.764	S	S	*	*			trans	68.5	125.3	158.1	44.9	0	0	0	0	119.3
35	N	25.1	Very low	27.3	Very low	148 Å²	148	118.6 Å²	118.6	79%	0.791	76%	0.759	S	S	*	*				67.2	135.7	64.1	-61.5	-10.9	0	0	0	112.3
36	T	25	Very low	27.4	Very low	125 Å²	125	119 Å²	119	77%	0.767	75%	0.751	S	S	*	*			cis	-142.5	150.6	28.9	46.5	0	0	0	0	111.3
37	S	26.2	Very low	27.4	Very low	95 Å²	95	118.6 Å²	118.6	66%	0.664	75%	0.749	S	S	*	*			cis	86.3	102	32.3	81.1	0	0	0	0	117
38	C	25.7	Very low	27.4	Very low	129 Å²	129	119.7 Å²	119.7	87%	0.872	76%	0.756	S	S	*	*			trans	169.4	151	149.5	-97.2	0	0	0	0	110.3
39	S	26.9	Very low	27.5	Very low	100 Å²	100	121.9 Å²	121.9	70%	0.699	76%	0.759	S	S	*	*			cis	-168.4	168.9	-17.3	50.3	0	0	0	0	111.3
40	S	26.8	Very low	26.9	Very low	127 Å²	127	125.4 Å²	125.4	89%	0.888	76%	0.763	S	S	*	*			trans	74.5	134.5	177.6	77.3	0	0	0	0	117.7
41	G	27.1	Very low	26.9	Very low	63 Å²	63	128.4 Å²	128.4	65%	0.649	76%	0.762	S	S	*	*			cis	153.5	113.4	-26.1	0	0	0	0	0	117.6
42	V	26.7	Very low	26.5	Very low	129 Å²	129	129.8 Å²	129.8	78%	0.782	76%	0.757	S	S	*	*			trans	62.4	153.9	157	-113.3	0	0	0	0	115.1
43	I	27	Very low	26.5	Very low	139 Å²	139	131.9 Å²	131.9	71%	0.713	76%	0.763	S	S	*	*			cis	-142.2	120	31.3	-70	-75.6	0	0	0	110.7
44	L	27.9	Very low	26.2	Very low	139 Å²	139	135.6 Å²	135.6	73%	0.728	77%	0.774	S	S	*	*				49	156	128	-53.6	-178.6	0	0	0	123.8
45	D	26.9	Very low	26.2	Very low	133 Å²	133	139.8 Å²	139.8	71%	0.711	79%	0.785	S	S	*	*			cis	-178.5	178.8	-21.1	-173	21.8	0	0	0	110.7
46	I	27.5	Very low	26.7	Very low	137 Å²	137	138.2 Å²	138.2	70%	0.703	79%	0.786	S	S	*	*			trans	77.5	105.5	157.6	-46.3	-177.1	0	0	0	118.4
47	S	24.9	Very low	26.8	Very low	105 Å²	105	141.3 Å²	141.3	73%	0.734	79%	0.792	S	S	*	*				-171.7	137	102.1	32.5	0	0	0	0	115.3
48	S	25.8	Very low	27	Very low	126 Å²	126	143 Å²	143	88%	0.881	80%	0.798	S	S	*	*			trans	67.7	138.3	166.6	63.6	0	0	0	0	119.9
49	L	25.3	Very low	27.3	Very low	154 Å²	154	142 Å²	142	81%	0.806	79%	0.79	S	S	*	*			trans	-139.8	138.3	-175.8	-99	157.6	0	0	0	109.3
50	K	25	Very low	27.4	Very low	188 Å²	188	143.2 Å²	143.2	82%	0.817	80%	0.795	S	S	*	*			trans	65.3	164.1	159.9	-69.8	-175.3	174.4	-169.8	0	115.7
51	M	23.7	Very low	27.5	Very low	163 Å²	163	144.9 Å²	144.9	80%	0.803	79%	0.793	S	S	*	*			cis	-138.7	-176.6	20.2	-160.9	155.5	170.8	0	0	113.6
52	E	27.3	Very low	27.7	Very low	152 Å²	152	147.1 Å²	147.1	71%	0.71	80%	0.796	S	S	*	*			trans	-74.8	153.3	-168.9	-57.3	125.4	123.8	0	0	115.3
53	Q	24.4	Very low	28	Very low	203 Å²	203	146.2 Å²	146.2	95%	0.949	79%	0.793	S	S	*	*			trans	-153	158.5	131.9	-120.1	169.3	-10.4	0	0	111.3
54	M	31.2	Very low	28.3	Very low	181 Å²	181	149.4 Å²	149.4	89%	0.892	80%	0.796	S	S	*	*			trans	-119.4	122.3	-174.9	177.9	-174.4	83.5	0	0	109.3
55	E	24.5	Very low	28.5	Very low	199 Å²	199	152.5 Å²	152.5	93%	0.93	80%	0.804	S	S	*	*			trans	-146.4	149.5	168.6	-124.9	166.5	-147.9	0	0	110.2
56	S	35.8	Very low	28.8	Very low	115 Å²	115	155.7 Å²	155.7	80%	0.804	81%	0.806	S	S	*	*			trans	-114	106.7	-168.8	58.1	0	0	0	0	111.7
57	E	26	Very low	29.1	Very low	191 Å²	191	156.3 Å²	156.3	89%	0.893	80%	0.804	S	S	*	*			trans	-119.4	118.9	164.3	-69.9	-158.1	134.4	0	0	111
58	V	30.7	Very low	29.5	Very low	130 Å²	130	160.7 Å²	160.7	79%	0.788	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-71.1	129.9	165.5	176.8	0	0	0	0	107.2
59	P	32.7	Very low	29.9	Very low	108 Å²	108	160.3 Å²	160.3	70%	0.701	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-60.7	127.2	179.6	24.7	-33.9	0	0	0	109.9	L61	P59-L61 PolarHBondContact O-N 3.13Å
60	P	29.4	Very low	30.7	Very low	125 Å²	125	159.9 Å²	159.9	81%	0.812	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-64.7	133.3	-175.9	24.8	-33.6	0	0	0	110.8
61	L	27.9	Very low	31.1	Very low	162 Å²	162	157.5 Å²	157.5	85%	0.848	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-58.3	138.8	172.4	-73	165.6	0	0	0	109.9	P59	P59-L61 PolarHBondContact O-N 3.13Å
62	P	31.3	Very low	31.5	Very low	110 Å²	110	156.4 Å²	156.4	71%	0.714	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-62.4	140.8	179.4	26.5	-34.4	0	0	0	110.4	R64	P62-R64 PolarHBondContact O-N 3.17Å
63	P	33.6	Very low	31.8	Very low	111 Å²	111	152.5 Å²	152.5	72%	0.721	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-61.9	134.8	-174.4	23.7	-33.4	0	0	0	111.9	F65	P63-F65 PolarHBondContact O-N 2.93Å
64	R	32.3	Very low	32.4	Very low	206 Å²	206	150.2 Å²	150.2	78%	0.777	78%	0.777	S	S	*	*			trans	-53.8	107.8	176	-76.5	175.7	163.5	-175.1	-10	110.1	P62 R66 D477	P62-R64 PolarHBondContact O-N 3.17Å; R64-R66 PolarHBondContact O-N 2.97Å; R64-R66 VanDerWaalsContact O-N 3.16Å; R64-D477 IonicContact CZ-OD2 3.5Å; R64-D477 IonicContact NH1-OD2 2.87Å; R64-D477 PolarHBondContact NH1-OD2 3.35Å; R64-D477 IonicContact NH2-OD2 2.62Å; R64-D477 PolarHBondContact NH2-OD2 3.07Å; R64-D477 VanDerWaalsContact NH2-OD2 3.16Å
65	F	33.1	Very low	32.3	Very low	203 Å²	203	150.7 Å²	150.7	89%	0.89	78%	0.777	S	S	*	*			trans	-62.1	114.3	171.3	-87.4	-86.8	0	0	0	110.1	P63 F67	P63-F65 PolarHBondContact O-N 2.93Å; F65-F67 PolarHBondContact O-N 3.46Å
66	R	32.1	Very low	32.9	Very low	200 Å²	200	149 Å²	149	76%	0.755	77%	0.774	S	S	*	*			trans	-69.7	121.1	175.4	-100.2	-179.5	170.4	165.6	-0.3	109.8	R64 R68 D69	R64-R66 PolarHBondContact O-N 2.97Å; R64-R66 VanDerWaalsContact O-N 3.16Å; R66-R68 PolarHBondContact O-N 3.5Å; R66-D69 PolarHBondContact O-N 3.2Å; R66-D69 VanDerWaalsContact O-N 3.16Å
67	F	34.6	Very low	32.7	Very low	150 Å²	150	153.1 Å²	153.1	66%	0.658	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-59.3	-11.4	179.2	-164.1	-99.5	0	0	0	114.4	F65 L71	F65-F67 PolarHBondContact O-N 3.46Å; F67-L71 HydrophobicContact CE1-CD1 4.47Å
68	R	33.7	Very low	33.2	Very low	198 Å²	198	152.5 Å²	152.5	75%	0.747	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-70.3	-30.5	178.1	-149.9	171.6	-166	159.7	4	112.8	R66 L70 L71	R66-R68 PolarHBondContact O-N 3.5Å; R68-L70 VanDerWaalsContact C-N 3.3Å; R68-L70 PolarHBondContact O-N 3.37Å; R68-L71 PolarHBondContact O-N 3.39Å
69	D	33.4	Very low	33.2	Very low	118 Å²	118	154 Å²	154	63%	0.631	78%	0.779	S	S	*	*	G	3₁₀ helix	trans	-84.7	-7	-170	-48.8	-29.7	0	0	0	112.4	R66	R66-D69 PolarHBondContact O-N 3.2Å; R66-D69 VanDerWaalsContact O-N 3.16Å
70	L	41.8	Very low	33.4	Very low	144 Å²	144	156.1 Å²	156.1	75%	0.754	78%	0.784	S	S	*	*	G	3₁₀ helix	trans	-91.6	-5.1	174.7	-81.7	164.5	0	0	0	114	R68	R68-L70 VanDerWaalsContact C-N 3.3Å; R68-L70 PolarHBondContact O-N 3.37Å
71	L	34.7	Very low	33.7	Very low	139 Å²	139	157.6 Å²	157.6	73%	0.728	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	-16	-178.1	-74.9	170.2	0	0	0	114	F67 R68	F67-L71 HydrophobicContact CE1-CD1 4.47Å; R68-L71 PolarHBondContact O-N 3.39Å
72	L	31.5	Very low	34.1	Very low	140 Å²	140	161 Å²	161	73%	0.733	79%	0.787	S	S	*	*	S	Bend	trans	-105.1	111.2	173.6	-70.3	170.2	0	0	0	109.1
73	G	33.6	Very low	34.2	Very low	70 Å²	70	161.3 Å²	161.3	72%	0.722	79%	0.787	S	S	*	*			trans	-75.8	142.5	168.3	0	0	0	0	0	111
74	D	36.1	Very low	34.4	Very low	154 Å²	154	162.1 Å²	162.1	82%	0.824	78%	0.781	S	S	*	*			trans	53.1	103.1	167.9	-56.4	-17.1	0	0	0	118.1
75	Q	28.8	Very low	34.7	Very low	191 Å²	191	157.2 Å²	157.2	89%	0.893	77%	0.773	S	S	*	*				-151.9	141.6	127	-118.5	155.8	83.2	0	0	111.9
76	N	38.1	Very low	35.2	Very low	163 Å²	163	155.2 Å²	155.2	87%	0.872	77%	0.767	S	S	*	*			trans	-67.2	132.6	-174.6	-62.8	-23.3	0	0	0	111.2
77	F	30.4	Very low	35.7	Very low	202 Å²	202	151.5 Å²	151.5	89%	0.886	76%	0.757	S	S	*	*			trans	-105.4	130.9	162.3	-107.3	-88.2	0	0	0	110.6
78	Q	37.2	Very low	36.1	Very low	178 Å²	178	153.1 Å²	153.1	83%	0.832	76%	0.76	S	S	*	*			trans	-73.8	126.7	-178	-62.5	162.7	-65.8	0	0	110
79	N	30.4	Very low	36.9	Very low	161 Å²	161	148.8 Å²	148.8	86%	0.861	76%	0.755	S	S	*	*			trans	-164.2	60.3	165.3	-97.2	-31.5	0	0	0	109.3
80	D	37.2	Very low	38	Very low	153 Å²	153	147.8 Å²	147.8	82%	0.818	75%	0.75	S	S	*	*			trans	-77.6	-175.5	166	-82.2	-59.1	0	0	0	111.1
81	D	35.8	Very low	38.7	Very low	156 Å²	156	145.8 Å²	145.8	83%	0.834	74%	0.736	S	S	*	*	S	Bend	trans	74	19.8	177	-62.7	-13.6	0	0	0	118.2
82	R	37.3	Very low	40.1	Very low	235 Å²	235	143.7 Å²	143.7	89%	0.887	73%	0.726	S	S	*	*	S	Bend	trans	-130.1	91.1	141.7	-76.3	-162.6	174.3	-169.1	-0.6	111.5	Q84	R82-Q84 PolarHBondContact O-N 3.44Å; R82-Q84 VanDerWaalsContact O-N 3.16Å
83	V	33.2	Very low	42.3	Very low	116 Å²	116	139.8 Å²	139.8	70%	0.703	71%	0.708	S	S	*	*			trans	-62.7	110.3	-171	-169.5	0	0	0	0	112.5	V85	V83-V85 VanDerWaalsContact C-N 3.26Å; V83-V85 HydrophobicContact CB-CG2 4.25Å; V83-V85 HydrophobicContact CG1-CG2 3.68Å; V83-V85 PolarHBondContact O-N 3.48Å
84	Q	36.9	Very low	44.6	Very low	128 Å²	128	143.8 Å²	143.8	60%	0.598	71%	0.706	S	S	*	*			trans	-76.5	72.8	168.4	-72.9	-170.9	-11.4	0	0	111.4	R82 E86 F87	R82-Q84 PolarHBondContact O-N 3.44Å; R82-Q84 VanDerWaalsContact O-N 3.16Å; Q84-E86 PolarHBondContact O-N 3.03Å; Q84-F87 HydrophobicContact CB-CB 4.37Å; Q84-F87 HydrophobicContact CB-CD2 4.1Å; Q84-F87 HydrophobicContact CG-CD2 4.44Å; Q84-F87 PolarHBondContact O-N 3.26Å
85	V	39.6	Very low	46.9	Very low	102 Å²	102	139.1 Å²	139.1	62%	0.618	68%	0.678	S	S	*	*	H	α-helix	trans	-55.6	-34.7	-178.6	-177.2	0	0	0	0	112.3	V83 F87	V83-V85 VanDerWaalsContact C-N 3.26Å; V83-V85 HydrophobicContact CB-CG2 4.25Å; V83-V85 HydrophobicContact CG1-CG2 3.68Å; V83-V85 PolarHBondContact O-N 3.48Å; V85-F87 PolarHBondContact O-N 3.14Å
86	E	43.2	Very low	49.4	Very low	161 Å²	161	131 Å²	131	75%	0.752	64%	0.64	S	S	*	*	H	α-helix	trans	-72.3	-22.9	-176.4	-59.1	-169.3	146.3	0	0	114.8	Q84 N90	Q84-E86 PolarHBondContact O-N 3.03Å; E86-N90 PolarHBondContact O-ND2 2.96Å
87	F	41.8	Very low	51.6	Low	123 Å²	123	130 Å²	130	54%	0.539	62%	0.624	S	S	.	*	H	α-helix	trans	-81.4	-42.2	-179.7	-83.9	-96	0	0	0	112.1	Q84 V85 V89 N90 E91	Q84-F87 HydrophobicContact CB-CB 4.37Å; Q84-F87 HydrophobicContact CB-CD2 4.1Å; Q84-F87 HydrophobicContact CG-CD2 4.44Å; Q84-F87 PolarHBondContact O-N 3.26Å; V85-F87 PolarHBondContact O-N 3.14Å; F87-V89 VanDerWaalsContact C-N 3.25Å; F87-V89 PolarHBondContact O-N 2.98Å; F87-N90 PolarHBondContact O-N 2.92Å; F87-N90 VanDerWaalsContact O-N 3.12Å; F87-E91 PolarHBondContact O-N 2.75Å
88	Y	43.8	Very low	54.2	Low	184 Å²	184	121.9 Å²	121.9	72%	0.722	59%	0.59	S	S	*	*	H	α-helix	trans	-61.7	-28.1	-176.5	-102.7	-84.7	0	0	0	114.6	N92	Y88-N92 PolarHBondContact O-ND2 2.95Å
89	V	50.8	Low	56.4	Low	107 Å²	107	116.5 Å²	116.5	65%	0.648	56%	0.564	S	S	*	*	H	α-helix	trans	-76.3	-35.4	177.7	-177.4	0	0	0	0	111.6	F87	F87-V89 VanDerWaalsContact C-N 3.25Å; F87-V89 PolarHBondContact O-N 2.98Å
90	N	55.4	Low	58.9	Low	97 Å²	97	111.2 Å²	111.2	52%	0.519	54%	0.535	S	S	.	.	H	α-helix	trans	-72.9	-47.4	-176	-94	-63.4	0	0	0	113.1	E86 F87 N92 T93 E96	E86-N90 PolarHBondContact O-ND2 2.96Å; F87-N90 PolarHBondContact O-N 2.92Å; F87-N90 VanDerWaalsContact O-N 3.12Å; N90-N92 VanDerWaalsContact C-N 3.26Å; N90-N92 PolarHBondContact O-N 2.63Å; N90-T93 PolarHBondContact O-N 3.42Å; N90-T93 PolarHBondContact O-OG1 2.84Å; N90-E96 WeakPolarHBondContact O-CB 3.38Å
91	E	56.3	Low	61.2	Low	101 Å²	101	109.3 Å²	109.3	47%	0.472	52%	0.52	S	S	.	.	H	α-helix	trans	-69.2	-20.9	-171.6	-60.9	-151.4	133.4	0	0	114.2	F87 T93 R97	F87-E91 PolarHBondContact O-N 2.75Å; E91-T93 VanDerWaalsContact C-N 3.34Å; E91-R97 VanDerWaalsContact O-CG 3.24Å; E91-R97 WeakPolarHBondContact O-CG 3.5Å
92	N	64.1	Low	63.4	Low	95 Å²	95	103.4 Å²	103.4	51%	0.508	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-6.6	177.6	-77.9	-55.2	0	0	0	114.2	Y88 N90 R97	Y88-N92 PolarHBondContact O-ND2 2.95Å; N90-N92 VanDerWaalsContact C-N 3.26Å; N90-N92 PolarHBondContact O-N 2.63Å; N92-R97 PolarHBondContact OD1-NH2 3.21Å
93	T	79.1	Confident	65.4	Low	59 Å²	59	95 Å²	95	36%	0.362	46%	0.459	S	S	.	.	S	Bend	trans	-72.2	141.2	176.3	68.7	0	0	0	0	111.9	N90 E91 K95 E96 R97	N90-T93 PolarHBondContact O-N 3.42Å; N90-T93 PolarHBondContact O-OG1 2.84Å; E91-T93 VanDerWaalsContact C-N 3.34Å; T93-K95 VanDerWaalsContact C-N 3.28Å; T93-K95 PolarHBondContact O-N 2.88Å; T93-E96 PolarHBondContact O-N 3.2Å; T93-E96 WeakPolarHBondContact OG1-CB 3.33Å; T93-E96 PolarHBondContact OG1-N 2.98Å; T93-R97 WeakPolarHBondContact O-CG 3.42Å; T93-R97 PolarHBondContact O-N 3.37Å
94	F	81.7	Confident	67.6	Low	153 Å²	153	94.5 Å²	94.5	67%	0.671	45%	0.447	S	S	*	.	H	α-helix	trans	-57.2	-40.3	178.1	179	-102.5	0	0	0	112.5	L98	F94-L98 HydrophobicContact CD1-CD1 4.15Å; F94-L98 HydrophobicContact CD2-CD1 3.94Å; F94-L98 HydrophobicContact CE1-CD1 3.78Å; F94-L98 HydrophobicContact CE2-CD1 3.54Å; F94-L98 HydrophobicContact CG-CD1 4.23Å; F94-L98 HydrophobicContact CZ-CD1 3.46Å; F94-L98 VanDerWaalsContact CZ-CD1 3.46Å; F94-L98 WeakPolarHBondContact O-CD1 3.22Å; F94-L98 PolarHBondContact O-N 3.25Å; F94-L98 VanDerWaalsContact O-N 3.08Å
95	K	83.9	Confident	69.7	Low	56 Å²	56	92.2 Å²	92.2	24%	0.243	44%	0.439	C	S	.	.	H	α-helix	trans	-61.7	-48.5	176.1	-175.8	172.5	-178.2	171.6	0	111.7	T93 L98 K99 Y193 L194	T93-K95 VanDerWaalsContact C-N 3.28Å; T93-K95 PolarHBondContact O-N 2.88Å; K95-L98 PolarHBondContact O-N 2.86Å; K95-K99 VanDerWaalsContact O-CB 3.28Å; K95-K99 WeakPolarHBondContact O-CB 3.25Å; K95-K99 PolarHBondContact O-N 2.97Å; K95-Y193 HydrophobicContact CB-CE1 4Å; K95-Y193 HydrophobicContact CD-CE1 4.02Å; K95-Y193 WeakPolarHBondContact CE-O 3.43Å; K95-Y193 HydrophobicContact CG-CD1 4.5Å; K95-Y193 HydrophobicContact CG-CE1 3.77Å; K95-Y193 PolarHBondContact NZ-O 3.37Å; K95-L194 HydrophobicContact CG-CD2 4.16Å; K95-L194 WeakPolarHBondContact O-CD2 3.47Å
96	E	82	Confident	71.5	Confident	20 Å²	20	91.4 Å²	91.4	9%	0.093	43%	0.429	C	S	.	.	H	α-helix	trans	-71.9	-33.2	-177.8	-156.9	66.5	-164	0	0	111.6	N90 T93 K99 L100 K104	N90-E96 WeakPolarHBondContact O-CB 3.38Å; T93-E96 PolarHBondContact O-N 3.2Å; T93-E96 WeakPolarHBondContact OG1-CB 3.33Å; T93-E96 PolarHBondContact OG1-N 2.98Å; E96-K99 VanDerWaalsContact CD-CD 3.49Å; E96-K99 PolarHBondContact O-N 2.81Å; E96-K99 WeakPolarHBondContact OE1-CD 3.48Å; E96-K99 IonicContact OE1-NZ 3.16Å; E96-K99 PolarHBondContact OE1-NZ 2.67Å; E96-K99 WeakPolarHBondContact OE2-CD 3.4Å; E96-K99 WeakPolarHBondContact OE2-CE 3.46Å; E96-K99 IonicContact OE2-NZ 3.49Å; E96-K99 PolarHBondContact OE2-NZ 3.05Å; E96-L100 VanDerWaalsContact O-CB 3.29Å; E96-L100 WeakPolarHBondContact O-CB 3.39Å; E96-L100 WeakPolarHBondContact O-CD1 3.46Å; E96-L100 VanDerWaalsContact O-CG 3.27Å; E96-L100 WeakPolarHBondContact O-CG 3.28Å; E96-L100 PolarHBondContact O-N 3.31Å; E96-K104 VanDerWaalsContact OE1-CE 3.25Å; E96-K104 WeakPolarHBondContact OE1-CE 3.43Å; E96-K104 IonicContact OE1-NZ 3.79Å; E96-K104 PolarHBondContact OE1-NZ 3.02Å
97	R	83.8	Confident	73.4	Confident	143 Å²	143	93.3 Å²	93.3	54%	0.54	43%	0.429	S	S	.	.	H	α-helix	trans	-60.9	-43.2	171.2	-72.6	-174.2	174.7	-166.4	1.5	113	E91 N92 T93 L100 F101	E91-R97 VanDerWaalsContact O-CG 3.24Å; E91-R97 WeakPolarHBondContact O-CG 3.5Å; N92-R97 PolarHBondContact OD1-NH2 3.21Å; T93-R97 WeakPolarHBondContact O-CG 3.42Å; T93-R97 PolarHBondContact O-N 3.37Å; R97-L100 WeakPolarHBondContact O-CB 3.46Å; R97-F101 PolarHBondContact O-N 2.87Å; R97-F101 VanDerWaalsContact O-N 3.11Å
98	L	84.2	Confident	75.5	Confident	31 Å²	31	88 Å²	88	16%	0.162	41%	0.407	C	S	.	.	H	α-helix	trans	-68.5	-41.3	173.4	-96.9	91.1	0	0	0	112.4	F94 K95 L100 F101 F102 L190 L194	F94-L98 HydrophobicContact CD1-CD1 4.15Å; F94-L98 HydrophobicContact CD2-CD1 3.94Å; F94-L98 HydrophobicContact CE1-CD1 3.78Å; F94-L98 HydrophobicContact CE2-CD1 3.54Å; F94-L98 HydrophobicContact CG-CD1 4.23Å; F94-L98 HydrophobicContact CZ-CD1 3.46Å; F94-L98 VanDerWaalsContact CZ-CD1 3.46Å; F94-L98 WeakPolarHBondContact O-CD1 3.22Å; F94-L98 PolarHBondContact O-N 3.25Å; F94-L98 VanDerWaalsContact O-N 3.08Å; K95-L98 PolarHBondContact O-N 2.86Å; L98-L100 VanDerWaalsContact C-N 3.27Å; L98-L100 PolarHBondContact O-N 3.48Å; L98-F101 CarbonylContact O-C 3.51Å; L98-F101 PolarHBondContact O-N 3.15Å; L98-F102 HydrophobicContact CD2-CD2 4.49Å; L98-F102 HydrophobicContact CD2-CE2 4.27Å; L98-F102 WeakPolarHBondContact O-CB 3.33Å; L98-F102 WeakPolarHBondContact O-CD2 3.3Å; L98-F102 PolarHBondContact O-N 2.84Å; L98-L190 HydrophobicContact CD2-CD1 3.58Å; L98-L190 HydrophobicContact CD2-CD2 3.85Å; L98-L190 HydrophobicContact CD2-CG 3.91Å; L98-L194 HydrophobicContact CB-CD1 3.97Å; L98-L194 HydrophobicContact CB-CD2 3.56Å; L98-L194 HydrophobicContact CB-CG 4.39Å; L98-L194 HydrophobicContact CD2-CD1 4.4Å
99	K	84.9	Confident	77.4	Confident	65 Å²	65	79.3 Å²	79.3	28%	0.283	37%	0.373	S	S	.	.	H	α-helix	trans	-66.4	-30.6	177.9	-171.2	-161.8	-179	-164.6	0	111.8	K95 E96 I103 K104 L194	K95-K99 VanDerWaalsContact O-CB 3.28Å; K95-K99 WeakPolarHBondContact O-CB 3.25Å; K95-K99 PolarHBondContact O-N 2.97Å; E96-K99 VanDerWaalsContact CD-CD 3.49Å; E96-K99 PolarHBondContact O-N 2.81Å; E96-K99 WeakPolarHBondContact OE1-CD 3.48Å; E96-K99 IonicContact OE1-NZ 3.16Å; E96-K99 PolarHBondContact OE1-NZ 2.67Å; E96-K99 WeakPolarHBondContact OE2-CD 3.4Å; E96-K99 WeakPolarHBondContact OE2-CE 3.46Å; E96-K99 IonicContact OE2-NZ 3.49Å; E96-K99 PolarHBondContact OE2-NZ 3.05Å; K99-I103 HydrophobicContact CG-CB 4.49Å; K99-I103 HydrophobicContact CG-CD1 4.22Å; K99-I103 WeakPolarHBondContact O-CA 3.04Å; K99-I103 WeakPolarHBondContact O-CB 3.45Å; K99-I103 PolarHBondContact O-N 3.45Å; K99-K104 PolarHBondContact O-N 3.05Å; K99-L194 HydrophobicContact CB-CD2 4.21Å
100	L	82.4	Confident	79.1	Confident	50 Å²	50	77 Å²	77	26%	0.262	36%	0.357	S	S	.	.	I	π-helix	trans	-59.8	-52.8	165.8	-81.4	160.3	0	0	0	110	E96 R97 L98 K104 N105	E96-L100 VanDerWaalsContact O-CB 3.29Å; E96-L100 WeakPolarHBondContact O-CB 3.39Å; E96-L100 WeakPolarHBondContact O-CD1 3.46Å; E96-L100 VanDerWaalsContact O-CG 3.27Å; E96-L100 WeakPolarHBondContact O-CG 3.28Å; E96-L100 PolarHBondContact O-N 3.31Å; R97-L100 WeakPolarHBondContact O-CB 3.46Å; L98-L100 VanDerWaalsContact C-N 3.27Å; L98-L100 PolarHBondContact O-N 3.48Å; L100-K104 HydrophobicContact CD2-CB 4.11Å; L100-K104 HydrophobicContact CD2-CD 3.59Å; L100-K104 HydrophobicContact CD2-CG 4.48Å; L100-K104 HydrophobicContact CG-CD 4.03Å; L100-N105 WeakPolarHBondContact O-CB 3.36Å; L100-N105 PolarHBondContact O-N 3.03Å
101	F	84.2	Confident	80.6	Confident	113 Å²	113	81.6 Å²	81.6	50%	0.496	37%	0.367	S	S	.	.	I	π-helix	trans	-64.7	-44	-179.4	-171.4	-104.3	0	0	0	114.3	R97 L98 S108 S109 I112	R97-F101 PolarHBondContact O-N 2.87Å; R97-F101 VanDerWaalsContact O-N 3.11Å; L98-F101 CarbonylContact O-C 3.51Å; L98-F101 PolarHBondContact O-N 3.15Å; F101-S108 VanDerWaalsContact O-CB 3.27Å; F101-S108 WeakPolarHBondContact O-CB 3.42Å; F101-S108 PolarHBondContact O-OG 3.31Å; F101-S109 PolarHBondContact O-N 3.23Å; F101-I112 HydrophobicContact CD1-CD1 3.77Å; F101-I112 HydrophobicContact CE1-CD1 3.68Å; F101-I112 HydrophobicContact CE1-CG1 4.34Å; F101-I112 HydrophobicContact CZ-CD1 4.46Å
102	F	82.8	Confident	82.1	Confident	32 Å²	32	77.9 Å²	77.9	14%	0.14	35%	0.35	C	S	.	.	I	π-helix	trans	-87	-29.5	-174.5	-83.9	-94.4	0	0	0	114.9	L98 S109 I112 E187 L190 L191 L194	L98-F102 HydrophobicContact CD2-CD2 4.49Å; L98-F102 HydrophobicContact CD2-CE2 4.27Å; L98-F102 WeakPolarHBondContact O-CB 3.33Å; L98-F102 WeakPolarHBondContact O-CD2 3.3Å; L98-F102 PolarHBondContact O-N 2.84Å; F102-S109 PolarHBondContact O-OG 3.21Å; F102-I112 HydrophobicContact CD1-CD1 3.83Å; F102-I112 HydrophobicContact CD1-CG2 3.96Å; F102-I112 HydrophobicContact CD2-CD1 4.46Å; F102-I112 HydrophobicContact CE1-CD1 4.07Å; F102-I112 HydrophobicContact CE1-CG2 3.83Å; F102-I112 HydrophobicContact CG-CD1 4.03Å; F102-I112 HydrophobicContact CZ-CD1 4.47Å; F102-E187 HydrophobicContact CE1-CG 4.36Å; F102-L190 HydrophobicContact CD2-CD2 4.47Å; F102-L190 HydrophobicContact CE1-CD2 4.18Å; F102-L190 HydrophobicContact CE2-CD2 3.63Å; F102-L190 HydrophobicContact CZ-CD2 3.47Å; F102-L190 VanDerWaalsContact CZ-CD2 3.47Å; F102-L191 HydrophobicContact CB-CD2 4.45Å; F102-L191 HydrophobicContact CD1-CD2 4.08Å; F102-L194 HydrophobicContact CB-CD1 3.86Å; F102-L194 HydrophobicContact CD2-CD1 3.95Å; F102-L194 HydrophobicContact CG-CD1 3.96Å
103	I	79.9	Confident	83.2	Confident	58 Å²	58	75.5 Å²	75.5	30%	0.297	33%	0.334	S	S	.	.	I	π-helix	trans	-126.5	-53.4	-166.8	-51.7	-177.2	0	0	0	112.8	K99 L194	K99-I103 HydrophobicContact CG-CB 4.49Å; K99-I103 HydrophobicContact CG-CD1 4.22Å; K99-I103 WeakPolarHBondContact O-CA 3.04Å; K99-I103 WeakPolarHBondContact O-CB 3.45Å; K99-I103 PolarHBondContact O-N 3.45Å; I103-L194 HydrophobicContact CD1-CB 4.22Å
104	K	79	Confident	83.7	Confident	106 Å²	106	75.6 Å²	75.6	46%	0.461	33%	0.334	S	S	.	.	I	π-helix	trans	-75.4	-46.8	-174.6	-64.6	174.3	152.6	176.4	0	112.7	E96 K99 L100 Q106	E96-K104 VanDerWaalsContact OE1-CE 3.25Å; E96-K104 WeakPolarHBondContact OE1-CE 3.43Å; E96-K104 IonicContact OE1-NZ 3.79Å; E96-K104 PolarHBondContact OE1-NZ 3.02Å; K99-K104 PolarHBondContact O-N 3.05Å; L100-K104 HydrophobicContact CD2-CB 4.11Å; L100-K104 HydrophobicContact CD2-CD 3.59Å; L100-K104 HydrophobicContact CD2-CG 4.48Å; L100-K104 HydrophobicContact CG-CD 4.03Å; K104-Q106 PolarHBondContact O-N 3.39Å
105	N	81.4	Confident	84.2	Confident	80 Å²	80	73.6 Å²	73.6	43%	0.428	33%	0.326	S	S	.	.			trans	-75	109	-175.4	179.6	-16.3	0	0	0	110.8	L100 R107 S108 S109	L100-N105 WeakPolarHBondContact O-CB 3.36Å; L100-N105 PolarHBondContact O-N 3.03Å; N105-R107 VanDerWaalsContact C-N 3.32Å; N105-R107 PolarHBondContact O-N 3.13Å; N105-R107 PolarHBondContact OD1-N 2.83Å; N105-S108 WeakPolarHBondContact CB-OG 3.21Å; N105-S108 VanDerWaalsContact CG-OG 3.31Å; N105-S108 PolarHBondContact O-N 3.39Å; N105-S108 PolarHBondContact O-OG 3.29Å; N105-S109 WeakPolarHBondContact O-CB 3.41Å; N105-S109 PolarHBondContact O-N 3.27Å
106	Q	76.6	Confident	84.4	Confident	86 Å²	86	72 Å²	72	40%	0.402	32%	0.319	S	S	.	.	H	α-helix	trans	-50.8	-42.5	179.9	-178.9	-178.2	-43.5	0	0	114.2	K104 L110 A256	K104-Q106 PolarHBondContact O-N 3.39Å; Q106-L110 VanDerWaalsContact O-CB 3.27Å; Q106-L110 WeakPolarHBondContact O-CB 3.39Å; Q106-L110 PolarHBondContact O-N 3.39Å; Q106-A256 VanDerWaalsContact CD-CB 3.41Å; Q106-A256 HydrophobicContact CG-CB 3.8Å
107	R	83	Confident	84.9	Confident	201 Å²	201	73.1 Å²	73.1	76%	0.758	32%	0.324	S	S	*	.	H	α-helix	trans	-78.7	-31	-174.4	-71	-174.5	179.8	179.3	2.4	112.9	N105 R111	N105-R107 VanDerWaalsContact C-N 3.32Å; N105-R107 PolarHBondContact O-N 3.13Å; N105-R107 PolarHBondContact OD1-N 2.83Å; R107-R111 WeakPolarHBondContact O-CD 3.42Å; R107-R111 VanDerWaalsContact O-CG 3.31Å; R107-R111 WeakPolarHBondContact O-CG 3.43Å
108	S	85.6	Confident	85.3	Confident	12 Å²	12	69.6 Å²	69.6	8%	0.084	32%	0.321	C	S	.	.	H	α-helix	trans	-84.8	-44.2	175.4	51.7	0	0	0	0	112	F101 N105 L110 R111 I112	F101-S108 VanDerWaalsContact O-CB 3.27Å; F101-S108 WeakPolarHBondContact O-CB 3.42Å; F101-S108 PolarHBondContact O-OG 3.31Å; N105-S108 WeakPolarHBondContact CB-OG 3.21Å; N105-S108 VanDerWaalsContact CG-OG 3.31Å; N105-S108 PolarHBondContact O-N 3.39Å; N105-S108 PolarHBondContact O-OG 3.29Å; S108-L110 VanDerWaalsContact C-N 3.3Å; S108-L110 PolarHBondContact O-N 3.41Å; S108-R111 PolarHBondContact O-N 3.25Å; S108-R111 VanDerWaalsContact O-N 3.08Å; S108-I112 WeakPolarHBondContact O-CD1 3.48Å; S108-I112 VanDerWaalsContact O-CG1 3.29Å; S108-I112 WeakPolarHBondContact O-CG1 3.28Å; S108-I112 PolarHBondContact O-N 2.85Å
109	S	84.7	Confident	85.6	Confident	0 Å²	0	69 Å²	69	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-51.7	-47.7	174.1	174.4	0	0	0	0	111.7	F101 F102 N105 R111 I112 R113 D252	F101-S109 PolarHBondContact O-N 3.23Å; F102-S109 PolarHBondContact O-OG 3.21Å; N105-S109 WeakPolarHBondContact O-CB 3.41Å; N105-S109 PolarHBondContact O-N 3.27Å; S109-R111 PolarHBondContact O-N 2.83Å; S109-I112 PolarHBondContact O-N 3.15Å; S109-R113 WeakPolarHBondContact O-CG 3.4Å; S109-R113 PolarHBondContact O-N 2.79Å; S109-R113 VanDerWaalsContact OG-CZ 3.25Å; S109-R113 PolarHBondContact OG-NE 3.39Å; S109-R113 PolarHBondContact OG-NH2 3.33Å; S109-D252 WeakPolarHBondContact CB-OD2 3.27Å; S109-D252 PolarHBondContact OG-OD2 3.41Å
110	L	85.4	Confident	86	Confident	59 Å²	59	66 Å²	66	31%	0.309	30%	0.304	S	S	.	.	H	α-helix	trans	-60.9	-43.7	177.6	-173.9	66.5	0	0	0	112.6	Q106 S108 I112 R113 V114 M249 V253	Q106-L110 VanDerWaalsContact O-CB 3.27Å; Q106-L110 WeakPolarHBondContact O-CB 3.39Å; Q106-L110 PolarHBondContact O-N 3.39Å; S108-L110 VanDerWaalsContact C-N 3.3Å; S108-L110 PolarHBondContact O-N 3.41Å; L110-I112 VanDerWaalsContact C-N 3.35Å; L110-I112 PolarHBondContact O-N 3.04Å; L110-R113 PolarHBondContact O-N 2.88Å; L110-V114 WeakPolarHBondContact O-CB 3.23Å; L110-V114 VanDerWaalsContact O-CG2 3.27Å; L110-V114 WeakPolarHBondContact O-CG2 3.2Å; L110-V114 PolarHBondContact O-N 3.09Å; L110-M249 HydrophobicContact CD1-CG 3.54Å; L110-V253 HydrophobicContact CD1-CG2 3.67Å; L110-V253 HydrophobicContact CD2-CG2 4.42Å
111	R	88.2	Confident	86.4	Confident	193 Å²	193	67.5 Å²	67.5	73%	0.728	31%	0.312	S	S	*	.	H	α-helix	trans	-62.8	-40.3	177.7	-73.8	172.2	177.7	-174.3	-1.3	112	R107 S108 S109 F115	R107-R111 WeakPolarHBondContact O-CD 3.42Å; R107-R111 VanDerWaalsContact O-CG 3.31Å; R107-R111 WeakPolarHBondContact O-CG 3.43Å; S108-R111 PolarHBondContact O-N 3.25Å; S108-R111 VanDerWaalsContact O-N 3.08Å; S109-R111 PolarHBondContact O-N 2.83Å; R111-F115 WeakPolarHBondContact O-CB 3.41Å; R111-F115 PolarHBondContact O-N 2.96Å
112	I	88.1	Confident	86.8	Confident	24 Å²	24	65.2 Å²	65.2	12%	0.123	31%	0.305	C	S	.	.	H	α-helix	trans	-66.2	-46.7	178.4	-63.3	157.9	0	0	0	110.1	F101 F102 S108 S109 L110 V114 F115 N116	F101-I112 HydrophobicContact CD1-CD1 3.77Å; F101-I112 HydrophobicContact CE1-CD1 3.68Å; F101-I112 HydrophobicContact CE1-CG1 4.34Å; F101-I112 HydrophobicContact CZ-CD1 4.46Å; F102-I112 HydrophobicContact CD1-CD1 3.83Å; F102-I112 HydrophobicContact CD1-CG2 3.96Å; F102-I112 HydrophobicContact CD2-CD1 4.46Å; F102-I112 HydrophobicContact CE1-CD1 4.07Å; F102-I112 HydrophobicContact CE1-CG2 3.83Å; F102-I112 HydrophobicContact CG-CD1 4.03Å; F102-I112 HydrophobicContact CZ-CD1 4.47Å; S108-I112 WeakPolarHBondContact O-CD1 3.48Å; S108-I112 VanDerWaalsContact O-CG1 3.29Å; S108-I112 WeakPolarHBondContact O-CG1 3.28Å; S108-I112 PolarHBondContact O-N 2.85Å; S109-I112 PolarHBondContact O-N 3.15Å; L110-I112 VanDerWaalsContact C-N 3.35Å; L110-I112 PolarHBondContact O-N 3.04Å; I112-V114 PolarHBondContact O-N 3.02Å; I112-F115 WeakPolarHBondContact O-CB 3.18Å; I112-F115 PolarHBondContact O-N 3.15Å; I112-F115 VanDerWaalsContact O-N 3.15Å; I112-N116 PolarHBondContact O-N 2.65Å
113	R	87.5	Confident	87.2	Confident	45 Å²	45	63.9 Å²	63.9	17%	0.17	30%	0.3	C	S	.	.	H	α-helix	trans	-63.5	-39.6	178.1	-66.4	177.3	-160.1	-175.4	13.4	112.5	S109 L110 F117 N248 M249 D252	S109-R113 WeakPolarHBondContact O-CG 3.4Å; S109-R113 PolarHBondContact O-N 2.79Å; S109-R113 VanDerWaalsContact OG-CZ 3.25Å; S109-R113 PolarHBondContact OG-NE 3.39Å; S109-R113 PolarHBondContact OG-NH2 3.33Å; L110-R113 PolarHBondContact O-N 2.88Å; R113-F117 VanDerWaalsContact O-CB 3.22Å; R113-F117 WeakPolarHBondContact O-CB 3.45Å; R113-F117 PolarHBondContact O-N 3.42Å; R113-N248 PolarHBondContact NH1-O 2.82Å; R113-M249 HydrophobicContact CB-CB 4.23Å; R113-D252 IonicContact CZ-OD1 3.29Å; R113-D252 VanDerWaalsContact CZ-OD1 3.26Å; R113-D252 IonicContact CZ-OD2 3.13Å; R113-D252 IonicContact NE-OD2 2.64Å; R113-D252 IonicContact NH1-OD1 2.67Å; R113-D252 PolarHBondContact NH1-OD1 3.15Å; R113-D252 IonicContact NH1-OD2 3.18Å; R113-D252 IonicContact NH2-OD1 3.43Å; R113-D252 PolarHBondContact NH2-OD1 3.27Å; R113-D252 IonicContact NH2-OD2 2.74Å; R113-D252 PolarHBondContact NH2-OD2 2.79Å
114	V	89.4	Confident	87.7	Confident	61 Å²	61	61.6 Å²	61.6	37%	0.37	29%	0.289	S	S	.	.	H	α-helix	trans	-62.1	-44.7	171.8	169.2	0	0	0	0	111.2	L110 I112 F117 C118 M249	L110-V114 WeakPolarHBondContact O-CB 3.23Å; L110-V114 VanDerWaalsContact O-CG2 3.27Å; L110-V114 WeakPolarHBondContact O-CG2 3.2Å; L110-V114 PolarHBondContact O-N 3.09Å; I112-V114 PolarHBondContact O-N 3.02Å; V114-F117 PolarHBondContact O-N 3.18Å; V114-C118 PolarHBondContact O-N 3.37Å; V114-C118 PolarHBondContact O-SG 3.05Å; V114-M249 HydrophobicContact CG2-CG 4.2Å; V114-M249 HydrophobicContact CG2-SD 3.58Å; V114-M249 VanDerWaalsContact CG2-SD 3.58Å
115	F	90.8	Very high	88.3	Confident	111 Å²	111	60.9 Å²	60.9	49%	0.487	29%	0.289	S	S	.	.	H	α-helix	trans	-62.1	-49.2	179	178.4	-109	0	0	0	112.1	R111 I112 F117 C118 L119 I183	R111-F115 WeakPolarHBondContact O-CB 3.41Å; R111-F115 PolarHBondContact O-N 2.96Å; I112-F115 WeakPolarHBondContact O-CB 3.18Å; I112-F115 PolarHBondContact O-N 3.15Å; I112-F115 VanDerWaalsContact O-N 3.15Å; F115-F117 PolarHBondContact O-N 2.86Å; F115-C118 PolarHBondContact O-N 3.08Å; F115-L119 HydrophobicContact CD1-CD1 4.01Å; F115-L119 HydrophobicContact CE1-CD1 3.53Å; F115-L119 HydrophobicContact CE1-CG 4.32Å; F115-L119 HydrophobicContact CE2-CD1 4.47Å; F115-L119 HydrophobicContact CE2-CG 4.46Å; F115-L119 HydrophobicContact CZ-CD1 3.8Å; F115-L119 HydrophobicContact CZ-CD2 4.41Å; F115-L119 HydrophobicContact CZ-CG 4.25Å; F115-L119 WeakPolarHBondContact O-CG 3.13Å; F115-L119 PolarHBondContact O-N 2.98Å; F115-I183 HydrophobicContact CE1-CG2 4.18Å
116	N	88.8	Confident	88.7	Confident	21 Å²	21	57.7 Å²	57.7	11%	0.112	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-45.2	175.9	-171.4	-15.5	0	0	0	111.3	I112 C118 L119 K120 E187	I112-N116 PolarHBondContact O-N 2.65Å; N116-C118 PolarHBondContact O-N 2.79Å; N116-L119 WeakPolarHBondContact O-CB 3.3Å; N116-L119 PolarHBondContact O-N 3.39Å; N116-L119 VanDerWaalsContact O-N 3.09Å; N116-K120 WeakPolarHBondContact O-CG 3.44Å; N116-K120 PolarHBondContact O-N 3.48Å; N116-K120 WeakPolarHBondContact OD1-CE 3.25Å; N116-K120 WeakPolarHBondContact OD1-CG 3.48Å; N116-E187 PolarHBondContact ND2-OE1 3.46Å; N116-E187 PolarHBondContact ND2-OE2 2.88Å
117	F	91.8	Very high	89.3	Confident	45 Å²	45	53.7 Å²	53.7	20%	0.197	25%	0.254	C	S	.	.	H	α-helix	trans	-54.7	-47.3	173.8	176.1	-105.1	0	0	0	112.7	R113 V114 F115 L119 K120 L121 A242 A245 L246	R113-F117 VanDerWaalsContact O-CB 3.22Å; R113-F117 WeakPolarHBondContact O-CB 3.45Å; R113-F117 PolarHBondContact O-N 3.42Å; V114-F117 PolarHBondContact O-N 3.18Å; F115-F117 PolarHBondContact O-N 2.86Å; F117-L119 PolarHBondContact O-N 3.43Å; F117-K120 PolarHBondContact O-N 3.04Å; F117-L121 HydrophobicContact CD1-CD1 4.16Å; F117-L121 HydrophobicContact CE1-CD1 3.53Å; F117-L121 HydrophobicContact CE1-CG 4.41Å; F117-L121 HydrophobicContact CE2-CD1 4.18Å; F117-L121 HydrophobicContact CE2-CG 4.35Å; F117-L121 HydrophobicContact CZ-CD1 3.56Å; F117-L121 HydrophobicContact CZ-CG 4.22Å; F117-L121 PolarHBondContact O-N 2.78Å; F117-A242 HydrophobicContact CD2-CB 4.04Å; F117-A242 WeakPolarHBondContact CD2-O 3.35Å; F117-A242 HydrophobicContact CE2-CB 4.14Å; F117-A245 HydrophobicContact CB-CB 4.23Å; F117-L246 HydrophobicContact CD2-CB 4.13Å; F117-L246 HydrophobicContact CD2-CD1 4.46Å; F117-L246 HydrophobicContact CE2-CB 3.92Å; F117-L246 HydrophobicContact CE2-CD1 3.98Å; F117-L246 HydrophobicContact CE2-CD2 4.39Å; F117-L246 HydrophobicContact CE2-CG 4.33Å; F117-L246 HydrophobicContact CZ-CD1 4Å
118	C	92.4	Very high	89.7	Confident	69 Å²	69	46.6 Å²	46.6	47%	0.466	23%	0.23	S	C	.	.	H	α-helix	trans	-61.9	-40.1	174.9	-71	0	0	0	0	112.7	V114 F115 N116 L122	V114-C118 PolarHBondContact O-N 3.37Å; V114-C118 PolarHBondContact O-SG 3.05Å; F115-C118 PolarHBondContact O-N 3.08Å; N116-C118 PolarHBondContact O-N 2.79Å; C118-L122 WeakPolarHBondContact O-CB 3.47Å; C118-L122 PolarHBondContact O-N 3.09Å
119	L	91.3	Very high	89.8	Confident	18 Å²	18	49.4 Å²	49.4	9%	0.094	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-43.9	175.5	-72.8	-178.7	0	0	0	112.3	F115 N116 F117 L122 T123 V180 I183	F115-L119 HydrophobicContact CD1-CD1 4.01Å; F115-L119 HydrophobicContact CE1-CD1 3.53Å; F115-L119 HydrophobicContact CE1-CG 4.32Å; F115-L119 HydrophobicContact CE2-CD1 4.47Å; F115-L119 HydrophobicContact CE2-CG 4.46Å; F115-L119 HydrophobicContact CZ-CD1 3.8Å; F115-L119 HydrophobicContact CZ-CD2 4.41Å; F115-L119 HydrophobicContact CZ-CG 4.25Å; F115-L119 WeakPolarHBondContact O-CG 3.13Å; F115-L119 PolarHBondContact O-N 2.98Å; N116-L119 WeakPolarHBondContact O-CB 3.3Å; N116-L119 PolarHBondContact O-N 3.39Å; N116-L119 VanDerWaalsContact O-N 3.09Å; F117-L119 PolarHBondContact O-N 3.43Å; L119-L122 WeakPolarHBondContact O-CB 3.44Å; L119-L122 PolarHBondContact O-N 3.48Å; L119-T123 PolarHBondContact O-N 3.4Å; L119-T123 VanDerWaalsContact O-N 3.1Å; L119-V180 HydrophobicContact CB-CG1 3.87Å; L119-V180 HydrophobicContact CD2-CG1 4.17Å; L119-V180 HydrophobicContact CD2-CG2 4.09Å; L119-V180 HydrophobicContact CG-CG1 4.42Å; L119-I183 HydrophobicContact CD1-CB 4.4Å; L119-I183 HydrophobicContact CD1-CG2 3.66Å
120	K	92	Very high	90	Very high	1 Å²	1	49.7 Å²	49.7	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-46.6	177.4	-62.8	-58.9	179.1	-178.8	0	111.1	N116 F117 L122 T123 C124 S184 E212 N238 L241 A242	N116-K120 WeakPolarHBondContact O-CG 3.44Å; N116-K120 PolarHBondContact O-N 3.48Å; N116-K120 WeakPolarHBondContact OD1-CE 3.25Å; N116-K120 WeakPolarHBondContact OD1-CG 3.48Å; F117-K120 PolarHBondContact O-N 3.04Å; K120-L122 VanDerWaalsContact C-N 3.31Å; K120-L122 PolarHBondContact O-N 3.03Å; K120-T123 PolarHBondContact O-N 2.88Å; K120-T123 VanDerWaalsContact O-N 3.14Å; K120-T123 PolarHBondContact O-OG1 2.82Å; K120-C124 PolarHBondContact O-N 2.89Å; K120-S184 VanDerWaalsContact NZ-CB 3.29Å; K120-S184 PolarHBondContact NZ-OG 2.9Å; K120-S184 VanDerWaalsContact NZ-OG 3.14Å; K120-E212 WeakPolarHBondContact CE-OE2 3.5Å; K120-E212 IonicContact NZ-OE1 2.76Å; K120-E212 PolarHBondContact NZ-OE1 2.93Å; K120-E212 IonicContact NZ-OE2 3.86Å; K120-E212 PolarHBondContact NZ-OE2 3.32Å; K120-N238 HydrophobicContact CD-CB 4.27Å; K120-L241 HydrophobicContact CD-CB 4.25Å; K120-L241 HydrophobicContact CG-CB 4.38Å; K120-A242 HydrophobicContact CB-CB 3.86Å
121	L	92	Very high	90	Very high	82 Å²	82	47.7 Å²	47.7	43%	0.429	24%	0.235	S	C	.	.	H	α-helix	trans	-59.1	-39.7	173.4	-71.3	-175.6	0	0	0	112.8	F117 T123 C124 L125 A242	F117-L121 HydrophobicContact CD1-CD1 4.16Å; F117-L121 HydrophobicContact CE1-CD1 3.53Å; F117-L121 HydrophobicContact CE1-CG 4.41Å; F117-L121 HydrophobicContact CE2-CD1 4.18Å; F117-L121 HydrophobicContact CE2-CG 4.35Å; F117-L121 HydrophobicContact CZ-CD1 3.56Å; F117-L121 HydrophobicContact CZ-CG 4.22Å; F117-L121 PolarHBondContact O-N 2.78Å; L121-T123 VanDerWaalsContact C-N 3.31Å; L121-T123 PolarHBondContact O-N 3.05Å; L121-C124 PolarHBondContact O-N 2.95Å; L121-L125 PolarHBondContact O-N 3.07Å; L121-A242 HydrophobicContact CD2-CB 4.19Å; L121-A242 HydrophobicContact CG-CB 4.49Å
122	L	91.9	Very high	89.8	Confident	65 Å²	65	45.5 Å²	45.5	34%	0.34	23%	0.234	S	C	.	.	H	α-helix	trans	-59.7	-39.8	175.9	178.8	62.3	0	0	0	111.8	C118 L119 K120 L125 L126 V180	C118-L122 WeakPolarHBondContact O-CB 3.47Å; C118-L122 PolarHBondContact O-N 3.09Å; L119-L122 WeakPolarHBondContact O-CB 3.44Å; L119-L122 PolarHBondContact O-N 3.48Å; K120-L122 VanDerWaalsContact C-N 3.31Å; K120-L122 PolarHBondContact O-N 3.03Å; L122-L125 PolarHBondContact O-N 3.02Å; L122-L126 HydrophobicContact CD1-CD1 4.32Å; L122-L126 HydrophobicContact CD1-CG 4.36Å; L122-L126 HydrophobicContact CG-CD1 4.06Å; L122-L126 WeakPolarHBondContact O-CB 3.21Å; L122-L126 VanDerWaalsContact O-CG 3.26Å; L122-L126 WeakPolarHBondContact O-CG 3.47Å; L122-L126 PolarHBondContact O-N 2.95Å; L122-V180 HydrophobicContact CD2-CG2 4.38Å
123	T	90.5	Very high	89.3	Confident	5 Å²	5	47.2 Å²	47.2	3%	0.031	25%	0.246	C	C	.	.	H	α-helix	trans	-66.4	-36.4	175.8	64.3	0	0	0	0	113.3	L119 K120 L121 L126 Y127 V180 N238	L119-T123 PolarHBondContact O-N 3.4Å; L119-T123 VanDerWaalsContact O-N 3.1Å; K120-T123 PolarHBondContact O-N 2.88Å; K120-T123 VanDerWaalsContact O-N 3.14Å; K120-T123 PolarHBondContact O-OG1 2.82Å; L121-T123 VanDerWaalsContact C-N 3.31Å; L121-T123 PolarHBondContact O-N 3.05Å; T123-L126 PolarHBondContact O-N 3.01Å; T123-Y127 PolarHBondContact O-N 2.95Å; T123-V180 HydrophobicContact CG2-CB 3.99Å; T123-V180 HydrophobicContact CG2-CG1 3.55Å; T123-N238 WeakPolarHBondContact OG1-CB 2.91Å; T123-N238 PolarHBondContact OG1-ND2 2.97Å
124	C	90.8	Very high	88.7	Confident	10 Å²	10	46.6 Å²	46.6	7%	0.068	25%	0.246	C	C	.	.	H	α-helix	trans	-67.3	-39.5	173.7	-60.6	0	0	0	0	111.6	K120 L121 Y127 I128 F280	K120-C124 PolarHBondContact O-N 2.89Å; L121-C124 PolarHBondContact O-N 2.95Å; C124-Y127 WeakPolarHBondContact O-CB 3.2Å; C124-Y127 PolarHBondContact O-N 2.92Å; C124-I128 PolarHBondContact O-N 2.94Å; C124-I128 VanDerWaalsContact O-N 3.14Å; C124-F280 HydrophobicContact CB-CE1 3.97Å; C124-F280 HydrophobicContact CB-CZ 3.99Å
125	L	91.5	Very high	87.4	Confident	91 Å²	91	53 Å²	53	48%	0.476	26%	0.263	S	S	.	.	H	α-helix	trans	-64	-41.7	173.8	-178.3	62	0	0	0	111.9	L121 L122 Y127 I128 I129	L121-L125 PolarHBondContact O-N 3.07Å; L122-L125 PolarHBondContact O-N 3.02Å; L125-Y127 VanDerWaalsContact C-N 3.25Å; L125-Y127 PolarHBondContact O-N 3Å; L125-I128 PolarHBondContact O-N 3.08Å; L125-I128 VanDerWaalsContact O-N 3.16Å; L125-I129 HydrophobicContact CD1-CD1 4.43Å; L125-I129 HydrophobicContact CG-CD1 4Å; L125-I129 WeakPolarHBondContact O-CG1 3.44Å; L125-I129 PolarHBondContact O-N 3.25Å
126	L	90.5	Very high	86	Confident	13 Å²	13	50.5 Å²	50.5	7%	0.068	26%	0.258	C	S	.	.	H	α-helix	trans	-64.5	-28.5	174.2	-70.9	165.9	0	0	0	112.6	L122 T123 R130 V173 I176 Q177	L122-L126 HydrophobicContact CD1-CD1 4.32Å; L122-L126 HydrophobicContact CD1-CG 4.36Å; L122-L126 HydrophobicContact CG-CD1 4.06Å; L122-L126 WeakPolarHBondContact O-CB 3.21Å; L122-L126 VanDerWaalsContact O-CG 3.26Å; L122-L126 WeakPolarHBondContact O-CG 3.47Å; L122-L126 PolarHBondContact O-N 2.95Å; T123-L126 PolarHBondContact O-N 3.01Å; L126-R130 WeakPolarHBondContact O-CB 3.48Å; L126-R130 PolarHBondContact O-N 3.38Å; L126-V173 HydrophobicContact CB-CG1 4.33Å; L126-V173 HydrophobicContact CD2-CG1 4.38Å; L126-I176 HydrophobicContact CD1-CB 4.13Å; L126-I176 HydrophobicContact CD1-CG2 3.57Å; L126-Q177 HydrophobicContact CB-CG 4.24Å; L126-Q177 HydrophobicContact CD1-CG 4.09Å
127	Y	90	Very high	84.4	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.008	29%	0.291	C	S	.	.	H	α-helix	trans	-66.9	-44.9	170	-172.5	-95.4	0	0	0	111.9	T123 C124 L125 R130 V131 F232 V235 F236 C284	T123-Y127 PolarHBondContact O-N 2.95Å; C124-Y127 WeakPolarHBondContact O-CB 3.2Å; C124-Y127 PolarHBondContact O-N 2.92Å; L125-Y127 VanDerWaalsContact C-N 3.25Å; L125-Y127 PolarHBondContact O-N 3Å; Y127-R130 WeakPolarHBondContact O-CB 3.43Å; Y127-R130 PolarHBondContact O-N 3.28Å; Y127-V131 HydrophobicContact CD1-CG2 4.13Å; Y127-V131 HydrophobicContact CE1-CG2 3.77Å; Y127-V131 WeakPolarHBondContact O-CG2 3.4Å; Y127-V131 PolarHBondContact O-N 3.23Å; Y127-F232 AromaticContact CE2-CE2 3.91Å; Y127-F232 HydrophobicContact CE2-CE2 3.91Å; Y127-F232 HydrophobicContact CE2-CZ 4.16Å; Y127-V235 HydrophobicContact CD2-CG1 3.57Å; Y127-V235 HydrophobicContact CE2-CG1 4.41Å; Y127-V235 HydrophobicContact CG-CG1 4.27Å; Y127-F236 HydrophobicContact CD1-CB 4.18Å; Y127-F236 HydrophobicContact CE1-CB 4.21Å; Y127-F236 HydrophobicContact CE1-CD1 4.49Å; Y127-F236 HydrophobicContact CE2-CD1 4.12Å; Y127-F236 HydrophobicContact CG-CB 4.37Å; Y127-F236 AromaticContact CZ-CD1 3.94Å; Y127-C284 HydrophobicContact CD1-CB 4.44Å; Y127-C284 HydrophobicContact CE1-CB 3.65Å; Y127-C284 VanDerWaalsContact CE1-SG 3.51Å; Y127-C284 PolarHBondContact OH-O 3.05Å
128	I	90.2	Very high	82.2	Confident	51 Å²	51	58.8 Å²	58.8	26%	0.262	32%	0.318	S	S	.	.	H	α-helix	trans	-60.2	-48	175.1	-62.5	164.6	0	0	0	110.3	C124 L125 R130 V131 M132 F280 L298	C124-I128 PolarHBondContact O-N 2.94Å; C124-I128 VanDerWaalsContact O-N 3.14Å; L125-I128 PolarHBondContact O-N 3.08Å; L125-I128 VanDerWaalsContact O-N 3.16Å; I128-R130 VanDerWaalsContact C-N 3.33Å; I128-R130 PolarHBondContact O-N 3.22Å; I128-V131 PolarHBondContact O-N 3.02Å; I128-M132 HydrophobicContact CG2-CG 4.41Å; I128-M132 HydrophobicContact CG2-SD 4.04Å; I128-M132 WeakPolarHBondContact O-CG 3.26Å; I128-M132 PolarHBondContact O-N 3.08Å; I128-F280 HydrophobicContact CD1-CE2 3.99Å; I128-F280 HydrophobicContact CD1-CZ 4.48Å; I128-F280 HydrophobicContact CG1-CE2 4.06Å; I128-F280 HydrophobicContact CG1-CZ 4.37Å; I128-L298 HydrophobicContact CG1-CD2 4.37Å; I128-L298 HydrophobicContact CG2-CD2 4Å
129	I	88.5	Confident	79.8	Confident	71 Å²	71	58.5 Å²	58.5	36%	0.364	33%	0.326	S	S	.	.	H	α-helix	trans	-60.3	-41.1	178	-67.3	165	0	0	0	111.3	L125 T133	L125-I129 HydrophobicContact CD1-CD1 4.43Å; L125-I129 HydrophobicContact CG-CD1 4Å; L125-I129 WeakPolarHBondContact O-CG1 3.44Å; L125-I129 PolarHBondContact O-N 3.25Å; I129-T133 WeakPolarHBondContact O-CB 3.24Å; I129-T133 WeakPolarHBondContact O-CG2 3.28Å; I129-T133 PolarHBondContact O-N 2.86Å; I129-T133 VanDerWaalsContact O-N 3.13Å; I129-T133 PolarHBondContact O-OG1 3.3Å
130	R	87.9	Confident	77.4	Confident	7 Å²	7	64.8 Å²	64.8	3%	0.026	37%	0.366	C	S	.	.	H	α-helix	trans	-56.3	-59.2	171.1	177.2	-169.8	-176.7	177.5	9.8	110.3	L126 Y127 I128 M132 T133 D134 V167 V173	L126-R130 WeakPolarHBondContact O-CB 3.48Å; L126-R130 PolarHBondContact O-N 3.38Å; Y127-R130 WeakPolarHBondContact O-CB 3.43Å; Y127-R130 PolarHBondContact O-N 3.28Å; I128-R130 VanDerWaalsContact C-N 3.33Å; I128-R130 PolarHBondContact O-N 3.22Å; R130-M132 PolarHBondContact O-N 2.96Å; R130-T133 PolarHBondContact O-N 2.96Å; R130-T133 PolarHBondContact O-OG1 3.48Å; R130-D134 VanDerWaalsContact O-CB 3.24Å; R130-D134 WeakPolarHBondContact O-CB 3.47Å; R130-D134 PolarHBondContact O-N 3.19Å; R130-V167 VanDerWaalsContact NH2-CB 3.28Å; R130-V167 VanDerWaalsContact NH2-CG1 3.29Å; R130-V167 PolarHBondContact NH2-O 2.85Å; R130-V167 VanDerWaalsContact NH2-O 3.07Å; R130-V173 HydrophobicContact CB-CG1 4.47Å
131	V	86.3	Confident	74.8	Confident	17 Å²	17	68.9 Å²	68.9	10%	0.103	41%	0.408	C	S	.	.	H	α-helix	trans	-58.7	-32.5	-176	173.7	0	0	0	0	112.6	Y127 I128 Q287 L298	Y127-V131 HydrophobicContact CD1-CG2 4.13Å; Y127-V131 HydrophobicContact CE1-CG2 3.77Å; Y127-V131 WeakPolarHBondContact O-CG2 3.4Å; Y127-V131 PolarHBondContact O-N 3.23Å; I128-V131 PolarHBondContact O-N 3.02Å; V131-Q287 HydrophobicContact CG1-CG 4.15Å; V131-L298 HydrophobicContact CG1-CB 4.14Å; V131-L298 HydrophobicContact CG1-CD1 4.45Å
132	M	82.8	Confident	72	Confident	147 Å²	147	68.6 Å²	68.6	72%	0.724	43%	0.425	S	S	*	.	H	α-helix	trans	-78.6	-18.6	175.3	-69	-174.3	73.1	0	0	114.9	I128 R130	I128-M132 HydrophobicContact CG2-CG 4.41Å; I128-M132 HydrophobicContact CG2-SD 4.04Å; I128-M132 WeakPolarHBondContact O-CG 3.26Å; I128-M132 PolarHBondContact O-N 3.08Å; R130-M132 PolarHBondContact O-N 2.96Å
133	T	78.6	Confident	69.1	Low	60 Å²	60	70.1 Å²	70.1	37%	0.368	44%	0.441	S	S	.	.	H	α-helix	trans	-107.9	-2.4	-177.1	57.6	0	0	0	0	114.5	I129 R130	I129-T133 WeakPolarHBondContact O-CB 3.24Å; I129-T133 WeakPolarHBondContact O-CG2 3.28Å; I129-T133 PolarHBondContact O-N 2.86Å; I129-T133 VanDerWaalsContact O-N 3.13Å; I129-T133 PolarHBondContact O-OG1 3.3Å; R130-T133 PolarHBondContact O-N 2.96Å; R130-T133 PolarHBondContact O-OG1 3.48Å
134	D	75.3	Confident	66.3	Low	32 Å²	32	78 Å²	78	17%	0.171	48%	0.477	C	S	.	.			trans	-86.8	144.1	179.9	-177.3	-4.8	0	0	0	110.8	R130 V167 R291	R130-D134 VanDerWaalsContact O-CB 3.24Å; R130-D134 WeakPolarHBondContact O-CB 3.47Å; R130-D134 PolarHBondContact O-N 3.19Å; D134-V167 VanDerWaalsContact OD2-CG1 3.31Å; D134-V167 WeakPolarHBondContact OD2-CG1 3.34Å; D134-R291 IonicContact OD1-NH1 2.7Å; D134-R291 IonicContact OD2-CZ 3.15Å; D134-R291 IonicContact OD2-NH1 2.84Å; D134-R291 PolarHBondContact OD2-NH1 2.84Å; D134-R291 IonicContact OD2-NH2 2.67Å; D134-R291 PolarHBondContact OD2-NH2 3.47Å
135	R	61.6	Low	63.6	Low	194 Å²	194	83.1 Å²	83.1	73%	0.732	51%	0.513	S	S	*	.			trans	-143.5	103.5	-179.2	-75.1	-172.3	175.2	-177.6	-2	109.6	G137	R135-G137 PolarHBondContact O-N 3.08Å
136	P	60.8	Low	60.8	Low	59 Å²	59	84.5 Å²	84.5	38%	0.383	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	51.9	-169.1	33.8	-38	0	0	0	113.4	L163 N295	P136-L163 HydrophobicContact CB-CD2 4.33Å; P136-N295 WeakPolarHBondContact CG-OD1 3.26Å
137	G	54.7	Low	58.1	Low	77 Å²	77	91.8 Å²	91.8	79%	0.794	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-161.4	21.1	-173.6	0	0	0	0	0	115.8	R135	R135-G137 PolarHBondContact O-N 3.08Å
138	Q	47.2	Very low	55.3	Low	164 Å²	164	96.8 Å²	96.8	77%	0.766	60%	0.598	S	S	*	*	S	Bend	trans	-141.3	31.1	-176.1	-152.3	162.7	16.1	0	0	113.3
139	G	42.1	Very low	52.8	Low	62 Å²	62	103.2 Å²	103.2	64%	0.639	63%	0.627	S	S	*	*			trans	-126.7	9.7	-162	0	0	0	0	0	118.6
140	T	39.6	Very low	49.9	Very low	151 Å²	151	110.9 Å²	110.9	93%	0.926	65%	0.651	S	S	*	*			trans	-146.2	126.9	173.5	21.5	0	0	0	0	112.2
141	G	37.9	Very low	47.2	Very low	87 Å²	87	117.8 Å²	117.8	90%	0.897	69%	0.689	S	S	*	*			trans	-117.9	109.7	171.5	0	0	0	0	0	110.6
142	G	33	Very low	45.1	Very low	75 Å²	75	120.9 Å²	120.9	77%	0.773	72%	0.724	S	S	*	*			trans	179.4	103.7	-179.2	0	0	0	0	0	112.7
143	S	32	Very low	42.6	Very low	97 Å²	97	118.3 Å²	118.3	68%	0.678	72%	0.721	S	S	*	*			trans	-10.3	116.3	172.6	-173.6	0	0	0	0	118
144	H	30.7	Very low	41	Very low	171 Å²	171	122.5 Å²	122.5	79%	0.792	75%	0.746	S	S	*	*				-170.9	122.5	99.8	-100.1	-69.8	0	0	0	112.2
145	S	34.7	Very low	39.1	Very low	118 Å²	118	128.8 Å²	128.8	83%	0.825	77%	0.774	S	S	*	*			trans	-97.4	117.6	168.9	54.6	0	0	0	0	110.4
146	V	31.4	Very low	38.2	Very low	119 Å²	119	127 Å²	127	72%	0.721	78%	0.779	S	S	*	*			trans	-138.3	114.1	164.7	-179.6	0	0	0	0	108.2
147	D	35.3	Very low	38.1	Very low	167 Å²	167	135 Å²	135	89%	0.893	80%	0.802	S	S	*	*			trans	-70.2	126.3	167.6	-73.7	-58.7	0	0	0	110
148	C	29.9	Very low	38.8	Very low	106 Å²	106	140 Å²	140	72%	0.716	80%	0.804	S	S	*	*			trans	-141.6	102.5	164.4	-93	0	0	0	0	110.8
149	Q	38.2	Very low	40.1	Very low	186 Å²	186	134.7 Å²	134.7	87%	0.869	78%	0.781	S	S	*	*			trans	-75.4	119.3	172.4	176.2	-172.8	14.1	0	0	110.4
150	W	28	Very low	41.9	Very low	233 Å²	233	136.3 Å²	136.3	88%	0.883	78%	0.775	S	S	*	*			trans	-138.6	146.7	169.6	-93.3	91.4	0	0	0	113.4
151	N	31.5	Very low	43.9	Very low	151 Å²	151	134.8 Å²	134.8	81%	0.807	75%	0.752	S	S	*	*			trans	-80.3	157.8	179.3	-78.4	-41.2	0	0	0	111.9
152	G	42.4	Very low	45.9	Very low	82 Å²	82	136 Å²	136	85%	0.845	74%	0.738	S	S	*	*			trans	-67.9	142	-162.9	0	0	0	0	0	116.8
153	S	29.6	Very low	48.1	Very low	94 Å²	94	134.8 Å²	134.8	66%	0.657	71%	0.714	S	S	*	*			trans	-136.6	168.8	144	65.6	0	0	0	0	108	Q155	S153-Q155 PolarHBondContact O-N 3.4Å
154	V	45.7	Very low	50.5	Low	148 Å²	148	130.7 Å²	130.7	90%	0.897	68%	0.684	S	S	*	*			trans	-78.4	110.7	175.9	-179.1	0	0	0	0	108.9
155	Q	35	Very low	53.1	Low	164 Å²	164	127.8 Å²	127.8	77%	0.766	67%	0.669	S	S	*	*			trans	-127.2	143.2	166.5	-76.5	-178	-67.6	0	0	109.2	S153 R157	S153-Q155 PolarHBondContact O-N 3.4Å; Q155-R157 PolarHBondContact O-N 3.05Å
156	D	43.2	Very low	55.5	Low	156 Å²	156	128.9 Å²	128.9	83%	0.834	66%	0.656	S	S	*	*			trans	-61.1	134	-176.9	-66	-69.4	0	0	0	111.6	E158	D156-E158 PolarHBondContact O-N 3.11Å; D156-E158 VanDerWaalsContact O-N 3.16Å
157	R	57.9	Low	58	Low	227 Å²	227	123.5 Å²	123.5	86%	0.857	62%	0.623	S	S	*	*			trans	-74.4	104.3	165.1	-73.1	-175	174.8	-163.2	-3	107.6	Q155 I159	Q155-R157 PolarHBondContact O-N 3.05Å; R157-I159 PolarHBondContact O-N 3.33Å
158	E	68.6	Low	60	Low	181 Å²	181	121.8 Å²	121.8	85%	0.846	61%	0.61	S	S	*	*			trans	-52.2	132.4	172.8	-64	-171.3	152.8	0	0	110.1	D156 N160	D156-E158 PolarHBondContact O-N 3.11Å; D156-E158 VanDerWaalsContact O-N 3.16Å; E158-N160 PolarHBondContact O-N 3.38Å
159	I	75.6	Confident	62.5	Low	53 Å²	53	117.5 Å²	117.5	27%	0.272	58%	0.578	S	S	.	*			trans	-77.8	122.5	-174.4	-61	169.6	0	0	0	108	R157 W161 A292 I321	R157-I159 PolarHBondContact O-N 3.33Å; I159-W161 HydrophobicContact CD1-CZ2 4.42Å; I159-W161 HydrophobicContact CG2-CD2 4.28Å; I159-W161 HydrophobicContact CG2-CG 4.45Å; I159-W161 HydrophobicContact CG2-CZ2 4.48Å; I159-W161 PolarHBondContact O-N 3.42Å; I159-A292 HydrophobicContact CG2-CB 3.84Å; I159-I321 HydrophobicContact CB-CG2 4.49Å; I159-I321 HydrophobicContact CD1-CG2 3.62Å; I159-I321 HydrophobicContact CG1-CG2 3.74Å; I159-I321 HydrophobicContact CG2-CG2 3.94Å
160	N	79.8	Confident	64.6	Low	96 Å²	96	114 Å²	114	51%	0.513	56%	0.56	S	S	.	*			trans	-72.7	73.8	176.9	-74.1	-26.6	0	0	0	111.3	E158 D162 L163 A292	E158-N160 PolarHBondContact O-N 3.38Å; N160-D162 PolarHBondContact O-N 2.77Å; N160-D162 VanDerWaalsContact O-N 3.16Å; N160-L163 HydrophobicContact CB-CD1 3.88Å; N160-L163 HydrophobicContact CB-CG 4.19Å; N160-L163 PolarHBondContact O-N 3.41Å; N160-A292 HydrophobicContact CB-CB 4.48Å; N160-A292 WeakPolarHBondContact O-CB 3.38Å
161	W	81	Confident	67.3	Low	119 Å²	119	106.1 Å²	106.1	45%	0.451	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-29	178.8	-69.5	100.1	0	0	0	113.2	I159 L163 I164 F165 P323	I159-W161 HydrophobicContact CD1-CZ2 4.42Å; I159-W161 HydrophobicContact CG2-CD2 4.28Å; I159-W161 HydrophobicContact CG2-CG 4.45Å; I159-W161 HydrophobicContact CG2-CZ2 4.48Å; I159-W161 PolarHBondContact O-N 3.42Å; W161-L163 VanDerWaalsContact C-N 3.26Å; W161-L163 PolarHBondContact O-N 3.22Å; W161-I164 HydrophobicContact CE3-CD1 3.91Å; W161-I164 HydrophobicContact CZ3-CD1 4.21Å; W161-I164 WeakPolarHBondContact O-CB 3.34Å; W161-I164 PolarHBondContact O-N 2.78Å; W161-F165 HydrophobicContact CB-CD2 4.37Å; W161-F165 HydrophobicContact CB-CE2 4.45Å; W161-F165 AromaticContact CE3-CE2 3.92Å; W161-F165 HydrophobicContact CE3-CE2 3.92Å; W161-F165 WeakPolarHBondContact O-CD2 3.25Å; W161-F165 PolarHBondContact O-N 3.32Å; W161-P323 HydrophobicContact CH2-CG 4.49Å
162	D	80.2	Confident	70	Confident	112 Å²	112	103 Å²	103	60%	0.599	53%	0.533	S	S	*	.	H	α-helix	trans	-59.5	-35.4	175.9	-67.9	-35.5	0	0	0	112.4	N160 I164 F165 W166	N160-D162 PolarHBondContact O-N 2.77Å; N160-D162 VanDerWaalsContact O-N 3.16Å; D162-I164 PolarHBondContact O-N 3.08Å; D162-F165 PolarHBondContact O-N 2.88Å; D162-W166 CarbonylContact O-C 3.59Å; D162-W166 WeakPolarHBondContact O-CA 3.38Å; D162-W166 WeakPolarHBondContact O-CB 3.2Å; D162-W166 PolarHBondContact O-N 3.08Å
163	L	79.5	Confident	72.1	Confident	51 Å²	51	99.9 Å²	99.9	27%	0.267	50%	0.497	S	S	.	.	H	α-helix	trans	-72.5	-10	176.8	-64.2	174.8	0	0	0	113.8	P136 N160 W161	P136-L163 HydrophobicContact CB-CD2 4.33Å; N160-L163 HydrophobicContact CB-CD1 3.88Å; N160-L163 HydrophobicContact CB-CG 4.19Å; N160-L163 PolarHBondContact O-N 3.41Å; W161-L163 VanDerWaalsContact C-N 3.26Å; W161-L163 PolarHBondContact O-N 3.22Å
164	I	83.3	Confident	75	Confident	11 Å²	11	97.6 Å²	97.6	6%	0.056	47%	0.474	C	S	.	.	H	α-helix	trans	-94.1	-51.3	173.9	-54.7	177.5	0	0	0	109	W161 D162 F232 H288 L289 A292	W161-I164 HydrophobicContact CE3-CD1 3.91Å; W161-I164 HydrophobicContact CZ3-CD1 4.21Å; W161-I164 WeakPolarHBondContact O-CB 3.34Å; W161-I164 PolarHBondContact O-N 2.78Å; D162-I164 PolarHBondContact O-N 3.08Å; I164-F232 WeakPolarHBondContact O-CB 3.35Å; I164-H288 PolarHBondContact O-CE1 3.09Å; I164-L289 HydrophobicContact CG2-CD2 4.36Å; I164-A292 HydrophobicContact CD1-CB 3.85Å; I164-A292 HydrophobicContact CG1-CB 3.88Å
165	F	85	Confident	77	Confident	110 Å²	110	92.3 Å²	92.3	48%	0.482	45%	0.446	S	S	.	.	H	α-helix	trans	-78.3	-41.7	-176.7	-68.8	-68.5	0	0	0	113.5	W161 D162 L231 F232	W161-F165 HydrophobicContact CB-CD2 4.37Å; W161-F165 HydrophobicContact CB-CE2 4.45Å; W161-F165 AromaticContact CE3-CE2 3.92Å; W161-F165 HydrophobicContact CE3-CE2 3.92Å; W161-F165 WeakPolarHBondContact O-CD2 3.25Å; W161-F165 PolarHBondContact O-N 3.32Å; D162-F165 PolarHBondContact O-N 2.88Å; F165-L231 HydrophobicContact CB-CD1 4.48Å; F165-L231 HydrophobicContact CD1-CD1 4.49Å; F165-L231 CarbonylContact O-C 3.53Å; F165-L231 WeakPolarHBondContact O-CA 3.16Å; F165-F232 PolarHBondContact O-N 2.84Å
166	W	84.7	Confident	79.7	Confident	141 Å²	141	88 Å²	88	53%	0.534	43%	0.428	S	S	.	.	B	Isolated β-bridge	trans	-103.9	118.1	-178.2	-58.6	92.7	0	0	0	110.6	D162 S227 D230	D162-W166 CarbonylContact O-C 3.59Å; D162-W166 WeakPolarHBondContact O-CA 3.38Å; D162-W166 WeakPolarHBondContact O-CB 3.2Å; D162-W166 PolarHBondContact O-N 3.08Å; W166-S227 VanDerWaalsContact CZ3-O 3.27Å; W166-S227 WeakPolarHBondContact CZ3-O 3.24Å; W166-D230 HydrophobicContact CE3-CB 4.27Å
167	V	83.2	Confident	81.9	Confident	6 Å²	6	80.6 Å²	80.6	4%	0.036	39%	0.388	C	S	.	.			trans	-142.9	105.9	-179.2	176.2	0	0	0	0	109.7	R130 D134 R169 D230 R291	R130-V167 VanDerWaalsContact NH2-CB 3.28Å; R130-V167 VanDerWaalsContact NH2-CG1 3.29Å; R130-V167 PolarHBondContact NH2-O 2.85Å; R130-V167 VanDerWaalsContact NH2-O 3.07Å; D134-V167 VanDerWaalsContact OD2-CG1 3.31Å; D134-V167 WeakPolarHBondContact OD2-CG1 3.34Å; V167-R169 PolarHBondContact O-N 2.83Å; V167-D230 PolarHBondContact N-O 2.66Å; V167-R291 VanDerWaalsContact CG1-NH1 3.32Å
168	E	78.5	Confident	83.5	Confident	131 Å²	131	70.4 Å²	70.4	61%	0.612	35%	0.351	S	S	*	.			trans	-46.8	116.9	-176.5	-167	-174	158.4	0	0	112.3	D230	E168-D230 WeakPolarHBondContact CA-OD1 3.41Å
169	R	80.8	Confident	84.6	Confident	15 Å²	15	66.4 Å²	66.4	6%	0.057	33%	0.334	C	S	.	.			trans	-105.9	118.8	177.1	-79.4	-168.8	-75.3	-139	-10.3	111.5	V167 A171 W174 K229 D230 L231	V167-R169 PolarHBondContact O-N 2.83Å; R169-A171 PolarHBondContact O-N 2.94Å; R169-A171 VanDerWaalsContact O-N 3.08Å; R169-W174 HydrophobicContact CB-CB 4.3Å; R169-K229 VanDerWaalsContact CZ-O 3.24Å; R169-K229 PolarHBondContact NE-O 3.26Å; R169-K229 PolarHBondContact NH2-O 3.42Å; R169-D230 PolarHBondContact N-OD1 2.9Å; R169-L231 PolarHBondContact NH2-O 3.19Å
170	K	83.9	Confident	85.4	Confident	113 Å²	113	64.1 Å²	64.1	49%	0.491	32%	0.323	S	S	.	.			trans	-52.4	119	166.5	-63.9	-172.5	-177.4	-173.9	0	109.9	P172 V173 W174	K170-P172 VanDerWaalsContact C-CD 3.41Å; K170-P172 VanDerWaalsContact C-N 3.34Å; K170-P172 VanDerWaalsContact O-N 3.09Å; K170-V173 HydrophobicContact CB-CG2 4.45Å; K170-V173 WeakPolarHBondContact O-CB 3.2Å; K170-V173 PolarHBondContact O-N 3.07Å; K170-W174 PolarHBondContact O-N 3.23Å
171	A	83.5	Confident	85.9	Confident	67 Å²	67	59.8 Å²	59.8	55%	0.554	30%	0.3	S	S	*	.	H	α-helix	trans	-42.3	-44.2	-175.3	0	0	0	0	0	116.1	R169 V173 W174 A175	R169-A171 PolarHBondContact O-N 2.94Å; R169-A171 VanDerWaalsContact O-N 3.08Å; A171-V173 PolarHBondContact O-N 2.64Å; A171-W174 PolarHBondContact O-N 2.93Å; A171-A175 WeakPolarHBondContact O-CB 2.93Å; A171-A175 PolarHBondContact O-N 3.21Å
172	P	88.1	Confident	86.4	Confident	87 Å²	87	57.2 Å²	57.2	57%	0.565	30%	0.295	S	S	*	.	H	α-helix	trans	-64.6	-34.1	177.4	23.9	-35	0	0	0	113.9	K170 A175 I176	K170-P172 VanDerWaalsContact C-CD 3.41Å; K170-P172 VanDerWaalsContact C-N 3.34Å; K170-P172 VanDerWaalsContact O-N 3.09Å; P172-A175 PolarHBondContact O-N 2.64Å; P172-I176 WeakPolarHBondContact O-CD1 3.46Å; P172-I176 VanDerWaalsContact O-CG1 3.27Å; P172-I176 WeakPolarHBondContact O-CG1 3.42Å; P172-I176 PolarHBondContact O-N 3.19Å; P172-I176 VanDerWaalsContact O-N 3.09Å
173	V	88.1	Confident	87	Confident	16 Å²	16	54.7 Å²	54.7	10%	0.097	28%	0.28	C	S	.	.	H	α-helix	trans	-69	-43.4	177.6	179.3	0	0	0	0	110.2	L126 R130 K170 A171 Q177	L126-V173 HydrophobicContact CB-CG1 4.33Å; L126-V173 HydrophobicContact CD2-CG1 4.38Å; R130-V173 HydrophobicContact CB-CG1 4.47Å; K170-V173 HydrophobicContact CB-CG2 4.45Å; K170-V173 WeakPolarHBondContact O-CB 3.2Å; K170-V173 PolarHBondContact O-N 3.07Å; A171-V173 PolarHBondContact O-N 2.64Å; V173-Q177 WeakPolarHBondContact O-CB 3.18Å; V173-Q177 VanDerWaalsContact O-CG 3.3Å; V173-Q177 WeakPolarHBondContact O-CG 3.38Å; V173-Q177 PolarHBondContact O-N 3.32Å
174	W	88.9	Confident	87.5	Confident	46 Å²	46	52.3 Å²	52.3	17%	0.174	27%	0.268	C	S	.	.	H	α-helix	trans	-60.6	-48.1	173.1	168.7	79.5	0	0	0	111.7	R169 K170 A171 I176 Q177 V178 T222 K229	R169-W174 HydrophobicContact CB-CB 4.3Å; K170-W174 PolarHBondContact O-N 3.23Å; A171-W174 PolarHBondContact O-N 2.93Å; W174-I176 PolarHBondContact O-N 3.12Å; W174-Q177 PolarHBondContact O-N 2.76Å; W174-V178 HydrophobicContact CD2-CG2 4.24Å; W174-V178 HydrophobicContact CG-CG2 4.43Å; W174-V178 HydrophobicContact CZ2-CG2 4.02Å; W174-V178 WeakPolarHBondContact O-CG2 3.14Å; W174-V178 PolarHBondContact O-N 3.07Å; W174-T222 PolarHBondContact NE1-OG1 2.68Å; W174-K229 HydrophobicContact CH2-CD 4.4Å; W174-K229 HydrophobicContact CZ2-CD 4.18Å; W174-K229 HydrophobicContact CZ2-CG 4.05Å
175	A	89.4	Confident	87.9	Confident	37 Å²	37	54.5 Å²	54.5	31%	0.306	28%	0.278	S	S	.	.	H	α-helix	trans	-60.1	-44.1	-178.5	0	0	0	0	0	112.6	A171 P172 V178 I179	A171-A175 WeakPolarHBondContact O-CB 2.93Å; A171-A175 PolarHBondContact O-N 3.21Å; P172-A175 PolarHBondContact O-N 2.64Å; A175-V178 PolarHBondContact O-N 3.41Å; A175-I179 VanDerWaalsContact O-CG1 3.32Å; A175-I179 WeakPolarHBondContact O-CG1 3.5Å; A175-I179 PolarHBondContact O-N 3.29Å
176	I	90.4	Very high	88.2	Confident	73 Å²	73	54.3 Å²	54.3	37%	0.374	28%	0.281	S	S	.	.	H	α-helix	trans	-66.7	-42.1	176.7	-61	163.8	0	0	0	110.6	L126 P172 W174 V178 I179 V180	L126-I176 HydrophobicContact CD1-CB 4.13Å; L126-I176 HydrophobicContact CD1-CG2 3.57Å; P172-I176 WeakPolarHBondContact O-CD1 3.46Å; P172-I176 VanDerWaalsContact O-CG1 3.27Å; P172-I176 WeakPolarHBondContact O-CG1 3.42Å; P172-I176 PolarHBondContact O-N 3.19Å; P172-I176 VanDerWaalsContact O-N 3.09Å; W174-I176 PolarHBondContact O-N 3.12Å; I176-V178 VanDerWaalsContact C-N 3.34Å; I176-V178 PolarHBondContact O-N 3.25Å; I176-I179 PolarHBondContact O-N 3.18Å; I176-V180 HydrophobicContact CG2-CG2 4.48Å; I176-V180 WeakPolarHBondContact O-CG2 3.31Å; I176-V180 PolarHBondContact O-N 3.5Å
177	Q	90.3	Very high	88.3	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-60.7	-40.9	176.4	-75.4	178	-18.6	0	0	112.5	L126 V173 W174 V180 A181 F219	L126-Q177 HydrophobicContact CB-CG 4.24Å; L126-Q177 HydrophobicContact CD1-CG 4.09Å; V173-Q177 WeakPolarHBondContact O-CB 3.18Å; V173-Q177 VanDerWaalsContact O-CG 3.3Å; V173-Q177 WeakPolarHBondContact O-CG 3.38Å; V173-Q177 PolarHBondContact O-N 3.32Å; W174-Q177 PolarHBondContact O-N 2.76Å; Q177-V180 PolarHBondContact O-N 3.02Å; Q177-A181 WeakPolarHBondContact O-CB 3.35Å; Q177-A181 PolarHBondContact O-N 3.05Å; Q177-F219 HydrophobicContact CB-CD1 4.17Å; Q177-F219 HydrophobicContact CB-CE1 3.57Å; Q177-F219 HydrophobicContact CB-CE2 4.41Å; Q177-F219 HydrophobicContact CB-CZ 3.73Å; Q177-F219 HydrophobicContact CG-CE1 4.41Å; Q177-F219 HydrophobicContact CG-CZ 4.22Å
178	V	91.2	Very high	88.6	Confident	12 Å²	12	49.3 Å²	49.3	7%	0.073	27%	0.265	C	S	.	.	H	α-helix	trans	-63.3	-44.6	175.1	169	0	0	0	0	111.7	W174 A175 I176 V180 A181 I182 F219 I223	W174-V178 HydrophobicContact CD2-CG2 4.24Å; W174-V178 HydrophobicContact CG-CG2 4.43Å; W174-V178 HydrophobicContact CZ2-CG2 4.02Å; W174-V178 WeakPolarHBondContact O-CG2 3.14Å; W174-V178 PolarHBondContact O-N 3.07Å; A175-V178 PolarHBondContact O-N 3.41Å; I176-V178 VanDerWaalsContact C-N 3.34Å; I176-V178 PolarHBondContact O-N 3.25Å; V178-V180 VanDerWaalsContact C-N 3.35Å; V178-V180 PolarHBondContact O-N 3.44Å; V178-A181 PolarHBondContact O-N 2.99Å; V178-I182 HydrophobicContact CG1-CD1 3.94Å; V178-I182 WeakPolarHBondContact O-CG1 3.18Å; V178-I182 PolarHBondContact O-N 2.88Å; V178-F219 HydrophobicContact CG2-CB 4.23Å; V178-F219 HydrophobicContact CG2-CD1 3.98Å; V178-I223 HydrophobicContact CG1-CD1 3.73Å; V178-I223 HydrophobicContact CG1-CG1 3.72Å
179	I	91.8	Very high	89	Confident	98 Å²	98	46.1 Å²	46.1	50%	0.503	25%	0.25	S	S	.	.	H	α-helix	trans	-59.5	-45.6	177	-69.4	163.7	0	0	0	110.8	A175 I176 I182 I183	A175-I179 VanDerWaalsContact O-CG1 3.32Å; A175-I179 WeakPolarHBondContact O-CG1 3.5Å; A175-I179 PolarHBondContact O-N 3.29Å; I176-I179 PolarHBondContact O-N 3.18Å; I179-I182 PolarHBondContact O-N 2.78Å; I179-I183 HydrophobicContact CG2-CD1 3.95Å; I179-I183 WeakPolarHBondContact O-CG1 3.48Å; I179-I183 PolarHBondContact O-N 3.28Å; I179-I183 VanDerWaalsContact O-N 3.12Å
180	V	91.8	Very high	89.4	Confident	5 Å²	5	48.1 Å²	48.1	3%	0.03	26%	0.262	C	S	.	.	H	α-helix	trans	-68.6	-35.2	178.8	-179.2	0	0	0	0	112.2	L119 L122 T123 I176 Q177 V178 I183 S184	L119-V180 HydrophobicContact CB-CG1 3.87Å; L119-V180 HydrophobicContact CD2-CG1 4.17Å; L119-V180 HydrophobicContact CD2-CG2 4.09Å; L119-V180 HydrophobicContact CG-CG1 4.42Å; L122-V180 HydrophobicContact CD2-CG2 4.38Å; T123-V180 HydrophobicContact CG2-CB 3.99Å; T123-V180 HydrophobicContact CG2-CG1 3.55Å; I176-V180 HydrophobicContact CG2-CG2 4.48Å; I176-V180 WeakPolarHBondContact O-CG2 3.31Å; I176-V180 PolarHBondContact O-N 3.5Å; Q177-V180 PolarHBondContact O-N 3.02Å; V178-V180 VanDerWaalsContact C-N 3.35Å; V178-V180 PolarHBondContact O-N 3.44Å; V180-I183 PolarHBondContact O-N 3.1Å; V180-S184 PolarHBondContact O-N 3.06Å; V180-S184 PolarHBondContact O-OG 2.86Å
181	A	90.6	Very high	89.4	Confident	5 Å²	5	45.4 Å²	45.4	4%	0.041	25%	0.253	C	S	.	.	H	α-helix	trans	-63.9	-42	174.5	0	0	0	0	0	112.2	Q177 V178 F185 T216 F219	Q177-A181 WeakPolarHBondContact O-CB 3.35Å; Q177-A181 PolarHBondContact O-N 3.05Å; V178-A181 PolarHBondContact O-N 2.99Å; A181-F185 WeakPolarHBondContact O-CB 3.3Å; A181-F185 PolarHBondContact O-N 3.28Å; A181-T216 HydrophobicContact CB-CG2 4.16Å; A181-F219 HydrophobicContact CB-CB 3.69Å; A181-F219 HydrophobicContact CB-CD2 4.07Å; A181-F219 HydrophobicContact CB-CG 4.16Å
182	I	91.9	Very high	89.5	Confident	64 Å²	64	44 Å²	44	33%	0.328	24%	0.235	S	C	.	.	H	α-helix	trans	-61.5	-47.5	174.5	-67.2	162.2	0	0	0	110.7	V178 I179 S184 L186 I220 I223	V178-I182 HydrophobicContact CG1-CD1 3.94Å; V178-I182 WeakPolarHBondContact O-CG1 3.18Å; V178-I182 PolarHBondContact O-N 2.88Å; I179-I182 PolarHBondContact O-N 2.78Å; I182-S184 PolarHBondContact O-N 2.91Å; I182-L186 HydrophobicContact CG2-CD1 3.87Å; I182-L186 HydrophobicContact CG2-CG 4.48Å; I182-L186 WeakPolarHBondContact O-CB 3.43Å; I182-L186 VanDerWaalsContact O-CG 3.28Å; I182-L186 WeakPolarHBondContact O-CG 3.46Å; I182-L186 PolarHBondContact O-N 3.31Å; I182-I220 HydrophobicContact CG1-CG1 4.49Å; I182-I223 HydrophobicContact CD1-CD1 3.95Å; I182-I223 HydrophobicContact CG1-CD1 4.41Å
183	I	91.8	Very high	89.5	Confident	59 Å²	59	45.7 Å²	45.7	30%	0.303	23%	0.231	S	C	.	.	H	α-helix	trans	-61	-47.3	-178.6	-66.9	164.3	0	0	0	111.1	F115 L119 I179 V180 L186 E187	F115-I183 HydrophobicContact CE1-CG2 4.18Å; L119-I183 HydrophobicContact CD1-CB 4.4Å; L119-I183 HydrophobicContact CD1-CG2 3.66Å; I179-I183 HydrophobicContact CG2-CD1 3.95Å; I179-I183 WeakPolarHBondContact O-CG1 3.48Å; I179-I183 PolarHBondContact O-N 3.28Å; I179-I183 VanDerWaalsContact O-N 3.12Å; V180-I183 PolarHBondContact O-N 3.1Å; I183-L186 PolarHBondContact O-N 3.15Å; I183-E187 PolarHBondContact O-N 3.39Å
184	S	90.3	Very high	89.3	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.014	23%	0.228	C	C	.	.	H	α-helix	trans	-77.7	-27.4	-176.5	49.3	0	0	0	0	114.3	K120 V180 I182 T188 E212	K120-S184 VanDerWaalsContact NZ-CB 3.29Å; K120-S184 PolarHBondContact NZ-OG 2.9Å; K120-S184 VanDerWaalsContact NZ-OG 3.14Å; V180-S184 PolarHBondContact O-N 3.06Å; V180-S184 PolarHBondContact O-OG 2.86Å; I182-S184 PolarHBondContact O-N 2.91Å; S184-T188 PolarHBondContact O-N 3.11Å; S184-T188 PolarHBondContact O-OG1 2.97Å; S184-E212 VanDerWaalsContact CB-OE1 3.23Å; S184-E212 WeakPolarHBondContact CB-OE1 3.4Å; S184-E212 PolarHBondContact OG-OE1 2.88Å
185	F	91.1	Very high	88.9	Confident	57 Å²	57	45.4 Å²	45.4	25%	0.25	24%	0.236	C	C	.	.	H	α-helix	trans	-62.9	-46.6	164.9	179.9	-95.1	0	0	0	111.8	A181 E187 T188 M189 M213 V217 I220	A181-F185 WeakPolarHBondContact O-CB 3.3Å; A181-F185 PolarHBondContact O-N 3.28Å; F185-E187 PolarHBondContact O-N 3.46Å; F185-T188 PolarHBondContact O-N 2.97Å; F185-T188 PolarHBondContact O-OG1 3.09Å; F185-T188 VanDerWaalsContact O-OG1 3.1Å; F185-M189 HydrophobicContact CD1-CG 4.18Å; F185-M189 HydrophobicContact CE1-CG 3.76Å; F185-M189 HydrophobicContact CE2-CE 4.17Å; F185-M189 HydrophobicContact CE2-CG 4.33Å; F185-M189 HydrophobicContact CE2-SD 4.47Å; F185-M189 HydrophobicContact CZ-CE 4.34Å; F185-M189 HydrophobicContact CZ-CG 3.84Å; F185-M189 HydrophobicContact CZ-SD 4.04Å; F185-M189 VanDerWaalsContact O-CG 3.3Å; F185-M189 WeakPolarHBondContact O-CG 3.08Å; F185-M189 PolarHBondContact O-N 3.01Å; F185-M213 HydrophobicContact CD2-CE 3.8Å; F185-M213 HydrophobicContact CD2-SD 4.24Å; F185-M213 HydrophobicContact CE2-CE 3.96Å; F185-M213 HydrophobicContact CE2-SD 3.9Å; F185-V217 HydrophobicContact CE2-CG2 4.35Å; F185-I220 HydrophobicContact CB-CD1 3.95Å; F185-I220 HydrophobicContact CD1-CD1 4.04Å; F185-I220 HydrophobicContact CD2-CD1 4.07Å; F185-I220 HydrophobicContact CG-CD1 3.74Å
186	L	91.1	Very high	88.8	Confident	105 Å²	105	48.8 Å²	48.8	55%	0.55	24%	0.242	S	C	.	.	H	α-helix	trans	-63.7	-41.2	177.1	-71.8	171.3	0	0	0	111.9	I182 I183 L190	I182-L186 HydrophobicContact CG2-CD1 3.87Å; I182-L186 HydrophobicContact CG2-CG 4.48Å; I182-L186 WeakPolarHBondContact O-CB 3.43Å; I182-L186 VanDerWaalsContact O-CG 3.28Å; I182-L186 WeakPolarHBondContact O-CG 3.46Å; I182-L186 PolarHBondContact O-N 3.31Å; I183-L186 PolarHBondContact O-N 3.15Å; L186-L190 VanDerWaalsContact O-CB 3.29Å; L186-L190 WeakPolarHBondContact O-CB 3.33Å; L186-L190 PolarHBondContact O-N 3.11Å
187	E	88.4	Confident	88.4	Confident	19 Å²	19	55.3 Å²	55.3	9%	0.089	27%	0.268	C	S	.	.	H	α-helix	trans	-62.4	-42.4	176.5	-167	-174.8	146.1	0	0	112.1	F102 N116 I183 F185 L190 L191	F102-E187 HydrophobicContact CE1-CG 4.36Å; N116-E187 PolarHBondContact ND2-OE1 3.46Å; N116-E187 PolarHBondContact ND2-OE2 2.88Å; I183-E187 PolarHBondContact O-N 3.39Å; F185-E187 PolarHBondContact O-N 3.46Å; E187-L190 WeakPolarHBondContact O-CB 3.45Å; E187-L190 PolarHBondContact O-N 3.06Å; E187-L191 HydrophobicContact CG-CD1 4.24Å; E187-L191 WeakPolarHBondContact O-CG 3.27Å; E187-L191 PolarHBondContact O-N 3.11Å
188	T	87.8	Confident	88	Confident	23 Å²	23	57 Å²	57	14%	0.141	29%	0.286	C	S	.	.	H	α-helix	trans	-72.9	-38	-179.9	48.4	0	0	0	0	113.1	S184 F185 L190 L191 M192 E212	S184-T188 PolarHBondContact O-N 3.11Å; S184-T188 PolarHBondContact O-OG1 2.97Å; F185-T188 PolarHBondContact O-N 2.97Å; F185-T188 PolarHBondContact O-OG1 3.09Å; F185-T188 VanDerWaalsContact O-OG1 3.1Å; T188-L190 VanDerWaalsContact C-N 3.25Å; T188-L190 PolarHBondContact O-N 3.4Å; T188-L191 PolarHBondContact O-N 2.69Å; T188-M192 WeakPolarHBondContact O-CB 3.26Å; T188-M192 PolarHBondContact O-N 3.43Å; T188-E212 HydrophobicContact CG2-CG 3.78Å
189	M	88.1	Confident	87.8	Confident	64 Å²	64	61.2 Å²	61.2	32%	0.315	31%	0.308	S	S	.	.	H	α-helix	trans	-58	-39.3	168.2	-69.9	-64.6	104.9	0	0	111.9	F185 M192 Y193 F209 M213	F185-M189 HydrophobicContact CD1-CG 4.18Å; F185-M189 HydrophobicContact CE1-CG 3.76Å; F185-M189 HydrophobicContact CE2-CE 4.17Å; F185-M189 HydrophobicContact CE2-CG 4.33Å; F185-M189 HydrophobicContact CE2-SD 4.47Å; F185-M189 HydrophobicContact CZ-CE 4.34Å; F185-M189 HydrophobicContact CZ-CG 3.84Å; F185-M189 HydrophobicContact CZ-SD 4.04Å; F185-M189 VanDerWaalsContact O-CG 3.3Å; F185-M189 WeakPolarHBondContact O-CG 3.08Å; F185-M189 PolarHBondContact O-N 3.01Å; M189-M192 HydrophobicContact CE-SD 4.43Å; M189-M192 WeakPolarHBondContact O-CB 3.44Å; M189-Y193 PolarHBondContact O-N 3.39Å; M189-F209 HydrophobicContact CE-CE2 3.63Å; M189-F209 HydrophobicContact CE-CZ 3.85Å; M189-M213 HydrophobicContact CE-CE 4.12Å
190	L	88.3	Confident	87.5	Confident	57 Å²	57	60.5 Å²	60.5	30%	0.298	30%	0.304	S	S	.	.	H	α-helix	trans	-70.1	-45.9	179.1	-161.8	62.2	0	0	0	111.8	L98 F102 L186 E187 T188 M192 Y193 L194	L98-L190 HydrophobicContact CD2-CD1 3.58Å; L98-L190 HydrophobicContact CD2-CD2 3.85Å; L98-L190 HydrophobicContact CD2-CG 3.91Å; F102-L190 HydrophobicContact CD2-CD2 4.47Å; F102-L190 HydrophobicContact CE1-CD2 4.18Å; F102-L190 HydrophobicContact CE2-CD2 3.63Å; F102-L190 HydrophobicContact CZ-CD2 3.47Å; F102-L190 VanDerWaalsContact CZ-CD2 3.47Å; L186-L190 VanDerWaalsContact O-CB 3.29Å; L186-L190 WeakPolarHBondContact O-CB 3.33Å; L186-L190 PolarHBondContact O-N 3.11Å; E187-L190 WeakPolarHBondContact O-CB 3.45Å; E187-L190 PolarHBondContact O-N 3.06Å; T188-L190 VanDerWaalsContact C-N 3.25Å; T188-L190 PolarHBondContact O-N 3.4Å; L190-M192 VanDerWaalsContact C-N 3.31Å; L190-M192 PolarHBondContact O-N 3.37Å; L190-Y193 PolarHBondContact O-N 3.38Å; L190-L194 HydrophobicContact CG-CD1 4.38Å; L190-L194 VanDerWaalsContact O-CG 3.28Å; L190-L194 WeakPolarHBondContact O-CG 3.41Å; L190-L194 PolarHBondContact O-N 2.65Å
191	L	85.2	Confident	87.3	Confident	56 Å²	56	68.8 Å²	68.8	29%	0.293	34%	0.335	S	S	.	.	H	α-helix	trans	-61.6	-37.6	175.5	-73.3	171.3	0	0	0	112	F102 E187 T188 L194 S195	F102-L191 HydrophobicContact CB-CD2 4.45Å; F102-L191 HydrophobicContact CD1-CD2 4.08Å; E187-L191 HydrophobicContact CG-CD1 4.24Å; E187-L191 WeakPolarHBondContact O-CG 3.27Å; E187-L191 PolarHBondContact O-N 3.11Å; T188-L191 PolarHBondContact O-N 2.69Å; L191-L194 PolarHBondContact O-N 2.74Å; L191-S195 VanDerWaalsContact O-CB 3.26Å; L191-S195 WeakPolarHBondContact O-CB 3.43Å; L191-S195 PolarHBondContact O-N 3.02Å; L191-S195 PolarHBondContact O-OG 3.46Å
192	M	84.8	Confident	87.1	Confident	39 Å²	39	75.1 Å²	75.1	19%	0.192	36%	0.364	C	S	.	.	H	α-helix	trans	-57.6	-52.6	172.7	-172.1	-174.1	-177.1	0	0	111	T188 M189 L190 L194 S195 Y196 I200 Q203 I204 F209	T188-M192 WeakPolarHBondContact O-CB 3.26Å; T188-M192 PolarHBondContact O-N 3.43Å; M189-M192 HydrophobicContact CE-SD 4.43Å; M189-M192 WeakPolarHBondContact O-CB 3.44Å; L190-M192 VanDerWaalsContact C-N 3.31Å; L190-M192 PolarHBondContact O-N 3.37Å; M192-L194 VanDerWaalsContact C-N 3.35Å; M192-L194 PolarHBondContact O-N 2.89Å; M192-S195 PolarHBondContact O-N 3.13Å; M192-S195 PolarHBondContact O-OG 3.43Å; M192-Y196 WeakPolarHBondContact O-CB 3.27Å; M192-Y196 PolarHBondContact O-N 2.92Å; M192-I200 HydrophobicContact CE-CB 4.5Å; M192-I200 HydrophobicContact CE-CG1 4.43Å; M192-I200 HydrophobicContact CE-CG2 3.73Å; M192-Q203 VanDerWaalsContact CG-OE1 3.24Å; M192-I204 HydrophobicContact CE-CD1 4.17Å; M192-I204 HydrophobicContact CE-CG1 3.91Å; M192-F209 HydrophobicContact SD-CE2 4.17Å
193	Y	87.3	Confident	86.7	Confident	122 Å²	122	73.5 Å²	73.5	48%	0.478	36%	0.355	S	S	.	.	H	α-helix	trans	-58.5	-41.2	177.2	175.3	-98.5	0	0	0	113.5	K95 M189 L190	K95-Y193 HydrophobicContact CB-CE1 4Å; K95-Y193 HydrophobicContact CD-CE1 4.02Å; K95-Y193 WeakPolarHBondContact CE-O 3.43Å; K95-Y193 HydrophobicContact CG-CD1 4.5Å; K95-Y193 HydrophobicContact CG-CE1 3.77Å; K95-Y193 PolarHBondContact NZ-O 3.37Å; M189-Y193 PolarHBondContact O-N 3.39Å; L190-Y193 PolarHBondContact O-N 3.38Å
194	L	85	Confident	86.5	Confident	5 Å²	5	73 Å²	73	3%	0.026	35%	0.352	C	S	.	.	H	α-helix	trans	-74.9	-33.5	-178.5	-62.5	175.7	0	0	0	113.3	K95 L98 K99 F102 I103 L190 L191 M192	K95-L194 HydrophobicContact CG-CD2 4.16Å; K95-L194 WeakPolarHBondContact O-CD2 3.47Å; L98-L194 HydrophobicContact CB-CD1 3.97Å; L98-L194 HydrophobicContact CB-CD2 3.56Å; L98-L194 HydrophobicContact CB-CG 4.39Å; L98-L194 HydrophobicContact CD2-CD1 4.4Å; K99-L194 HydrophobicContact CB-CD2 4.21Å; F102-L194 HydrophobicContact CB-CD1 3.86Å; F102-L194 HydrophobicContact CD2-CD1 3.95Å; F102-L194 HydrophobicContact CG-CD1 3.96Å; I103-L194 HydrophobicContact CD1-CB 4.22Å; L190-L194 HydrophobicContact CG-CD1 4.38Å; L190-L194 VanDerWaalsContact O-CG 3.28Å; L190-L194 WeakPolarHBondContact O-CG 3.41Å; L190-L194 PolarHBondContact O-N 2.65Å; L191-L194 PolarHBondContact O-N 2.74Å; M192-L194 VanDerWaalsContact C-N 3.35Å; M192-L194 PolarHBondContact O-N 2.89Å
195	S	81.1	Confident	86.4	Confident	51 Å²	51	79.4 Å²	79.4	36%	0.357	38%	0.38	S	S	.	.	H	α-helix	trans	-88.8	-10.9	179.6	61.9	0	0	0	0	114.2	L191 M192 K197 Q203	L191-S195 VanDerWaalsContact O-CB 3.26Å; L191-S195 WeakPolarHBondContact O-CB 3.43Å; L191-S195 PolarHBondContact O-N 3.02Å; L191-S195 PolarHBondContact O-OG 3.46Å; M192-S195 PolarHBondContact O-N 3.13Å; M192-S195 PolarHBondContact O-OG 3.43Å; S195-K197 PolarHBondContact O-N 3.24Å; S195-Q203 PolarHBondContact O-NE2 2.89Å; S195-Q203 PolarHBondContact OG-NE2 2.98Å
196	Y	85.6	Confident	86.2	Confident	107 Å²	107	82.3 Å²	82.3	42%	0.42	39%	0.394	S	S	.	.			trans	-54.7	119.4	-179.8	176.2	-109.8	0	0	0	113.1	M192 G198 I200	M192-Y196 WeakPolarHBondContact O-CB 3.27Å; M192-Y196 PolarHBondContact O-N 2.92Å; Y196-G198 VanDerWaalsContact CE2-O 3.26Å; Y196-G198 WeakPolarHBondContact CE2-O 3.37Å; Y196-G198 PolarHBondContact OH-O 3.4Å; Y196-G198 VanDerWaalsContact OH-O 3.1Å; Y196-I200 HydrophobicContact CD2-CG1 4.07Å; Y196-I200 HydrophobicContact CE2-CD1 4.43Å; Y196-I200 HydrophobicContact CE2-CG1 3.77Å
197	K	83	Confident	86.1	Confident	210 Å²	210	82.2 Å²	82.2	91%	0.913	40%	0.398	S	S	*	.	S	Bend	trans	-114.9	-1.6	179.1	-72.1	177.7	-178	178.1	0	114.6	S195	S195-K197 PolarHBondContact O-N 3.24Å
198	G	82.1	Confident	86	Confident	37 Å²	37	83 Å²	83	38%	0.381	41%	0.406	S	S	.	.	S	Bend	trans	138.7	-41.9	-177.2	0	0	0	0	0	113.3	Y196	Y196-G198 VanDerWaalsContact CE2-O 3.26Å; Y196-G198 WeakPolarHBondContact CE2-O 3.37Å; Y196-G198 PolarHBondContact OH-O 3.4Å; Y196-G198 VanDerWaalsContact OH-O 3.1Å
199	N	87.1	Confident	86.1	Confident	101 Å²	101	83.3 Å²	83.3	54%	0.54	41%	0.405	S	S	.	.			trans	-95.2	115.9	179.1	-65.7	-24.5	0	0	0	111.5	E202	N199-E202 HydrophobicContact CB-CB 3.75Å; N199-E202 WeakPolarHBondContact CB-OE2 3.49Å; N199-E202 PolarHBondContact ND2-OE2 3.48Å
200	I	85.3	Confident	86.2	Confident	83 Å²	83	83.7 Å²	83.7	43%	0.426	41%	0.408	S	S	.	.	S	Bend	trans	-77.3	-42.6	168.5	-77.4	169.9	0	0	0	110.9	M192 Y196 E202 Q203 I204	M192-I200 HydrophobicContact CE-CB 4.5Å; M192-I200 HydrophobicContact CE-CG1 4.43Å; M192-I200 HydrophobicContact CE-CG2 3.73Å; Y196-I200 HydrophobicContact CD2-CG1 4.07Å; Y196-I200 HydrophobicContact CE2-CD1 4.43Å; Y196-I200 HydrophobicContact CE2-CG1 3.77Å; I200-E202 VanDerWaalsContact C-N 3.31Å; I200-E202 PolarHBondContact O-N 3.45Å; I200-Q203 WeakPolarHBondContact O-CB 3.33Å; I200-Q203 PolarHBondContact O-N 3.39Å; I200-I204 HydrophobicContact CG2-CD1 3.47Å; I200-I204 VanDerWaalsContact CG2-CD1 3.47Å; I200-I204 HydrophobicContact CG2-CG1 4.06Å; I200-I204 PolarHBondContact O-N 3.44Å; I200-I204 VanDerWaalsContact O-N 3.08Å
201	W	87.2	Confident	86.3	Confident	179 Å²	179	82.4 Å²	82.4	68%	0.678	40%	0.401	S	S	*	.	H	α-helix	trans	-59	-38.8	-176.2	-70.3	113.5	0	0	0	113.8	Q203 I204 F205	W201-Q203 PolarHBondContact O-N 3.35Å; W201-I204 PolarHBondContact O-N 2.94Å; W201-F205 HydrophobicContact CB-CD2 4.43Å; W201-F205 HydrophobicContact CD2-CE2 4.42Å; W201-F205 HydrophobicContact CE3-CD2 4.21Å; W201-F205 AromaticContact CE3-CE2 3.56Å; W201-F205 HydrophobicContact CE3-CE2 3.56Å; W201-F205 HydrophobicContact CE3-CZ 4.25Å; W201-F205 HydrophobicContact CZ3-CE2 4.12Å; W201-F205 HydrophobicContact CZ3-CZ 4.37Å; W201-F205 WeakPolarHBondContact O-CD2 3.4Å; W201-F205 PolarHBondContact O-N 3.17Å
202	E	86.6	Confident	86.6	Confident	138 Å²	138	80 Å²	80	65%	0.645	39%	0.389	S	S	*	.	H	α-helix	trans	-58	-35.1	176.4	-170.9	-178.1	149.4	0	0	112.3	N199 I200	N199-E202 HydrophobicContact CB-CB 3.75Å; N199-E202 WeakPolarHBondContact CB-OE2 3.49Å; N199-E202 PolarHBondContact ND2-OE2 3.48Å; I200-E202 VanDerWaalsContact C-N 3.31Å; I200-E202 PolarHBondContact O-N 3.45Å
203	Q	83.2	Confident	86.9	Confident	29 Å²	29	80 Å²	80	14%	0.136	39%	0.388	C	S	.	.	H	α-helix	trans	-81.6	-39	178.1	-56.4	-175.3	-36.7	0	0	111.8	M192 S195 I200 W201 Q206 F209	M192-Q203 VanDerWaalsContact CG-OE1 3.24Å; S195-Q203 PolarHBondContact O-NE2 2.89Å; S195-Q203 PolarHBondContact OG-NE2 2.98Å; I200-Q203 WeakPolarHBondContact O-CB 3.33Å; I200-Q203 PolarHBondContact O-N 3.39Å; W201-Q203 PolarHBondContact O-N 3.35Å; Q203-Q206 WeakPolarHBondContact O-CB 3.33Å; Q203-Q206 PolarHBondContact O-N 2.88Å; Q203-F209 WeakPolarHBondContact O-CB 3.39Å
204	I	87.1	Confident	87.1	Confident	48 Å²	48	78.3 Å²	78.3	25%	0.246	39%	0.387	C	S	.	.	H	α-helix	trans	-67.3	-38.9	179.7	-68.9	-179.3	0	0	0	111.9	M192 I200 W201 Q206 F209 L210	M192-I204 HydrophobicContact CE-CD1 4.17Å; M192-I204 HydrophobicContact CE-CG1 3.91Å; I200-I204 HydrophobicContact CG2-CD1 3.47Å; I200-I204 VanDerWaalsContact CG2-CD1 3.47Å; I200-I204 HydrophobicContact CG2-CG1 4.06Å; I200-I204 PolarHBondContact O-N 3.44Å; I200-I204 VanDerWaalsContact O-N 3.08Å; W201-I204 PolarHBondContact O-N 2.94Å; I204-Q206 PolarHBondContact O-N 3.03Å; I204-F209 HydrophobicContact CB-CD1 4.4Å; I204-F209 HydrophobicContact CB-CE1 4.28Å; I204-F209 HydrophobicContact CG1-CE1 4.07Å; I204-F209 HydrophobicContact CG1-CZ 4.29Å; I204-F209 HydrophobicContact CG2-CD1 4.33Å; I204-F209 HydrophobicContact CG2-CE1 4.11Å; I204-F209 WeakPolarHBondContact O-CD1 3.48Å; I204-L210 WeakPolarHBondContact O-CD2 3.29Å
205	F	88.3	Confident	87.3	Confident	137 Å²	137	78.1 Å²	78.1	60%	0.601	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	0.1	177.7	-75.2	-63.7	0	0	0	114.1	W201 V207	W201-F205 HydrophobicContact CB-CD2 4.43Å; W201-F205 HydrophobicContact CD2-CE2 4.42Å; W201-F205 HydrophobicContact CE3-CD2 4.21Å; W201-F205 AromaticContact CE3-CE2 3.56Å; W201-F205 HydrophobicContact CE3-CE2 3.56Å; W201-F205 HydrophobicContact CE3-CZ 4.25Å; W201-F205 HydrophobicContact CZ3-CE2 4.12Å; W201-F205 HydrophobicContact CZ3-CZ 4.37Å; W201-F205 WeakPolarHBondContact O-CD2 3.4Å; W201-F205 PolarHBondContact O-N 3.17Å; F205-V207 PolarHBondContact O-N 2.77Å
206	Q	88.3	Confident	87.8	Confident	118 Å²	118	75.8 Å²	75.8	55%	0.551	37%	0.37	S	S	*	.	S	Bend	trans	-67.9	130.5	174.4	-162.2	-179.6	11	0	0	110.3	Q203 I204 S208 F209 L210	Q203-Q206 WeakPolarHBondContact O-CB 3.33Å; Q203-Q206 PolarHBondContact O-N 2.88Å; I204-Q206 PolarHBondContact O-N 3.03Å; Q206-S208 WeakPolarHBondContact CG-OG 3.39Å; Q206-S208 PolarHBondContact O-N 3.16Å; Q206-S208 VanDerWaalsContact O-N 3.11Å; Q206-F209 HydrophobicContact CB-CB 4.48Å; Q206-F209 WeakPolarHBondContact O-CA 3.33Å; Q206-F209 WeakPolarHBondContact O-CB 3.2Å; Q206-F209 PolarHBondContact O-N 3.2Å; Q206-L210 PolarHBondContact O-N 3.36Å
207	V	88.2	Confident	88	Confident	103 Å²	103	73.2 Å²	73.2	62%	0.624	37%	0.365	S	S	*	.	H	α-helix	trans	-54.8	-35.9	-175.3	-179.4	0	0	0	0	112.8	F205 L210 L211	F205-V207 PolarHBondContact O-N 2.77Å; V207-L210 PolarHBondContact O-N 2.9Å; V207-L211 HydrophobicContact CG1-CD1 3.97Å; V207-L211 HydrophobicContact CG1-CG 4.31Å; V207-L211 WeakPolarHBondContact O-CB 3.43Å; V207-L211 WeakPolarHBondContact O-CG 3.43Å; V207-L211 PolarHBondContact O-N 3.16Å
208	S	87.3	Confident	88.4	Confident	37 Å²	37	65.1 Å²	65.1	26%	0.259	33%	0.333	S	S	.	.	H	α-helix	trans	-64.2	-37.6	174.2	46.6	0	0	0	0	113.3	Q206 E212 L241	Q206-S208 WeakPolarHBondContact CG-OG 3.39Å; Q206-S208 PolarHBondContact O-N 3.16Å; Q206-S208 VanDerWaalsContact O-N 3.11Å; S208-E212 WeakPolarHBondContact O-CB 3.48Å; S208-E212 PolarHBondContact O-N 3.44Å; S208-E212 VanDerWaalsContact O-N 3.07Å; S208-L241 VanDerWaalsContact O-CD2 3.28Å; S208-L241 WeakPolarHBondContact O-CD2 3.46Å
209	F	89.6	Confident	88.7	Confident	29 Å²	29	63.5 Å²	63.5	13%	0.127	32%	0.316	C	S	.	.	H	α-helix	trans	-70	-44.1	175.2	-174.6	-88.1	0	0	0	111.1	M189 M192 Q203 I204 Q206 L211 E212 M213	M189-F209 HydrophobicContact CE-CE2 3.63Å; M189-F209 HydrophobicContact CE-CZ 3.85Å; M192-F209 HydrophobicContact SD-CE2 4.17Å; Q203-F209 WeakPolarHBondContact O-CB 3.39Å; I204-F209 HydrophobicContact CB-CD1 4.4Å; I204-F209 HydrophobicContact CB-CE1 4.28Å; I204-F209 HydrophobicContact CG1-CE1 4.07Å; I204-F209 HydrophobicContact CG1-CZ 4.29Å; I204-F209 HydrophobicContact CG2-CD1 4.33Å; I204-F209 HydrophobicContact CG2-CE1 4.11Å; I204-F209 WeakPolarHBondContact O-CD1 3.48Å; Q206-F209 HydrophobicContact CB-CB 4.48Å; Q206-F209 WeakPolarHBondContact O-CA 3.33Å; Q206-F209 WeakPolarHBondContact O-CB 3.2Å; Q206-F209 PolarHBondContact O-N 3.2Å; F209-L211 PolarHBondContact O-N 3.2Å; F209-E212 WeakPolarHBondContact O-CB 3.37Å; F209-E212 PolarHBondContact O-N 3.27Å; F209-M213 HydrophobicContact CD1-CG 3.88Å; F209-M213 HydrophobicContact CE1-CG 3.49Å; F209-M213 VanDerWaalsContact CE1-CG 3.49Å; F209-M213 HydrophobicContact CE1-SD 4.14Å; F209-M213 HydrophobicContact CE2-CE 4.14Å; F209-M213 HydrophobicContact CZ-CE 4.12Å; F209-M213 HydrophobicContact CZ-CG 3.94Å; F209-M213 HydrophobicContact CZ-SD 3.97Å; F209-M213 WeakPolarHBondContact O-CG 3.4Å; F209-M213 PolarHBondContact O-N 2.97Å
210	L	90.1	Very high	88.8	Confident	71 Å²	71	60.4 Å²	60.4	37%	0.372	30%	0.299	S	S	.	.	H	α-helix	trans	-60.8	-46.5	178	-64.7	173.9	0	0	0	111.8	I204 Q206 V207 E212 M213 I214	I204-L210 WeakPolarHBondContact O-CD2 3.29Å; Q206-L210 PolarHBondContact O-N 3.36Å; V207-L210 PolarHBondContact O-N 2.9Å; L210-E212 VanDerWaalsContact C-N 3.34Å; L210-E212 PolarHBondContact O-N 3.02Å; L210-M213 PolarHBondContact O-N 2.95Å; L210-I214 WeakPolarHBondContact O-CB 3.25Å; L210-I214 WeakPolarHBondContact O-CD1 3.41Å; L210-I214 VanDerWaalsContact O-CG1 3.23Å; L210-I214 WeakPolarHBondContact O-CG1 3.47Å; L210-I214 PolarHBondContact O-N 3.13Å
211	L	90.4	Very high	89.1	Confident	31 Å²	31	60.1 Å²	60.1	16%	0.162	30%	0.297	C	S	.	.	H	α-helix	trans	-63	-37.9	175	-73.5	173.3	0	0	0	112.5	V207 F209 N215 L237 W240 L241	V207-L211 HydrophobicContact CG1-CD1 3.97Å; V207-L211 HydrophobicContact CG1-CG 4.31Å; V207-L211 WeakPolarHBondContact O-CB 3.43Å; V207-L211 WeakPolarHBondContact O-CG 3.43Å; V207-L211 PolarHBondContact O-N 3.16Å; F209-L211 PolarHBondContact O-N 3.2Å; L211-N215 WeakPolarHBondContact O-CB 3.33Å; L211-N215 VanDerWaalsContact O-CG 3.29Å; L211-N215 PolarHBondContact O-N 3.16Å; L211-N215 VanDerWaalsContact O-N 3.16Å; L211-N215 PolarHBondContact O-ND2 3.25Å; L211-L237 HydrophobicContact CD2-CB 4.4Å; L211-L237 HydrophobicContact CD2-CD1 4.27Å; L211-W240 HydrophobicContact CD1-CB 4.01Å; L211-L241 HydrophobicContact CB-CD1 4.17Å; L211-L241 HydrophobicContact CB-CD2 3.94Å; L211-L241 HydrophobicContact CB-CG 4.11Å
212	E	90.9	Very high	89.1	Confident	6 Å²	6	51.6 Å²	51.6	3%	0.028	27%	0.266	C	S	.	.	H	α-helix	trans	-61.9	-47.3	174.6	-171.2	75.1	-146	0	0	111.3	K120 S184 T188 S208 F209 L210 N215 T216 L241	K120-E212 WeakPolarHBondContact CE-OE2 3.5Å; K120-E212 IonicContact NZ-OE1 2.76Å; K120-E212 PolarHBondContact NZ-OE1 2.93Å; K120-E212 IonicContact NZ-OE2 3.86Å; K120-E212 PolarHBondContact NZ-OE2 3.32Å; S184-E212 VanDerWaalsContact CB-OE1 3.23Å; S184-E212 WeakPolarHBondContact CB-OE1 3.4Å; S184-E212 PolarHBondContact OG-OE1 2.88Å; T188-E212 HydrophobicContact CG2-CG 3.78Å; S208-E212 WeakPolarHBondContact O-CB 3.48Å; S208-E212 PolarHBondContact O-N 3.44Å; S208-E212 VanDerWaalsContact O-N 3.07Å; F209-E212 WeakPolarHBondContact O-CB 3.37Å; F209-E212 PolarHBondContact O-N 3.27Å; L210-E212 VanDerWaalsContact C-N 3.34Å; L210-E212 PolarHBondContact O-N 3.02Å; E212-N215 PolarHBondContact O-N 3.32Å; E212-T216 HydrophobicContact CG-CG2 4.28Å; E212-T216 WeakPolarHBondContact O-CB 3.49Å; E212-T216 WeakPolarHBondContact O-CG2 3.29Å; E212-T216 PolarHBondContact O-N 3.15Å; E212-T216 PolarHBondContact O-OG1 2.86Å; E212-T216 WeakPolarHBondContact OE1-CG2 3.27Å; E212-L241 HydrophobicContact CB-CD1 4.44Å
213	M	91	Very high	89.2	Confident	38 Å²	38	48.6 Å²	48.6	19%	0.187	25%	0.253	C	S	.	.	H	α-helix	trans	-65.8	-43.5	-179.5	-66.4	-56.5	103.8	0	0	112	F185 M189 F209 L210 N215 V217	F185-M213 HydrophobicContact CD2-CE 3.8Å; F185-M213 HydrophobicContact CD2-SD 4.24Å; F185-M213 HydrophobicContact CE2-CE 3.96Å; F185-M213 HydrophobicContact CE2-SD 3.9Å; M189-M213 HydrophobicContact CE-CE 4.12Å; F209-M213 HydrophobicContact CD1-CG 3.88Å; F209-M213 HydrophobicContact CE1-CG 3.49Å; F209-M213 VanDerWaalsContact CE1-CG 3.49Å; F209-M213 HydrophobicContact CE1-SD 4.14Å; F209-M213 HydrophobicContact CE2-CE 4.14Å; F209-M213 HydrophobicContact CZ-CE 4.12Å; F209-M213 HydrophobicContact CZ-CG 3.94Å; F209-M213 HydrophobicContact CZ-SD 3.97Å; F209-M213 WeakPolarHBondContact O-CG 3.4Å; F209-M213 PolarHBondContact O-N 2.97Å; L210-M213 PolarHBondContact O-N 2.95Å; M213-N215 PolarHBondContact O-N 3.4Å; M213-V217 HydrophobicContact CB-CG2 4.31Å; M213-V217 WeakPolarHBondContact O-CB 3.13Å; M213-V217 WeakPolarHBondContact O-CG2 3.48Å; M213-V217 PolarHBondContact O-N 3.29Å; M213-V217 VanDerWaalsContact O-N 3.16Å; M213-V217 HydrophobicContact SD-CG2 3.87Å
214	I	91.1	Very high	89.6	Confident	86 Å²	86	54.7 Å²	54.7	44%	0.441	28%	0.279	S	S	.	.	H	α-helix	trans	-57.2	-37.3	176	-72.1	164.4	0	0	0	111.3	L210 P218 P234 L237	L210-I214 WeakPolarHBondContact O-CB 3.25Å; L210-I214 WeakPolarHBondContact O-CD1 3.41Å; L210-I214 VanDerWaalsContact O-CG1 3.23Å; L210-I214 WeakPolarHBondContact O-CG1 3.47Å; L210-I214 PolarHBondContact O-N 3.13Å; I214-P218 WeakPolarHBondContact O-CD 3.46Å; I214-P218 WeakPolarHBondContact O-CG 3.5Å; I214-P234 HydrophobicContact CG2-CG 4.01Å; I214-L237 HydrophobicContact CG2-CD1 4.47Å
215	N	90.3	Very high	89.6	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-89.3	-38.5	-176.3	-66.9	-22	0	0	0	113.6	L211 E212 M213 F219 P234 N238	L211-N215 WeakPolarHBondContact O-CB 3.33Å; L211-N215 VanDerWaalsContact O-CG 3.29Å; L211-N215 PolarHBondContact O-N 3.16Å; L211-N215 VanDerWaalsContact O-N 3.16Å; L211-N215 PolarHBondContact O-ND2 3.25Å; E212-N215 PolarHBondContact O-N 3.32Å; M213-N215 PolarHBondContact O-N 3.4Å; N215-F219 WeakPolarHBondContact O-CD2 2.91Å; N215-P234 PolarHBondContact OD1-O 3.17Å; N215-N238 WeakPolarHBondContact CB-OD1 3.38Å; N215-N238 PolarHBondContact ND2-N 2.81Å; N215-N238 PolarHBondContact ND2-OD1 3.21Å
216	T	90.4	Very high	89.1	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.018	30%	0.295	C	S	.	.	H	α-helix	trans	-89.8	-41.6	-172.5	58.1	0	0	0	0	114.3	A181 E212 F219 I220	A181-T216 HydrophobicContact CB-CG2 4.16Å; E212-T216 HydrophobicContact CG-CG2 4.28Å; E212-T216 WeakPolarHBondContact O-CB 3.49Å; E212-T216 WeakPolarHBondContact O-CG2 3.29Å; E212-T216 PolarHBondContact O-N 3.15Å; E212-T216 PolarHBondContact O-OG1 2.86Å; E212-T216 WeakPolarHBondContact OE1-CG2 3.27Å; T216-F219 PolarHBondContact O-N 3.15Å; T216-F219 VanDerWaalsContact O-N 3.09Å; T216-I220 PolarHBondContact O-N 2.6Å; T216-I220 VanDerWaalsContact O-N 3.15Å
217	V	90.6	Very high	88.6	Confident	53 Å²	53	56.5 Å²	56.5	32%	0.321	30%	0.299	S	S	.	.	H	α-helix	trans	-61.4	-41.1	-173.8	178.8	0	0	0	0	112.1	F185 M213 F219 I220 I221	F185-V217 HydrophobicContact CE2-CG2 4.35Å; M213-V217 HydrophobicContact CB-CG2 4.31Å; M213-V217 WeakPolarHBondContact O-CB 3.13Å; M213-V217 WeakPolarHBondContact O-CG2 3.48Å; M213-V217 PolarHBondContact O-N 3.29Å; M213-V217 VanDerWaalsContact O-N 3.16Å; M213-V217 HydrophobicContact SD-CG2 3.87Å; V217-F219 VanDerWaalsContact C-N 3.35Å; V217-F219 PolarHBondContact O-N 2.79Å; V217-I220 PolarHBondContact O-N 3.13Å; V217-I221 HydrophobicContact CG1-CD1 4Å; V217-I221 HydrophobicContact CG1-CG1 4.48Å; V217-I221 WeakPolarHBondContact O-CG1 3.5Å; V217-I221 PolarHBondContact O-N 3.31Å
218	P	90.7	Very high	88.3	Confident	39 Å²	39	53.7 Å²	53.7	25%	0.253	28%	0.28	S	S	.	.	H	α-helix	trans	-60.4	-37.4	173.8	-27.2	38.1	0	0	0	114.1	I214 I221 T222 I233	I214-P218 WeakPolarHBondContact O-CD 3.46Å; I214-P218 WeakPolarHBondContact O-CG 3.5Å; P218-I221 PolarHBondContact O-N 3.32Å; P218-T222 WeakPolarHBondContact O-CG2 3.39Å; P218-T222 PolarHBondContact O-N 3.05Å; P218-T222 VanDerWaalsContact O-N 3.1Å; P218-I233 HydrophobicContact CB-CD1 3.72Å; P218-I233 HydrophobicContact CB-CG1 3.81Å; P218-I233 HydrophobicContact CB-CG2 4.2Å
219	F	89.6	Confident	88	Confident	4 Å²	4	55.4 Å²	55.4	2%	0.018	28%	0.283	C	S	.	.	H	α-helix	trans	-64.7	-41.2	174.8	-80	-67.4	0	0	0	111.6	Q177 V178 A181 N215 T216 V217 I221 T222 I233 V235	Q177-F219 HydrophobicContact CB-CD1 4.17Å; Q177-F219 HydrophobicContact CB-CE1 3.57Å; Q177-F219 HydrophobicContact CB-CE2 4.41Å; Q177-F219 HydrophobicContact CB-CZ 3.73Å; Q177-F219 HydrophobicContact CG-CE1 4.41Å; Q177-F219 HydrophobicContact CG-CZ 4.22Å; V178-F219 HydrophobicContact CG2-CB 4.23Å; V178-F219 HydrophobicContact CG2-CD1 3.98Å; A181-F219 HydrophobicContact CB-CB 3.69Å; A181-F219 HydrophobicContact CB-CD2 4.07Å; A181-F219 HydrophobicContact CB-CG 4.16Å; N215-F219 WeakPolarHBondContact O-CD2 2.91Å; T216-F219 PolarHBondContact O-N 3.15Å; T216-F219 VanDerWaalsContact O-N 3.09Å; V217-F219 VanDerWaalsContact C-N 3.35Å; V217-F219 PolarHBondContact O-N 2.79Å; F219-I221 VanDerWaalsContact C-N 3.32Å; F219-I221 PolarHBondContact O-N 3.19Å; F219-T222 PolarHBondContact O-N 2.98Å; F219-T222 PolarHBondContact O-OG1 3.36Å; F219-I233 HydrophobicContact CB-CD1 4.47Å; F219-I233 HydrophobicContact CD1-CD1 3.64Å; F219-I233 HydrophobicContact CD2-CD1 4.02Å; F219-I233 HydrophobicContact CD2-CG2 4.14Å; F219-I233 HydrophobicContact CE1-CD1 3.75Å; F219-I233 HydrophobicContact CE2-CB 4.26Å; F219-I233 HydrophobicContact CE2-CD1 4.1Å; F219-I233 HydrophobicContact CE2-CG2 3.76Å; F219-I233 HydrophobicContact CG-CD1 3.76Å; F219-I233 HydrophobicContact CZ-CB 4.25Å; F219-I233 HydrophobicContact CZ-CD1 3.97Å; F219-I233 HydrophobicContact CZ-CG2 4.26Å; F219-V235 HydrophobicContact CE2-CB 4.06Å; F219-V235 HydrophobicContact CE2-CG2 3.95Å; F219-V235 HydrophobicContact CZ-CB 4.3Å; F219-V235 HydrophobicContact CZ-CG2 4.35Å
220	I	89.6	Confident	87.6	Confident	36 Å²	36	56.6 Å²	56.6	19%	0.185	29%	0.291	C	S	.	.	H	α-helix	trans	-62.1	-40.8	176.2	-64.5	168.1	0	0	0	110.5	I182 F185 T216 V217 T222 I223 F224	I182-I220 HydrophobicContact CG1-CG1 4.49Å; F185-I220 HydrophobicContact CB-CD1 3.95Å; F185-I220 HydrophobicContact CD1-CD1 4.04Å; F185-I220 HydrophobicContact CD2-CD1 4.07Å; F185-I220 HydrophobicContact CG-CD1 3.74Å; T216-I220 PolarHBondContact O-N 2.6Å; T216-I220 VanDerWaalsContact O-N 3.15Å; V217-I220 PolarHBondContact O-N 3.13Å; I220-T222 VanDerWaalsContact C-N 3.32Å; I220-T222 PolarHBondContact O-N 3.03Å; I220-I223 VanDerWaalsContact O-CB 3.32Å; I220-I223 WeakPolarHBondContact O-CB 3.28Å; I220-I223 WeakPolarHBondContact O-CG1 2.98Å; I220-I223 PolarHBondContact O-N 3.4Å; I220-F224 HydrophobicContact CG2-CE2 4.06Å; I220-F224 WeakPolarHBondContact O-CD2 3.12Å
221	I	89.9	Confident	87.5	Confident	76 Å²	76	56.2 Å²	56.2	39%	0.39	29%	0.289	S	S	.	.	H	α-helix	trans	-61.3	-38	175	-67.3	166.2	0	0	0	111.8	V217 P218 F219 I223 F224 W225	V217-I221 HydrophobicContact CG1-CD1 4Å; V217-I221 HydrophobicContact CG1-CG1 4.48Å; V217-I221 WeakPolarHBondContact O-CG1 3.5Å; V217-I221 PolarHBondContact O-N 3.31Å; P218-I221 PolarHBondContact O-N 3.32Å; F219-I221 VanDerWaalsContact C-N 3.32Å; F219-I221 PolarHBondContact O-N 3.19Å; I221-I223 PolarHBondContact O-N 2.62Å; I221-I223 VanDerWaalsContact O-N 3.1Å; I221-F224 PolarHBondContact O-N 3.15Å; I221-W225 PolarHBondContact O-N 3.23Å; I221-W225 VanDerWaalsContact O-N 3.12Å
222	T	88.7	Confident	87.4	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.006	29%	0.288	C	S	.	.	H	α-helix	trans	-65.5	-12	178.4	72.3	0	0	0	0	114.8	W174 P218 F219 I220 I228 I233	W174-T222 PolarHBondContact NE1-OG1 2.68Å; P218-T222 WeakPolarHBondContact O-CG2 3.39Å; P218-T222 PolarHBondContact O-N 3.05Å; P218-T222 VanDerWaalsContact O-N 3.1Å; F219-T222 PolarHBondContact O-N 2.98Å; F219-T222 PolarHBondContact O-OG1 3.36Å; I220-T222 VanDerWaalsContact C-N 3.32Å; I220-T222 PolarHBondContact O-N 3.03Å; T222-I228 HydrophobicContact CG2-CG2 4.01Å; T222-I233 HydrophobicContact CG2-CD1 4.37Å
223	I	88.6	Confident	87.3	Confident	75 Å²	75	56.2 Å²	56.2	39%	0.385	29%	0.287	S	S	.	.	H	α-helix	trans	-71.5	-46.6	171.1	-53.7	171.2	0	0	0	109.9	V178 I182 I220 I221	V178-I223 HydrophobicContact CG1-CD1 3.73Å; V178-I223 HydrophobicContact CG1-CG1 3.72Å; I182-I223 HydrophobicContact CD1-CD1 3.95Å; I182-I223 HydrophobicContact CG1-CD1 4.41Å; I220-I223 VanDerWaalsContact O-CB 3.32Å; I220-I223 WeakPolarHBondContact O-CB 3.28Å; I220-I223 WeakPolarHBondContact O-CG1 2.98Å; I220-I223 PolarHBondContact O-N 3.4Å; I221-I223 PolarHBondContact O-N 2.62Å; I221-I223 VanDerWaalsContact O-N 3.1Å
224	F	90.1	Very high	87.2	Confident	157 Å²	157	56 Å²	56	69%	0.689	29%	0.289	S	S	*	.	H	α-helix	trans	-80.3	-30.7	-174.6	-60.4	-76.5	0	0	0	112.9	I220 I221 P226	I220-F224 HydrophobicContact CG2-CE2 4.06Å; I220-F224 WeakPolarHBondContact O-CD2 3.12Å; I221-F224 PolarHBondContact O-N 3.15Å; F224-P226 WeakPolarHBondContact O-CD 3.35Å
225	W	87.7	Confident	87.2	Confident	165 Å²	165	51.9 Å²	51.9	63%	0.625	27%	0.268	S	S	*	.			trans	-117.5	95.7	-175.7	-77.9	46.4	0	0	0	110.7	I221 S227 I228	I221-W225 PolarHBondContact O-N 3.23Å; I221-W225 VanDerWaalsContact O-N 3.12Å; W225-S227 PolarHBondContact O-N 3.15Å; W225-I228 HydrophobicContact CB-CB 4.33Å; W225-I228 HydrophobicContact CB-CD1 3.98Å; W225-I228 HydrophobicContact CB-CG1 4.12Å; W225-I228 HydrophobicContact CD2-CD1 4.09Å; W225-I228 HydrophobicContact CE3-CD1 3.5Å; W225-I228 HydrophobicContact CE3-CG1 4.24Å; W225-I228 HydrophobicContact CG-CD1 4.33Å; W225-I228 HydrophobicContact CZ3-CD1 4.27Å; W225-I228 PolarHBondContact O-N 3.18Å; W225-I228 VanDerWaalsContact O-N 3.08Å
226	P	78.7	Confident	87.1	Confident	83 Å²	83	52.9 Å²	52.9	54%	0.539	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-57.2	-34.6	-176.6	-27.5	35.7	0	0	0	114.3	F224 I228 K229	F224-P226 WeakPolarHBondContact O-CD 3.35Å; P226-I228 PolarHBondContact O-N 3.23Å; P226-K229 WeakPolarHBondContact O-CB 3.4Å; P226-K229 WeakPolarHBondContact O-CD 3.49Å; P226-K229 VanDerWaalsContact O-CG 3.25Å; P226-K229 WeakPolarHBondContact O-CG 3.3Å; P226-K229 PolarHBondContact O-N 3.25Å
227	S	76.9	Confident	87.2	Confident	93 Å²	93	54.5 Å²	54.5	65%	0.65	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-68.8	-9.6	-179.7	-40.5	0	0	0	0	114.3	W166 W225	W166-S227 VanDerWaalsContact CZ3-O 3.27Å; W166-S227 WeakPolarHBondContact CZ3-O 3.24Å; W225-S227 PolarHBondContact O-N 3.15Å
228	I	82.4	Confident	87.3	Confident	43 Å²	43	52.3 Å²	52.3	22%	0.221	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-99	-0.2	-180	-62.2	-176	0	0	0	111.1	T222 W225 P226 D230 L231	T222-I228 HydrophobicContact CG2-CG2 4.01Å; W225-I228 HydrophobicContact CB-CB 4.33Å; W225-I228 HydrophobicContact CB-CD1 3.98Å; W225-I228 HydrophobicContact CB-CG1 4.12Å; W225-I228 HydrophobicContact CD2-CD1 4.09Å; W225-I228 HydrophobicContact CE3-CD1 3.5Å; W225-I228 HydrophobicContact CE3-CG1 4.24Å; W225-I228 HydrophobicContact CG-CD1 4.33Å; W225-I228 HydrophobicContact CZ3-CD1 4.27Å; W225-I228 PolarHBondContact O-N 3.18Å; W225-I228 VanDerWaalsContact O-N 3.08Å; P226-I228 PolarHBondContact O-N 3.23Å; I228-D230 PolarHBondContact O-N 2.87Å; I228-D230 VanDerWaalsContact O-N 3.1Å; I228-L231 HydrophobicContact CG2-CB 3.74Å; I228-L231 HydrophobicContact CG2-CD2 3.65Å; I228-L231 HydrophobicContact CG2-CG 4.34Å; I228-L231 VanDerWaalsContact O-CB 3.24Å; I228-L231 WeakPolarHBondContact O-CB 3.48Å; I228-L231 PolarHBondContact O-N 3.4Å
229	K	80.2	Confident	87.3	Confident	73 Å²	73	50.9 Å²	50.9	32%	0.317	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-26.1	-176.8	-76.8	176.5	178.6	179.4	0	115.2	R169 W174 P226	R169-K229 VanDerWaalsContact CZ-O 3.24Å; R169-K229 PolarHBondContact NE-O 3.26Å; R169-K229 PolarHBondContact NH2-O 3.42Å; W174-K229 HydrophobicContact CH2-CD 4.4Å; W174-K229 HydrophobicContact CZ2-CD 4.18Å; W174-K229 HydrophobicContact CZ2-CG 4.05Å; P226-K229 WeakPolarHBondContact O-CB 3.4Å; P226-K229 WeakPolarHBondContact O-CD 3.49Å; P226-K229 VanDerWaalsContact O-CG 3.25Å; P226-K229 WeakPolarHBondContact O-CG 3.3Å; P226-K229 PolarHBondContact O-N 3.25Å
230	D	82.1	Confident	87.5	Confident	54 Å²	54	54.1 Å²	54.1	29%	0.289	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	0.4	178	-60.4	-67.2	0	0	0	113.7	W166 V167 E168 R169 I228 F232	W166-D230 HydrophobicContact CE3-CB 4.27Å; V167-D230 PolarHBondContact N-O 2.66Å; E168-D230 WeakPolarHBondContact CA-OD1 3.41Å; R169-D230 PolarHBondContact N-OD1 2.9Å; I228-D230 PolarHBondContact O-N 2.87Å; I228-D230 VanDerWaalsContact O-N 3.1Å; D230-F232 PolarHBondContact O-N 3.49Å
231	L	87.8	Confident	87.6	Confident	63 Å²	63	53 Å²	53	33%	0.33	26%	0.264	S	S	.	.	B	Isolated β-bridge	trans	-61	131.9	174.1	-177.5	66.4	0	0	0	111.1	F165 R169 I228	F165-L231 HydrophobicContact CB-CD1 4.48Å; F165-L231 HydrophobicContact CD1-CD1 4.49Å; F165-L231 CarbonylContact O-C 3.53Å; F165-L231 WeakPolarHBondContact O-CA 3.16Å; R169-L231 PolarHBondContact NH2-O 3.19Å; I228-L231 HydrophobicContact CG2-CB 3.74Å; I228-L231 HydrophobicContact CG2-CD2 3.65Å; I228-L231 HydrophobicContact CG2-CG 4.34Å; I228-L231 VanDerWaalsContact O-CB 3.24Å; I228-L231 WeakPolarHBondContact O-CB 3.48Å; I228-L231 PolarHBondContact O-N 3.4Å
232	F	87.3	Confident	87.7	Confident	35 Å²	35	49.5 Å²	49.5	15%	0.154	25%	0.247	C	C	.	.			trans	-61.4	139.4	174.9	-174.7	-97.9	0	0	0	112.5	Y127 I164 F165 D230 P234 F236 H288	Y127-F232 AromaticContact CE2-CE2 3.91Å; Y127-F232 HydrophobicContact CE2-CE2 3.91Å; Y127-F232 HydrophobicContact CE2-CZ 4.16Å; I164-F232 WeakPolarHBondContact O-CB 3.35Å; F165-F232 PolarHBondContact O-N 2.84Å; D230-F232 PolarHBondContact O-N 3.49Å; F232-P234 HydrophobicContact CE1-CB 4.04Å; F232-F236 HydrophobicContact CE1-CE1 4.31Å; F232-F236 HydrophobicContact CZ-CD1 4.28Å; F232-F236 AromaticContact CZ-CE1 3.98Å; F232-F236 HydrophobicContact CZ-CE1 3.98Å; F232-H288 AromaticContact CD1-CD2 3.99Å; F232-H288 AromaticContact CD1-CE1 3.79Å; F232-H288 AromaticContact CD1-NE2 3.35Å; F232-H288 WeakPolarHBondContact CD1-NE2 3.17Å; F232-H288 AromaticContact CD2-CE1 3.27Å; F232-H288 WeakPolarHBondContact CD2-CE1 3.36Å; F232-H288 AromaticContact CD2-ND1 3.64Å; F232-H288 AromaticContact CD2-NE2 3.73Å; F232-H288 AromaticContact CE1-CD2 3.58Å; F232-H288 AromaticContact CE1-NE2 3.47Å; F232-H288 WeakPolarHBondContact CE1-NE2 3.2Å; F232-H288 AromaticContact CE2-CD2 3.98Å; F232-H288 AromaticContact CE2-CE1 3.51Å; F232-H288 AromaticContact CE2-CG 3.74Å; F232-H288 AromaticContact CE2-ND1 3.44Å; F232-H288 WeakPolarHBondContact CE2-ND1 3.42Å; F232-H288 AromaticContact CE2-NE2 3.83Å; F232-H288 AromaticContact CG-CE1 3.41Å; F232-H288 VanDerWaalsContact CG-CE1 3.41Å; F232-H288 WeakPolarHBondContact CG-CE1 3.3Å; F232-H288 AromaticContact CG-NE2 3.49Å; F232-H288 WeakPolarHBondContact CG-NE2 3.43Å; F232-H288 HydrophobicContact CZ-CB 4.37Å; F232-H288 AromaticContact CZ-CD2 3.57Å; F232-H288 AromaticContact CZ-CE1 3.87Å; F232-H288 AromaticContact CZ-CG 3.66Å; F232-H288 AromaticContact CZ-ND1 3.85Å; F232-H288 AromaticContact CZ-NE2 3.71Å
233	I	89.3	Confident	87.9	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.01	25%	0.254	C	S	.	.			trans	-133.6	128.1	176	-58.4	171.9	0	0	0	106.2	P218 F219 T222 V235	P218-I233 HydrophobicContact CB-CD1 3.72Å; P218-I233 HydrophobicContact CB-CG1 3.81Å; P218-I233 HydrophobicContact CB-CG2 4.2Å; F219-I233 HydrophobicContact CB-CD1 4.47Å; F219-I233 HydrophobicContact CD1-CD1 3.64Å; F219-I233 HydrophobicContact CD2-CD1 4.02Å; F219-I233 HydrophobicContact CD2-CG2 4.14Å; F219-I233 HydrophobicContact CE1-CD1 3.75Å; F219-I233 HydrophobicContact CE2-CB 4.26Å; F219-I233 HydrophobicContact CE2-CD1 4.1Å; F219-I233 HydrophobicContact CE2-CG2 3.76Å; F219-I233 HydrophobicContact CG-CD1 3.76Å; F219-I233 HydrophobicContact CZ-CB 4.25Å; F219-I233 HydrophobicContact CZ-CD1 3.97Å; F219-I233 HydrophobicContact CZ-CG2 4.26Å; T222-I233 HydrophobicContact CG2-CD1 4.37Å; I233-V235 PolarHBondContact O-N 2.94Å
234	P	89.5	Confident	87.9	Confident	34 Å²	34	49.6 Å²	49.6	22%	0.221	25%	0.249	C	C	.	.			trans	-77.7	45	-172	34.2	-38.4	0	0	0	113.3	I214 N215 F232 F236 L237	I214-P234 HydrophobicContact CG2-CG 4.01Å; N215-P234 PolarHBondContact OD1-O 3.17Å; F232-P234 HydrophobicContact CE1-CB 4.04Å; P234-F236 HydrophobicContact CB-CD1 4.34Å; P234-F236 HydrophobicContact CB-CE1 3.77Å; P234-F236 HydrophobicContact CB-CZ 4.17Å; P234-F236 PolarHBondContact O-N 3.4Å; P234-L237 HydrophobicContact CB-CD1 3.96Å; P234-L237 HydrophobicContact CB-CG 4.32Å; P234-L237 HydrophobicContact CG-CD1 4.08Å; P234-L237 WeakPolarHBondContact O-CB 3.48Å; P234-L237 WeakPolarHBondContact O-CG 3.21Å; P234-L237 PolarHBondContact O-N 3.05Å
235	V	90.4	Very high	87.9	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-55.8	-17.2	-175.1	67.8	0	0	0	0	114.4	Y127 F219 I233 L237 N238	Y127-V235 HydrophobicContact CD2-CG1 3.57Å; Y127-V235 HydrophobicContact CE2-CG1 4.41Å; Y127-V235 HydrophobicContact CG-CG1 4.27Å; F219-V235 HydrophobicContact CE2-CB 4.06Å; F219-V235 HydrophobicContact CE2-CG2 3.95Å; F219-V235 HydrophobicContact CZ-CB 4.3Å; F219-V235 HydrophobicContact CZ-CG2 4.35Å; I233-V235 PolarHBondContact O-N 2.94Å; V235-L237 PolarHBondContact O-N 3.27Å; V235-N238 VanDerWaalsContact O-CB 3.3Å; V235-N238 WeakPolarHBondContact O-CB 3.49Å; V235-N238 PolarHBondContact O-N 3.41Å; V235-N238 VanDerWaalsContact O-N 3.09Å
236	F	89.8	Confident	88	Confident	21 Å²	21	35.5 Å²	35.5	9%	0.092	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-58.6	-27.2	170.5	65.9	-96.7	0	0	0	112.9	Y127 F232 P234 N238 C239 F280 T281 C284	Y127-F236 HydrophobicContact CD1-CB 4.18Å; Y127-F236 HydrophobicContact CE1-CB 4.21Å; Y127-F236 HydrophobicContact CE1-CD1 4.49Å; Y127-F236 HydrophobicContact CE2-CD1 4.12Å; Y127-F236 HydrophobicContact CG-CB 4.37Å; Y127-F236 AromaticContact CZ-CD1 3.94Å; F232-F236 HydrophobicContact CE1-CE1 4.31Å; F232-F236 HydrophobicContact CZ-CD1 4.28Å; F232-F236 AromaticContact CZ-CE1 3.98Å; F232-F236 HydrophobicContact CZ-CE1 3.98Å; P234-F236 HydrophobicContact CB-CD1 4.34Å; P234-F236 HydrophobicContact CB-CE1 3.77Å; P234-F236 HydrophobicContact CB-CZ 4.17Å; P234-F236 PolarHBondContact O-N 3.4Å; F236-N238 PolarHBondContact O-N 3.41Å; F236-N238 VanDerWaalsContact O-N 3.12Å; F236-C239 PolarHBondContact O-N 3.48Å; F236-C239 PolarHBondContact O-SG 3.43Å; F236-F280 HydrophobicContact CB-CE1 3.91Å; F236-T281 HydrophobicContact CD2-CG2 4.06Å; F236-T281 HydrophobicContact CE2-CG2 4.29Å; F236-C284 HydrophobicContact CB-CB 3.59Å; F236-C284 HydrophobicContact CD1-CB 3.85Å; F236-C284 HydrophobicContact CD2-CB 3.72Å; F236-C284 HydrophobicContact CE1-CB 4.45Å; F236-C284 HydrophobicContact CE2-CB 4.33Å; F236-C284 HydrophobicContact CG-CB 3.44Å; F236-C284 VanDerWaalsContact CG-CB 3.44Å
237	L	91.5	Very high	88.4	Confident	37 Å²	37	34.1 Å²	34.1	19%	0.194	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-61.7	-15.4	174.3	-66.6	176.5	0	0	0	113.7	L211 I214 P234 V235 C239 W240 T281	L211-L237 HydrophobicContact CD2-CB 4.4Å; L211-L237 HydrophobicContact CD2-CD1 4.27Å; I214-L237 HydrophobicContact CG2-CD1 4.47Å; P234-L237 HydrophobicContact CB-CD1 3.96Å; P234-L237 HydrophobicContact CB-CG 4.32Å; P234-L237 HydrophobicContact CG-CD1 4.08Å; P234-L237 WeakPolarHBondContact O-CB 3.48Å; P234-L237 WeakPolarHBondContact O-CG 3.21Å; P234-L237 PolarHBondContact O-N 3.05Å; V235-L237 PolarHBondContact O-N 3.27Å; L237-C239 PolarHBondContact O-N 3.26Å; L237-C239 VanDerWaalsContact O-N 3.08Å; L237-W240 PolarHBondContact O-N 3.16Å; L237-W240 VanDerWaalsContact O-N 3.17Å; L237-T281 HydrophobicContact CD2-CG2 4.13Å
238	N	91.9	Very high	88.8	Confident	7 Å²	7	33.5 Å²	33.5	4%	0.037	17%	0.171	C	C	.	.	H	α-helix	trans	-61.1	-13.1	172.9	-77.3	-15.2	0	0	0	113.4	K120 T123 N215 V235 F236 W240 L241 A242	K120-N238 HydrophobicContact CD-CB 4.27Å; T123-N238 WeakPolarHBondContact OG1-CB 2.91Å; T123-N238 PolarHBondContact OG1-ND2 2.97Å; N215-N238 WeakPolarHBondContact CB-OD1 3.38Å; N215-N238 PolarHBondContact ND2-N 2.81Å; N215-N238 PolarHBondContact ND2-OD1 3.21Å; V235-N238 VanDerWaalsContact O-CB 3.3Å; V235-N238 WeakPolarHBondContact O-CB 3.49Å; V235-N238 PolarHBondContact O-N 3.41Å; V235-N238 VanDerWaalsContact O-N 3.09Å; F236-N238 PolarHBondContact O-N 3.41Å; F236-N238 VanDerWaalsContact O-N 3.12Å; N238-W240 VanDerWaalsContact C-N 3.33Å; N238-W240 PolarHBondContact O-N 3.43Å; N238-L241 PolarHBondContact O-N 3.18Å; N238-L241 WeakPolarHBondContact OD1-CD1 3.34Å; N238-A242 PolarHBondContact O-N 3Å
239	C	92.1	Very high	89.1	Confident	10 Å²	10	33.3 Å²	33.3	7%	0.068	17%	0.17	C	C	.	.	H	α-helix	trans	-61.5	-39.2	172.1	66	0	0	0	0	112.3	F236 L237 L241 A242 K243 C277 F280 T281	F236-C239 PolarHBondContact O-N 3.48Å; F236-C239 PolarHBondContact O-SG 3.43Å; L237-C239 PolarHBondContact O-N 3.26Å; L237-C239 VanDerWaalsContact O-N 3.08Å; C239-L241 VanDerWaalsContact C-N 3.33Å; C239-L241 PolarHBondContact O-N 2.77Å; C239-A242 WeakPolarHBondContact O-CB 3.11Å; C239-A242 PolarHBondContact O-N 2.94Å; C239-K243 PolarHBondContact O-N 3.46Å; C239-C277 HydrophobicContact CB-CB 4.39Å; C239-C277 PolarHBondContact O-SG 2.96Å; C239-C277 VanDerWaalsContact O-SG 3.37Å; C239-F280 HydrophobicContact CB-CD1 3.95Å; C239-F280 HydrophobicContact CB-CE1 4.47Å; C239-T281 VanDerWaalsContact SG-CG2 3.54Å
240	W	92.9	Very high	89.3	Confident	71 Å²	71	30.6 Å²	30.6	27%	0.269	16%	0.158	S	C	.	.	H	α-helix	trans	-67.4	-35.1	176.5	-67.1	110.6	0	0	0	111.9	L211 L237 N238 K243 C244 T274 C277 L278	L211-W240 HydrophobicContact CD1-CB 4.01Å; L237-W240 PolarHBondContact O-N 3.16Å; L237-W240 VanDerWaalsContact O-N 3.17Å; N238-W240 VanDerWaalsContact C-N 3.33Å; N238-W240 PolarHBondContact O-N 3.43Å; W240-K243 WeakPolarHBondContact O-CB 3.42Å; W240-K243 PolarHBondContact O-N 3.07Å; W240-C244 PolarHBondContact O-N 3.4Å; W240-C244 PolarHBondContact O-SG 2.99Å; W240-C244 VanDerWaalsContact O-SG 3.4Å; W240-T274 HydrophobicContact CZ3-CG2 4.47Å; W240-C277 HydrophobicContact CD2-CB 3.97Å; W240-C277 HydrophobicContact CE3-CB 3.91Å; W240-C277 HydrophobicContact CH2-CB 3.88Å; W240-C277 HydrophobicContact CZ2-CB 3.93Å; W240-C277 HydrophobicContact CZ3-CB 3.87Å; W240-L278 HydrophobicContact CH2-CB 4.19Å; W240-L278 HydrophobicContact CZ2-CB 4.23Å
241	L	91.8	Very high	89.3	Confident	12 Å²	12	32.4 Å²	32.4	6%	0.063	17%	0.168	C	C	.	.	H	α-helix	trans	-68.9	-37.6	173.1	-63.9	170.9	0	0	0	111.8	K120 S208 L211 E212 N238 C239 C244 A245	K120-L241 HydrophobicContact CD-CB 4.25Å; K120-L241 HydrophobicContact CG-CB 4.38Å; S208-L241 VanDerWaalsContact O-CD2 3.28Å; S208-L241 WeakPolarHBondContact O-CD2 3.46Å; L211-L241 HydrophobicContact CB-CD1 4.17Å; L211-L241 HydrophobicContact CB-CD2 3.94Å; L211-L241 HydrophobicContact CB-CG 4.11Å; E212-L241 HydrophobicContact CB-CD1 4.44Å; N238-L241 PolarHBondContact O-N 3.18Å; N238-L241 WeakPolarHBondContact OD1-CD1 3.34Å; C239-L241 VanDerWaalsContact C-N 3.33Å; C239-L241 PolarHBondContact O-N 2.77Å; L241-C244 PolarHBondContact O-N 2.9Å; L241-A245 WeakPolarHBondContact O-CB 3.24Å; L241-A245 PolarHBondContact O-N 3.04Å
242	A	91.7	Very high	88.8	Confident	3 Å²	3	29.7 Å²	29.7	3%	0.025	15%	0.154	C	C	.	.	H	α-helix	trans	-62.3	-41.9	170.4	0	0	0	0	0	111.5	F117 K120 L121 N238 C239 A245 L246	F117-A242 HydrophobicContact CD2-CB 4.04Å; F117-A242 WeakPolarHBondContact CD2-O 3.35Å; F117-A242 HydrophobicContact CE2-CB 4.14Å; K120-A242 HydrophobicContact CB-CB 3.86Å; L121-A242 HydrophobicContact CD2-CB 4.19Å; L121-A242 HydrophobicContact CG-CB 4.49Å; N238-A242 PolarHBondContact O-N 3Å; C239-A242 WeakPolarHBondContact O-CB 3.11Å; C239-A242 PolarHBondContact O-N 2.94Å; A242-A245 PolarHBondContact O-N 3.45Å; A242-L246 WeakPolarHBondContact O-CB 3.2Å; A242-L246 PolarHBondContact O-N 2.71Å
243	K	92.4	Very high	88.3	Confident	36 Å²	36	29.8 Å²	29.8	16%	0.157	16%	0.157	C	C	.	.	H	α-helix	trans	-60.1	-45.7	173.9	179.8	-94.6	176.1	-173.6	0	111.7	C239 W240 L246 E247 C273 T274	C239-K243 PolarHBondContact O-N 3.46Å; W240-K243 WeakPolarHBondContact O-CB 3.42Å; W240-K243 PolarHBondContact O-N 3.07Å; K243-L246 WeakPolarHBondContact O-CB 3.46Å; K243-L246 PolarHBondContact O-N 2.84Å; K243-E247 WeakPolarHBondContact CD-OE2 3.38Å; K243-E247 VanDerWaalsContact CE-OE1 3.22Å; K243-E247 WeakPolarHBondContact CE-OE1 3.35Å; K243-E247 WeakPolarHBondContact CE-OE2 3.15Å; K243-E247 IonicContact NZ-OE1 3.18Å; K243-E247 PolarHBondContact NZ-OE1 3.28Å; K243-E247 IonicContact NZ-OE2 3.99Å; K243-E247 PolarHBondContact NZ-OE2 3.09Å; K243-E247 WeakPolarHBondContact O-CG 3.28Å; K243-E247 PolarHBondContact O-N 2.6Å; K243-C273 HydrophobicContact CG-CB 4.47Å; K243-T274 HydrophobicContact CD-CG2 4.3Å; K243-T274 VanDerWaalsContact CE-CG2 3.46Å; K243-T274 HydrophobicContact CG-CG2 4.37Å
244	C	89.9	Confident	87.5	Confident	42 Å²	42	34 Å²	34	28%	0.284	18%	0.177	S	C	.	.	H	α-helix	trans	-66.4	-36	175.3	-68.1	0	0	0	0	113.1	W240 L241 L246 N248	W240-C244 PolarHBondContact O-N 3.4Å; W240-C244 PolarHBondContact O-SG 2.99Å; W240-C244 VanDerWaalsContact O-SG 3.4Å; L241-C244 PolarHBondContact O-N 2.9Å; C244-L246 VanDerWaalsContact C-N 3.33Å; C244-N248 PolarHBondContact O-N 2.85Å; C244-N248 VanDerWaalsContact O-N 3.14Å; C244-N248 PolarHBondContact O-ND2 2.87Å
245	A	88.8	Confident	86.6	Confident	14 Å²	14	38.6 Å²	38.6	12%	0.116	19%	0.19	C	C	.	.	H	α-helix	trans	-64.8	-38.7	172.6	0	0	0	0	0	111.6	F117 L241 A242 N248 M249	F117-A245 HydrophobicContact CB-CB 4.23Å; L241-A245 WeakPolarHBondContact O-CB 3.24Å; L241-A245 PolarHBondContact O-N 3.04Å; A242-A245 PolarHBondContact O-N 3.45Å; A245-N248 PolarHBondContact O-N 2.86Å; A245-M249 WeakPolarHBondContact O-CB 3.35Å; A245-M249 PolarHBondContact O-N 3.04Å
246	L	89.6	Confident	85.3	Confident	13 Å²	13	40.2 Å²	40.2	7%	0.068	20%	0.203	C	C	.	.	H	α-helix	trans	-66.9	-44.1	177.6	-171.9	70	0	0	0	112.4	F117 A242 K243 C244 N248 M249 I250 I269 C273	F117-L246 HydrophobicContact CD2-CB 4.13Å; F117-L246 HydrophobicContact CD2-CD1 4.46Å; F117-L246 HydrophobicContact CE2-CB 3.92Å; F117-L246 HydrophobicContact CE2-CD1 3.98Å; F117-L246 HydrophobicContact CE2-CD2 4.39Å; F117-L246 HydrophobicContact CE2-CG 4.33Å; F117-L246 HydrophobicContact CZ-CD1 4Å; A242-L246 WeakPolarHBondContact O-CB 3.2Å; A242-L246 PolarHBondContact O-N 2.71Å; K243-L246 WeakPolarHBondContact O-CB 3.46Å; K243-L246 PolarHBondContact O-N 2.84Å; C244-L246 VanDerWaalsContact C-N 3.33Å; L246-N248 PolarHBondContact O-N 3.13Å; L246-M249 HydrophobicContact CD1-CE 3.66Å; L246-M249 HydrophobicContact CD1-SD 4.48Å; L246-M249 WeakPolarHBondContact O-CB 3.45Å; L246-M249 PolarHBondContact O-N 3.48Å; L246-I250 HydrophobicContact CG-CD1 4.11Å; L246-I250 WeakPolarHBondContact O-CB 3.36Å; L246-I250 WeakPolarHBondContact O-CG1 3.44Å; L246-I250 PolarHBondContact O-N 2.84Å; L246-I269 HydrophobicContact CD2-CG2 3.93Å; L246-C273 HydrophobicContact CD2-CB 4.16Å; L246-C273 WeakPolarHBondContact CD2-SG 3.44Å
247	E	88.9	Confident	84	Confident	53 Å²	53	42.4 Å²	42.4	25%	0.248	22%	0.215	C	C	.	.	H	α-helix	trans	-58.4	-46.9	172.8	-73.5	174.2	127.5	0	0	111.5	K243 M249 I250 N251 V270	K243-E247 WeakPolarHBondContact CD-OE2 3.38Å; K243-E247 VanDerWaalsContact CE-OE1 3.22Å; K243-E247 WeakPolarHBondContact CE-OE1 3.35Å; K243-E247 WeakPolarHBondContact CE-OE2 3.15Å; K243-E247 IonicContact NZ-OE1 3.18Å; K243-E247 PolarHBondContact NZ-OE1 3.28Å; K243-E247 IonicContact NZ-OE2 3.99Å; K243-E247 PolarHBondContact NZ-OE2 3.09Å; K243-E247 WeakPolarHBondContact O-CG 3.28Å; K243-E247 PolarHBondContact O-N 2.6Å; E247-M249 VanDerWaalsContact C-N 3.33Å; E247-M249 PolarHBondContact O-N 3.22Å; E247-I250 WeakPolarHBondContact O-CB 3.41Å; E247-I250 PolarHBondContact O-N 2.63Å; E247-N251 WeakPolarHBondContact O-CB 3.46Å; E247-N251 VanDerWaalsContact O-CG 3.23Å; E247-N251 PolarHBondContact O-N 2.87Å; E247-N251 PolarHBondContact O-ND2 3.3Å; E247-V270 HydrophobicContact CG-CB 4.48Å; E247-V270 HydrophobicContact CG-CG1 3.73Å; E247-V270 HydrophobicContact CG-CG2 3.81Å
248	N	85.4	Confident	82.2	Confident	81 Å²	81	48.6 Å²	48.6	43%	0.433	24%	0.243	S	C	.	.	H	α-helix	trans	-65	-36.6	176.6	-76.7	-61.5	0	0	0	112.1	R113 C244 A245 L246 D252	R113-N248 PolarHBondContact NH1-O 2.82Å; C244-N248 PolarHBondContact O-N 2.85Å; C244-N248 VanDerWaalsContact O-N 3.14Å; C244-N248 PolarHBondContact O-ND2 2.87Å; A245-N248 PolarHBondContact O-N 2.86Å; L246-N248 PolarHBondContact O-N 3.13Å; N248-D252 PolarHBondContact O-N 3.08Å
249	M	87	Confident	80.6	Confident	39 Å²	39	56.4 Å²	56.4	19%	0.192	27%	0.272	C	S	.	.	H	α-helix	trans	-62.8	-46.3	173.3	-170.9	-163.9	78.5	0	0	110.9	L110 R113 V114 A245 L246 E247 N251 D252 V253	L110-M249 HydrophobicContact CD1-CG 3.54Å; R113-M249 HydrophobicContact CB-CB 4.23Å; V114-M249 HydrophobicContact CG2-CG 4.2Å; V114-M249 HydrophobicContact CG2-SD 3.58Å; V114-M249 VanDerWaalsContact CG2-SD 3.58Å; A245-M249 WeakPolarHBondContact O-CB 3.35Å; A245-M249 PolarHBondContact O-N 3.04Å; L246-M249 HydrophobicContact CD1-CE 3.66Å; L246-M249 HydrophobicContact CD1-SD 4.48Å; L246-M249 WeakPolarHBondContact O-CB 3.45Å; L246-M249 PolarHBondContact O-N 3.48Å; E247-M249 VanDerWaalsContact C-N 3.33Å; E247-M249 PolarHBondContact O-N 3.22Å; M249-N251 PolarHBondContact O-N 3.33Å; M249-D252 PolarHBondContact O-N 3.43Å; M249-V253 WeakPolarHBondContact O-CG2 3.47Å; M249-V253 PolarHBondContact O-N 3.31Å
250	I	84.5	Confident	78.8	Confident	15 Å²	15	59.4 Å²	59.4	8%	0.077	29%	0.29	C	S	.	.	H	α-helix	trans	-59.5	-43.7	177.1	-83.1	166.7	0	0	0	112	L246 E247 D252 V253 H254 N266 I269 V270	L246-I250 HydrophobicContact CG-CD1 4.11Å; L246-I250 WeakPolarHBondContact O-CB 3.36Å; L246-I250 WeakPolarHBondContact O-CG1 3.44Å; L246-I250 PolarHBondContact O-N 2.84Å; E247-I250 WeakPolarHBondContact O-CB 3.41Å; E247-I250 PolarHBondContact O-N 2.63Å; I250-D252 PolarHBondContact O-N 3.44Å; I250-V253 CarbonylContact O-C 3.57Å; I250-V253 PolarHBondContact O-N 3.46Å; I250-V253 VanDerWaalsContact O-N 3.16Å; I250-H254 PolarHBondContact O-N 2.73Å; I250-N266 HydrophobicContact CB-CB 4.44Å; I250-N266 HydrophobicContact CD1-CB 4.09Å; I250-N266 HydrophobicContact CG1-CB 4.06Å; I250-N266 HydrophobicContact CG2-CB 3.62Å; I250-I269 HydrophobicContact CD1-CG2 4.31Å; I250-V270 HydrophobicContact CD1-CG2 3.65Å
251	N	81.8	Confident	76.9	Confident	92 Å²	92	58.7 Å²	58.7	49%	0.492	29%	0.291	S	S	.	.	H	α-helix	trans	-68.1	-34.4	-179.8	-69.2	-20.9	0	0	0	112.2	E247 M249 R255	E247-N251 WeakPolarHBondContact O-CB 3.46Å; E247-N251 VanDerWaalsContact O-CG 3.23Å; E247-N251 PolarHBondContact O-N 2.87Å; E247-N251 PolarHBondContact O-ND2 3.3Å; M249-N251 PolarHBondContact O-N 3.33Å; N251-R255 PolarHBondContact O-N 3.15Å
252	D	78.5	Confident	75.7	Confident	6 Å²	6	60 Å²	60	3%	0.032	30%	0.301	C	S	.	.	H	α-helix	trans	-69.6	-36.9	170.1	-94.9	35	0	0	0	112.1	S109 R113 N248 M249 I250 R255 A256	S109-D252 WeakPolarHBondContact CB-OD2 3.27Å; S109-D252 PolarHBondContact OG-OD2 3.41Å; R113-D252 IonicContact CZ-OD1 3.29Å; R113-D252 VanDerWaalsContact CZ-OD1 3.26Å; R113-D252 IonicContact CZ-OD2 3.13Å; R113-D252 IonicContact NE-OD2 2.64Å; R113-D252 IonicContact NH1-OD1 2.67Å; R113-D252 PolarHBondContact NH1-OD1 3.15Å; R113-D252 IonicContact NH1-OD2 3.18Å; R113-D252 IonicContact NH2-OD1 3.43Å; R113-D252 PolarHBondContact NH2-OD1 3.27Å; R113-D252 IonicContact NH2-OD2 2.74Å; R113-D252 PolarHBondContact NH2-OD2 2.79Å; N248-D252 PolarHBondContact O-N 3.08Å; M249-D252 PolarHBondContact O-N 3.43Å; I250-D252 PolarHBondContact O-N 3.44Å; D252-R255 VanDerWaalsContact CG-NH2 3.34Å; D252-R255 PolarHBondContact O-N 2.95Å; D252-R255 IonicContact OD1-CZ 3.33Å; D252-R255 IonicContact OD1-NH1 3.63Å; D252-R255 PolarHBondContact OD1-NH1 2.99Å; D252-R255 IonicContact OD1-NH2 3.95Å; D252-R255 PolarHBondContact OD1-NH2 2.92Å; D252-R255 IonicContact OD2-NH2 2.73Å; D252-R255 PolarHBondContact OD2-NH2 2.73Å; D252-A256 WeakPolarHBondContact O-CB 3.47Å; D252-A256 PolarHBondContact O-N 3.35Å
253	V	76.1	Confident	74.6	Confident	37 Å²	37	61.4 Å²	61.4	22%	0.224	31%	0.313	C	S	.	.	H	α-helix	trans	-66	-37.1	173.4	170.2	0	0	0	0	111.9	L110 M249 I250 A256 I257	L110-V253 HydrophobicContact CD1-CG2 3.67Å; L110-V253 HydrophobicContact CD2-CG2 4.42Å; M249-V253 WeakPolarHBondContact O-CG2 3.47Å; M249-V253 PolarHBondContact O-N 3.31Å; I250-V253 CarbonylContact O-C 3.57Å; I250-V253 PolarHBondContact O-N 3.46Å; I250-V253 VanDerWaalsContact O-N 3.16Å; V253-A256 WeakPolarHBondContact O-CB 3.25Å; V253-A256 PolarHBondContact O-N 3.11Å; V253-I257 HydrophobicContact CG1-CD1 4.26Å; V253-I257 WeakPolarHBondContact O-CB 3.37Å; V253-I257 PolarHBondContact O-N 3.04Å
254	H	72.7	Confident	73.8	Confident	90 Å²	90	62.3 Å²	62.3	42%	0.417	32%	0.318	S	S	.	.	H	α-helix	trans	-69.9	-41.2	176.2	-172.7	52.1	0	0	0	111.7	I250 A256 I257	I250-H254 PolarHBondContact O-N 2.73Å; H254-A256 VanDerWaalsContact C-N 3.27Å; H254-A256 PolarHBondContact O-N 3.24Å; H254-I257 CarbonylContact O-C 3.59Å; H254-I257 PolarHBondContact O-N 3.29Å
255	R	70.7	Confident	73.2	Confident	132 Å²	132	64.7 Å²	64.7	50%	0.498	32%	0.324	S	S	.	.	H	α-helix	trans	-62.2	-35.2	170.4	-171.7	173.7	73.5	-99.1	2.5	112.2	N251 D252	N251-R255 PolarHBondContact O-N 3.15Å; D252-R255 VanDerWaalsContact CG-NH2 3.34Å; D252-R255 PolarHBondContact O-N 2.95Å; D252-R255 IonicContact OD1-CZ 3.33Å; D252-R255 IonicContact OD1-NH1 3.63Å; D252-R255 PolarHBondContact OD1-NH1 2.99Å; D252-R255 IonicContact OD1-NH2 3.95Å; D252-R255 PolarHBondContact OD1-NH2 2.92Å; D252-R255 IonicContact OD2-NH2 2.73Å; D252-R255 PolarHBondContact OD2-NH2 2.73Å
256	A	63.4	Low	72.8	Confident	33 Å²	33	65 Å²	65	27%	0.273	32%	0.324	S	S	.	.	H	α-helix	trans	-73.8	-26.8	179.1	0	0	0	0	0	114.5	Q106 D252 V253 H254	Q106-A256 VanDerWaalsContact CD-CB 3.41Å; Q106-A256 HydrophobicContact CG-CB 3.8Å; D252-A256 WeakPolarHBondContact O-CB 3.47Å; D252-A256 PolarHBondContact O-N 3.35Å; V253-A256 WeakPolarHBondContact O-CB 3.25Å; V253-A256 PolarHBondContact O-N 3.11Å; H254-A256 VanDerWaalsContact C-N 3.27Å; H254-A256 PolarHBondContact O-N 3.24Å
257	I	61.9	Low	72.5	Confident	68 Å²	68	68.1 Å²	68.1	35%	0.349	34%	0.338	S	S	.	.			trans	-139.6	102.1	-168.6	-53.5	-179.7	0	0	0	108.8	V253 H254 R259	V253-I257 HydrophobicContact CG1-CD1 4.26Å; V253-I257 WeakPolarHBondContact O-CB 3.37Å; V253-I257 PolarHBondContact O-N 3.04Å; H254-I257 CarbonylContact O-C 3.59Å; H254-I257 PolarHBondContact O-N 3.29Å; I257-R259 HydrophobicContact CG2-CB 3.86Å; I257-R259 HydrophobicContact CG2-CG 3.66Å; I257-R259 PolarHBondContact O-N 3.14Å
258	Q	53.6	Low	72.3	Confident	167 Å²	167	66.3 Å²	66.3	78%	0.78	33%	0.331	S	S	*	.			trans	-69	38.2	175.1	-67.1	-178.6	-30.9	0	0	113.8	Q437	Q258-Q437 PolarHBondContact O-NE2 3.44Å
259	R	58.4	Low	72.4	Confident	170 Å²	170	64.9 Å²	64.9	64%	0.642	32%	0.322	S	S	*	.			trans	-95	98.4	171.9	-70.2	177.5	-177.3	161.7	1.2	108.7	I257 N261 S262	I257-R259 HydrophobicContact CG2-CB 3.86Å; I257-R259 HydrophobicContact CG2-CG 3.66Å; I257-R259 PolarHBondContact O-N 3.14Å; R259-N261 PolarHBondContact O-N 3.42Å; R259-S262 WeakPolarHBondContact O-CB 3.48Å; R259-S262 PolarHBondContact O-N 3.31Å
260	T	53.8	Low	72.4	Confident	73 Å²	73	63.9 Å²	63.9	45%	0.448	32%	0.319	S	S	.	.	H	α-helix	trans	-38.8	-48.5	167.3	42.2	0	0	0	0	112.7	S262 A263 Q437	T260-S262 PolarHBondContact O-N 2.91Å; T260-A263 WeakPolarHBondContact O-CB 3.34Å; T260-A263 PolarHBondContact O-N 2.96Å; T260-Q437 PolarHBondContact OG1-OE1 2.99Å
261	N	54.6	Low	72.5	Confident	56 Å²	56	63.5 Å²	63.5	30%	0.299	32%	0.317	S	S	.	.	H	α-helix	trans	-64.5	-14.6	-177.3	-59.4	10.4	0	0	0	114.3	R259 N359 R441	R259-N261 PolarHBondContact O-N 3.42Å; N261-N359 PolarHBondContact ND2-OD1 3.41Å; N261-R441 WeakPolarHBondContact ND2-CD 3.39Å; N261-R441 PolarHBondContact ND2-NE 3.09Å
262	S	65.4	Low	72.9	Confident	39 Å²	39	62.7 Å²	62.7	27%	0.273	31%	0.311	S	S	.	.	H	α-helix	trans	-83.1	-26.4	170.8	-64.3	0	0	0	0	112.8	R259 T260 F265 N266	R259-S262 WeakPolarHBondContact O-CB 3.48Å; R259-S262 PolarHBondContact O-N 3.31Å; T260-S262 PolarHBondContact O-N 2.91Å; S262-F265 PolarHBondContact O-N 2.98Å; S262-N266 VanDerWaalsContact O-CB 3.29Å; S262-N266 WeakPolarHBondContact O-CB 3.31Å; S262-N266 PolarHBondContact O-N 3.18Å; S262-N266 PolarHBondContact O-ND2 3.45Å; S262-N266 PolarHBondContact O-OD1 2.74Å
263	A	68.8	Low	73.5	Confident	33 Å²	33	63.8 Å²	63.8	27%	0.273	32%	0.32	S	S	.	.	H	α-helix	trans	-62.8	-53.7	-177.6	0	0	0	0	0	111.8	T260 F265 N266 Q267	T260-A263 WeakPolarHBondContact O-CB 3.34Å; T260-A263 PolarHBondContact O-N 2.96Å; A263-F265 VanDerWaalsContact C-N 3.3Å; A263-F265 PolarHBondContact O-N 2.74Å; A263-N266 PolarHBondContact O-N 3.29Å; A263-N266 VanDerWaalsContact O-N 3.14Å; A263-Q267 PolarHBondContact O-N 2.7Å
264	M	74.9	Confident	74.1	Confident	55 Å²	55	62.6 Å²	62.6	27%	0.271	31%	0.312	S	S	.	.	H	α-helix	trans	-57.8	-41.1	178.4	-59.3	-65.4	-80.5	0	0	112.2	V268 L349 E352	M264-V268 WeakPolarHBondContact O-CG2 3.06Å; M264-V268 PolarHBondContact O-N 3.36Å; M264-L349 HydrophobicContact CE-CB 4.34Å; M264-L349 HydrophobicContact CE-CD2 3.51Å; M264-L349 HydrophobicContact SD-CD2 3.95Å; M264-E352 HydrophobicContact CE-CB 4.06Å; M264-E352 HydrophobicContact CE-CG 4.1Å
265	F	77.9	Confident	74.9	Confident	93 Å²	93	59.4 Å²	59.4	41%	0.408	30%	0.298	S	S	.	.	H	α-helix	trans	-68.8	-39.3	177.7	178.6	-125.1	0	0	0	112.5	S262 A263 V268 I269	S262-F265 PolarHBondContact O-N 2.98Å; A263-F265 VanDerWaalsContact C-N 3.3Å; A263-F265 PolarHBondContact O-N 2.74Å; F265-V268 PolarHBondContact O-N 2.79Å; F265-I269 HydrophobicContact CD1-CD1 4.04Å; F265-I269 HydrophobicContact CD2-CD1 4.47Å; F265-I269 HydrophobicContact CE1-CD1 3.68Å; F265-I269 HydrophobicContact CE2-CD1 4.15Å; F265-I269 HydrophobicContact CE2-CG1 4.33Å; F265-I269 HydrophobicContact CG-CD1 4.44Å; F265-I269 HydrophobicContact CZ-CD1 3.75Å; F265-I269 HydrophobicContact CZ-CG1 4.36Å; F265-I269 WeakPolarHBondContact O-CG1 3.33Å; F265-I269 PolarHBondContact O-N 3.34Å
266	N	81.5	Confident	75.9	Confident	19 Å²	19	58.3 Å²	58.3	10%	0.102	30%	0.302	C	S	.	.	H	α-helix	trans	-67.2	-39.7	176.8	-69.1	-6.8	0	0	0	111.6	I250 S262 A263 I269 V270	I250-N266 HydrophobicContact CB-CB 4.44Å; I250-N266 HydrophobicContact CD1-CB 4.09Å; I250-N266 HydrophobicContact CG1-CB 4.06Å; I250-N266 HydrophobicContact CG2-CB 3.62Å; S262-N266 VanDerWaalsContact O-CB 3.29Å; S262-N266 WeakPolarHBondContact O-CB 3.31Å; S262-N266 PolarHBondContact O-N 3.18Å; S262-N266 PolarHBondContact O-ND2 3.45Å; S262-N266 PolarHBondContact O-OD1 2.74Å; A263-N266 PolarHBondContact O-N 3.29Å; A263-N266 VanDerWaalsContact O-N 3.14Å; N266-I269 WeakPolarHBondContact O-CB 3.4Å; N266-I269 PolarHBondContact O-N 2.82Å; N266-V270 WeakPolarHBondContact O-CG2 3.44Å; N266-V270 PolarHBondContact O-N 2.91Å
267	Q	81.7	Confident	77.3	Confident	80 Å²	80	57.3 Å²	57.3	37%	0.374	29%	0.293	S	S	.	.	H	α-helix	trans	-62.7	-44.9	174.2	-169.5	174.3	-8.9	0	0	111.1	A263 I269 V270 L271 E345 L349	A263-Q267 PolarHBondContact O-N 2.7Å; Q267-I269 VanDerWaalsContact C-N 3.28Å; Q267-I269 PolarHBondContact O-N 2.85Å; Q267-V270 WeakPolarHBondContact O-CB 3.42Å; Q267-V270 PolarHBondContact O-N 2.84Å; Q267-L271 WeakPolarHBondContact O-CG 3.41Å; Q267-L271 PolarHBondContact O-N 3.27Å; Q267-E345 PolarHBondContact NE2-OE1 2.9Å; Q267-L349 HydrophobicContact CB-CD1 4.09Å; Q267-L349 VanDerWaalsContact CD-CD1 3.47Å; Q267-L349 HydrophobicContact CG-CD1 3.55Å
268	V	85.9	Confident	78.7	Confident	15 Å²	15	54.2 Å²	54.2	9%	0.091	28%	0.276	C	S	.	.	H	α-helix	trans	-55.7	-39.5	171.7	163	0	0	0	0	112.4	M264 F265 L271 I272 L346 L349	M264-V268 WeakPolarHBondContact O-CG2 3.06Å; M264-V268 PolarHBondContact O-N 3.36Å; F265-V268 PolarHBondContact O-N 2.79Å; V268-L271 PolarHBondContact O-N 2.69Å; V268-I272 HydrophobicContact CG1-CD1 3.87Å; V268-I272 VanDerWaalsContact O-CG1 3.31Å; V268-I272 WeakPolarHBondContact O-CG1 3.31Å; V268-I272 PolarHBondContact O-N 3.25Å; V268-L346 HydrophobicContact CB-CD1 4.32Å; V268-L346 HydrophobicContact CG1-CD1 3.78Å; V268-L346 HydrophobicContact CG2-CD1 4.16Å; V268-L349 HydrophobicContact CG2-CB 3.86Å; V268-L349 HydrophobicContact CG2-CD1 4.36Å
269	I	86.3	Confident	80.5	Confident	50 Å²	50	47.6 Å²	47.6	26%	0.256	25%	0.247	S	C	.	.	H	α-helix	trans	-62.9	-43.2	173.8	-72.8	163.7	0	0	0	111.5	L246 I250 F265 N266 Q267 L271 I272 C273	L246-I269 HydrophobicContact CD2-CG2 3.93Å; I250-I269 HydrophobicContact CD1-CG2 4.31Å; F265-I269 HydrophobicContact CD1-CD1 4.04Å; F265-I269 HydrophobicContact CD2-CD1 4.47Å; F265-I269 HydrophobicContact CE1-CD1 3.68Å; F265-I269 HydrophobicContact CE2-CD1 4.15Å; F265-I269 HydrophobicContact CE2-CG1 4.33Å; F265-I269 HydrophobicContact CG-CD1 4.44Å; F265-I269 HydrophobicContact CZ-CD1 3.75Å; F265-I269 HydrophobicContact CZ-CG1 4.36Å; F265-I269 WeakPolarHBondContact O-CG1 3.33Å; F265-I269 PolarHBondContact O-N 3.34Å; N266-I269 WeakPolarHBondContact O-CB 3.4Å; N266-I269 PolarHBondContact O-N 2.82Å; Q267-I269 VanDerWaalsContact C-N 3.28Å; Q267-I269 PolarHBondContact O-N 2.85Å; I269-L271 VanDerWaalsContact C-N 3.34Å; I269-L271 PolarHBondContact O-N 3.02Å; I269-I272 PolarHBondContact O-N 3.22Å; I269-C273 WeakPolarHBondContact O-CB 3.41Å; I269-C273 PolarHBondContact O-N 3.32Å; I269-C273 PolarHBondContact O-SG 2.93Å
270	V	87.4	Confident	82.2	Confident	19 Å²	19	41.3 Å²	41.3	12%	0.115	23%	0.225	C	C	.	.	H	α-helix	trans	-61.5	-42.6	178.1	175.2	0	0	0	0	111.3	E247 I250 N266 Q267 C273 T274	E247-V270 HydrophobicContact CG-CB 4.48Å; E247-V270 HydrophobicContact CG-CG1 3.73Å; E247-V270 HydrophobicContact CG-CG2 3.81Å; I250-V270 HydrophobicContact CD1-CG2 3.65Å; N266-V270 WeakPolarHBondContact O-CG2 3.44Å; N266-V270 PolarHBondContact O-N 2.91Å; Q267-V270 WeakPolarHBondContact O-CB 3.42Å; Q267-V270 PolarHBondContact O-N 2.84Å; V270-C273 CarbonylContact O-C 3.58Å; V270-C273 WeakPolarHBondContact O-CB 3.47Å; V270-C273 PolarHBondContact O-N 2.93Å; V270-C273 VanDerWaalsContact O-N 3.16Å; V270-T274 PolarHBondContact O-N 3.3Å
271	L	87.3	Confident	84	Confident	6 Å²	6	38.6 Å²	38.6	3%	0.031	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-36.9	177.4	-61.1	175.9	0	0	0	112.9	Q267 V268 I269 C273 T274 L275 Q342 E345 L346 L349	Q267-L271 WeakPolarHBondContact O-CG 3.41Å; Q267-L271 PolarHBondContact O-N 3.27Å; V268-L271 PolarHBondContact O-N 2.69Å; I269-L271 VanDerWaalsContact C-N 3.34Å; I269-L271 PolarHBondContact O-N 3.02Å; L271-C273 VanDerWaalsContact C-N 3.29Å; L271-C273 PolarHBondContact O-N 3.08Å; L271-T274 WeakPolarHBondContact CA-OG1 3.32Å; L271-T274 PolarHBondContact O-N 2.85Å; L271-T274 PolarHBondContact O-OG1 3.13Å; L271-L275 VanDerWaalsContact O-CG 3.29Å; L271-L275 WeakPolarHBondContact O-CG 3.3Å; L271-L275 PolarHBondContact O-N 3.46Å; L271-Q342 VanDerWaalsContact CD2-NE2 3.29Å; L271-Q342 VanDerWaalsContact CD2-OE1 3.32Å; L271-E345 HydrophobicContact CD1-CB 4.02Å; L271-E345 HydrophobicContact CD1-CG 3.8Å; L271-E345 WeakPolarHBondContact CD2-OE2 3.36Å; L271-L346 HydrophobicContact CB-CD1 4.47Å; L271-L346 HydrophobicContact CD1-CB 4.13Å; L271-L349 HydrophobicContact CD1-CD1 3.62Å
272	I	89.6	Confident	85.8	Confident	75 Å²	75	35.9 Å²	35.9	39%	0.385	19%	0.194	S	C	.	.	H	α-helix	trans	-65.1	-37.8	171.6	-68.6	165.1	0	0	0	110.1	V268 I269 L276 L346	V268-I272 HydrophobicContact CG1-CD1 3.87Å; V268-I272 VanDerWaalsContact O-CG1 3.31Å; V268-I272 WeakPolarHBondContact O-CG1 3.31Å; V268-I272 PolarHBondContact O-N 3.25Å; I269-I272 PolarHBondContact O-N 3.22Å; I272-L276 HydrophobicContact CG2-CD1 3.94Å; I272-L276 WeakPolarHBondContact O-CB 3.09Å; I272-L276 VanDerWaalsContact O-CG 3.28Å; I272-L276 WeakPolarHBondContact O-CG 3.43Å; I272-L276 PolarHBondContact O-N 3.36Å; I272-L346 HydrophobicContact CG1-CD1 4.32Å
273	C	90.6	Very high	87.1	Confident	30 Å²	30	34.3 Å²	34.3	20%	0.203	18%	0.183	C	C	.	.	H	α-helix	trans	-70.8	-33.6	177	-74.1	0	0	0	0	114.2	K243 L246 I269 V270 L271 C277	K243-C273 HydrophobicContact CG-CB 4.47Å; L246-C273 HydrophobicContact CD2-CB 4.16Å; L246-C273 WeakPolarHBondContact CD2-SG 3.44Å; I269-C273 WeakPolarHBondContact O-CB 3.41Å; I269-C273 PolarHBondContact O-N 3.32Å; I269-C273 PolarHBondContact O-SG 2.93Å; V270-C273 CarbonylContact O-C 3.58Å; V270-C273 WeakPolarHBondContact O-CB 3.47Å; V270-C273 PolarHBondContact O-N 2.93Å; V270-C273 VanDerWaalsContact O-N 3.16Å; L271-C273 VanDerWaalsContact C-N 3.29Å; L271-C273 PolarHBondContact O-N 3.08Å; C273-C277 WeakPolarHBondContact O-CB 3.48Å; C273-C277 PolarHBondContact O-N 2.84Å; C273-C277 PolarHBondContact O-SG 3.02Å
274	T	90	Very high	88.1	Confident	11 Å²	11	32.8 Å²	32.8	7%	0.067	17%	0.17	C	C	.	.	H	α-helix	trans	-65.5	-46.2	173.2	48.8	0	0	0	0	111.4	W240 K243 V270 L271 L276 C277 L278 Q342	W240-T274 HydrophobicContact CZ3-CG2 4.47Å; K243-T274 HydrophobicContact CD-CG2 4.3Å; K243-T274 VanDerWaalsContact CE-CG2 3.46Å; K243-T274 HydrophobicContact CG-CG2 4.37Å; V270-T274 PolarHBondContact O-N 3.3Å; L271-T274 WeakPolarHBondContact CA-OG1 3.32Å; L271-T274 PolarHBondContact O-N 2.85Å; L271-T274 PolarHBondContact O-OG1 3.13Å; T274-L276 PolarHBondContact O-N 2.86Å; T274-C277 PolarHBondContact O-N 3.34Å; T274-L278 WeakPolarHBondContact O-CB 3.35Å; T274-L278 PolarHBondContact O-N 2.89Å; T274-Q342 PolarHBondContact OG1-OE1 2.99Å
275	L	89.6	Confident	88.9	Confident	23 Å²	23	30.5 Å²	30.5	12%	0.12	16%	0.16	C	C	.	.	H	α-helix	trans	-56.4	-48.7	175.1	-67	171.4	0	0	0	111.3	L271 L278 V279 L339 Q342 F343 L346	L271-L275 VanDerWaalsContact O-CG 3.29Å; L271-L275 WeakPolarHBondContact O-CG 3.3Å; L271-L275 PolarHBondContact O-N 3.46Å; L275-L278 PolarHBondContact O-N 3.36Å; L275-V279 WeakPolarHBondContact O-CG2 3.04Å; L275-V279 PolarHBondContact O-N 2.96Å; L275-V279 VanDerWaalsContact O-N 3.09Å; L275-L339 HydrophobicContact CD2-CD2 3.44Å; L275-L339 VanDerWaalsContact CD2-CD2 3.44Å; L275-Q342 HydrophobicContact CD2-CB 4.09Å; L275-Q342 HydrophobicContact CG-CB 4.49Å; L275-F343 HydrophobicContact CD1-CD1 4.27Å; L275-F343 HydrophobicContact CD1-CE1 3.83Å; L275-F343 HydrophobicContact CD1-CZ 4.26Å; L275-F343 HydrophobicContact CD2-CE1 4.41Å; L275-F343 HydrophobicContact CD2-CE2 4.27Å; L275-F343 HydrophobicContact CD2-CZ 4.11Å; L275-L346 HydrophobicContact CD1-CD2 4.08Å
276	L	91	Very high	89.5	Confident	110 Å²	110	26.2 Å²	26.2	58%	0.576	14%	0.142	S	C	*	.	H	α-helix	trans	-65	-38.5	177.8	-71.3	172	0	0	0	113	I272 T274 F280	I272-L276 HydrophobicContact CG2-CD1 3.94Å; I272-L276 WeakPolarHBondContact O-CB 3.09Å; I272-L276 VanDerWaalsContact O-CG 3.28Å; I272-L276 WeakPolarHBondContact O-CG 3.43Å; I272-L276 PolarHBondContact O-N 3.36Å; T274-L276 PolarHBondContact O-N 2.86Å; L276-F280 VanDerWaalsContact O-CB 3.24Å; L276-F280 WeakPolarHBondContact O-CB 3.47Å; L276-F280 PolarHBondContact O-N 3.16Å
277	C	92.5	Very high	89.9	Confident	12 Å²	12	25.9 Å²	25.9	8%	0.081	14%	0.139	C	C	.	.	H	α-helix	trans	-66.3	-44.1	176.5	-71.3	0	0	0	0	112	C239 W240 C273 T274 F280 T281	C239-C277 HydrophobicContact CB-CB 4.39Å; C239-C277 PolarHBondContact O-SG 2.96Å; C239-C277 VanDerWaalsContact O-SG 3.37Å; W240-C277 HydrophobicContact CD2-CB 3.97Å; W240-C277 HydrophobicContact CE3-CB 3.91Å; W240-C277 HydrophobicContact CH2-CB 3.88Å; W240-C277 HydrophobicContact CZ2-CB 3.93Å; W240-C277 HydrophobicContact CZ3-CB 3.87Å; C273-C277 WeakPolarHBondContact O-CB 3.48Å; C273-C277 PolarHBondContact O-N 2.84Å; C273-C277 PolarHBondContact O-SG 3.02Å; T274-C277 PolarHBondContact O-N 3.34Å; C277-F280 PolarHBondContact O-N 3.14Å; C277-T281 PolarHBondContact O-N 3.35Å; C277-T281 PolarHBondContact O-OG1 3.16Å
278	L	91.2	Very high	90.2	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-59.9	-50.1	178.1	-169	161.1	0	0	0	110.4	W240 T274 L275 F280 T281 G282 F309 M331 V334 A335 V338 L339	W240-L278 HydrophobicContact CH2-CB 4.19Å; W240-L278 HydrophobicContact CZ2-CB 4.23Å; T274-L278 WeakPolarHBondContact O-CB 3.35Å; T274-L278 PolarHBondContact O-N 2.89Å; L275-L278 PolarHBondContact O-N 3.36Å; L278-F280 PolarHBondContact O-N 2.99Å; L278-T281 PolarHBondContact O-N 3.28Å; L278-T281 PolarHBondContact O-OG1 3.47Å; L278-G282 PolarHBondContact O-N 3.01Å; L278-F309 HydrophobicContact CD2-CD2 4.01Å; L278-F309 HydrophobicContact CD2-CE1 4.44Å; L278-F309 HydrophobicContact CD2-CE2 3.51Å; L278-F309 HydrophobicContact CD2-CZ 3.76Å; L278-M331 HydrophobicContact CD2-CE 4.03Å; L278-M331 HydrophobicContact CG-CE 4.41Å; L278-V334 HydrophobicContact CD1-CG1 4.24Å; L278-A335 HydrophobicContact CD2-CB 4.48Å; L278-V338 HydrophobicContact CD1-CB 3.93Å; L278-V338 HydrophobicContact CD1-CG1 3.81Å; L278-L339 HydrophobicContact CD1-CD2 3.96Å; L278-L339 HydrophobicContact CD1-CG 4.42Å; L278-L339 HydrophobicContact CD2-CD2 4.38Å
279	V	92.8	Very high	90.3	Very high	28 Å²	28	23.4 Å²	23.4	17%	0.17	13%	0.127	C	C	.	.	H	α-helix	trans	-56.9	-52.1	174.4	174.4	0	0	0	0	110.7	L275 T281 G282 T283 F302 F309	L275-V279 WeakPolarHBondContact O-CG2 3.04Å; L275-V279 PolarHBondContact O-N 2.96Å; L275-V279 VanDerWaalsContact O-N 3.09Å; V279-T281 PolarHBondContact O-N 3.31Å; V279-G282 PolarHBondContact O-N 2.91Å; V279-G282 VanDerWaalsContact O-N 3.1Å; V279-T283 HydrophobicContact CG1-CG2 4.13Å; V279-T283 VanDerWaalsContact O-CG2 3.25Å; V279-T283 WeakPolarHBondContact O-CG2 3.33Å; V279-T283 PolarHBondContact O-N 2.9Å; V279-F302 HydrophobicContact CG1-CD2 3.98Å; V279-F302 HydrophobicContact CG1-CE2 3.91Å; V279-F309 HydrophobicContact CG2-CD2 4.25Å; V279-F309 HydrophobicContact CG2-CE2 4.44Å
280	F	93.4	Very high	90.3	Very high	39 Å²	39	21.1 Å²	21.1	17%	0.171	12%	0.116	C	C	.	.	H	α-helix	trans	-60.3	-39.1	-178.3	-173.9	-105.7	0	0	0	113.4	C124 I128 F236 C239 L276 C277 L278 T283 C284	C124-F280 HydrophobicContact CB-CE1 3.97Å; C124-F280 HydrophobicContact CB-CZ 3.99Å; I128-F280 HydrophobicContact CD1-CE2 3.99Å; I128-F280 HydrophobicContact CD1-CZ 4.48Å; I128-F280 HydrophobicContact CG1-CE2 4.06Å; I128-F280 HydrophobicContact CG1-CZ 4.37Å; F236-F280 HydrophobicContact CB-CE1 3.91Å; C239-F280 HydrophobicContact CB-CD1 3.95Å; C239-F280 HydrophobicContact CB-CE1 4.47Å; L276-F280 VanDerWaalsContact O-CB 3.24Å; L276-F280 WeakPolarHBondContact O-CB 3.47Å; L276-F280 PolarHBondContact O-N 3.16Å; C277-F280 PolarHBondContact O-N 3.14Å; L278-F280 PolarHBondContact O-N 2.99Å; F280-T283 PolarHBondContact O-OG1 3.41Å; F280-T283 VanDerWaalsContact O-OG1 3.06Å; F280-C284 VanDerWaalsContact CZ-SG 3.58Å; F280-C284 WeakPolarHBondContact O-CB 3.37Å; F280-C284 PolarHBondContact O-N 3.3Å; F280-C284 PolarHBondContact O-SG 3.37Å
281	T	92.6	Very high	90.1	Very high	15 Å²	15	21 Å²	21	9%	0.092	11%	0.113	C	C	.	.	H	α-helix	trans	-67.8	-37.9	174	52.2	0	0	0	0	113	F236 L237 C239 C277 L278 V279 G285	F236-T281 HydrophobicContact CD2-CG2 4.06Å; F236-T281 HydrophobicContact CE2-CG2 4.29Å; L237-T281 HydrophobicContact CD2-CG2 4.13Å; C239-T281 VanDerWaalsContact SG-CG2 3.54Å; C277-T281 PolarHBondContact O-N 3.35Å; C277-T281 PolarHBondContact O-OG1 3.16Å; L278-T281 PolarHBondContact O-N 3.28Å; L278-T281 PolarHBondContact O-OG1 3.47Å; V279-T281 PolarHBondContact O-N 3.31Å; T281-G285 PolarHBondContact O-N 3.43Å
282	G	91.1	Very high	89.7	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.2	-50.9	173.3	0	0	0	0	0	111.4	L278 V279 C284 G285 I286	L278-G282 PolarHBondContact O-N 3.01Å; V279-G282 PolarHBondContact O-N 2.91Å; V279-G282 VanDerWaalsContact O-N 3.1Å; G282-C284 PolarHBondContact O-N 2.95Å; G282-G285 PolarHBondContact O-N 2.87Å; G282-I286 WeakPolarHBondContact O-CB 3.39Å; G282-I286 WeakPolarHBondContact O-CD1 3.42Å; G282-I286 WeakPolarHBondContact O-CG1 3.41Å; G282-I286 PolarHBondContact O-N 2.95Å
283	T	92.2	Very high	88.8	Confident	6 Å²	6	19.8 Å²	19.8	4%	0.037	12%	0.12	C	C	.	.	H	α-helix	trans	-61.4	-45.9	-178.5	70.6	0	0	0	0	111.7	V279 F280 Q287 F302 C305	V279-T283 HydrophobicContact CG1-CG2 4.13Å; V279-T283 VanDerWaalsContact O-CG2 3.25Å; V279-T283 WeakPolarHBondContact O-CG2 3.33Å; V279-T283 PolarHBondContact O-N 2.9Å; F280-T283 PolarHBondContact O-OG1 3.41Å; F280-T283 VanDerWaalsContact O-OG1 3.06Å; T283-Q287 WeakPolarHBondContact O-CB 3.37Å; T283-Q287 PolarHBondContact O-N 2.85Å; T283-F302 VanDerWaalsContact CG2-CA 3.46Å; T283-F302 HydrophobicContact CG2-CB 3.8Å; T283-F302 HydrophobicContact CG2-CD2 3.86Å; T283-F302 HydrophobicContact CG2-CG 4.3Å; T283-C305 HydrophobicContact CG2-CB 4.2Å; T283-C305 PolarHBondContact N-SG 3.47Å; T283-C305 VanDerWaalsContact N-SG 3.42Å
284	C	91.4	Very high	87.8	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-68.9	-39	-176.7	-66.2	0	0	0	0	112.2	Y127 F236 F280 G282 H288	Y127-C284 HydrophobicContact CD1-CB 4.44Å; Y127-C284 HydrophobicContact CE1-CB 3.65Å; Y127-C284 VanDerWaalsContact CE1-SG 3.51Å; Y127-C284 PolarHBondContact OH-O 3.05Å; F236-C284 HydrophobicContact CB-CB 3.59Å; F236-C284 HydrophobicContact CD1-CB 3.85Å; F236-C284 HydrophobicContact CD2-CB 3.72Å; F236-C284 HydrophobicContact CE1-CB 4.45Å; F236-C284 HydrophobicContact CE2-CB 4.33Å; F236-C284 HydrophobicContact CG-CB 3.44Å; F236-C284 VanDerWaalsContact CG-CB 3.44Å; F280-C284 VanDerWaalsContact CZ-SG 3.58Å; F280-C284 WeakPolarHBondContact O-CB 3.37Å; F280-C284 PolarHBondContact O-N 3.3Å; F280-C284 PolarHBondContact O-SG 3.37Å; G282-C284 PolarHBondContact O-N 2.95Å; C284-H288 WeakPolarHBondContact O-CB 3.43Å; C284-H288 PolarHBondContact O-N 2.83Å; C284-H288 VanDerWaalsContact O-N 3.08Å
285	G	90.3	Very high	87.1	Confident	7 Å²	7	26.7 Å²	26.7	7%	0.072	15%	0.151	C	C	.	.	H	α-helix	trans	-68.6	-46.3	176.9	0	0	0	0	0	112.8	T281 G282 H288 L289 L327	T281-G285 PolarHBondContact O-N 3.43Å; G282-G285 PolarHBondContact O-N 2.87Å; G285-H288 PolarHBondContact O-N 2.82Å; G285-L289 WeakPolarHBondContact O-CG 3.37Å; G285-L289 PolarHBondContact O-N 3.2Å; G285-L327 VanDerWaalsContact C-CD2 3.49Å
286	I	90.3	Very high	86.8	Confident	4 Å²	4	26.3 Å²	26.3	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-70.8	-40.5	-179.5	-68.6	156.2	0	0	0	111.3	G282 H288 E290 F304 C305 L327 V328	G282-I286 WeakPolarHBondContact O-CB 3.39Å; G282-I286 WeakPolarHBondContact O-CD1 3.42Å; G282-I286 WeakPolarHBondContact O-CG1 3.41Å; G282-I286 PolarHBondContact O-N 2.95Å; I286-H288 VanDerWaalsContact C-N 3.27Å; I286-H288 PolarHBondContact O-N 3.13Å; I286-E290 WeakPolarHBondContact O-CB 3.47Å; I286-E290 PolarHBondContact O-N 3.45Å; I286-E290 VanDerWaalsContact O-N 3.14Å; I286-F304 HydrophobicContact CD1-CD1 4.12Å; I286-F304 HydrophobicContact CD1-CE1 3.93Å; I286-F304 HydrophobicContact CG2-CD1 4.03Å; I286-F304 HydrophobicContact CG2-CE1 4.28Å; I286-C305 VanDerWaalsContact CD1-SG 3.58Å; I286-L327 HydrophobicContact CG1-CD2 3.99Å; I286-V328 HydrophobicContact CD1-CG2 3.78Å; I286-V328 HydrophobicContact CG1-CG2 3.99Å
287	Q	90.8	Very high	86.7	Confident	12 Å²	12	23.6 Å²	23.6	6%	0.056	14%	0.14	C	C	.	.	H	α-helix	trans	-57.3	-43.4	171.5	-166.4	-63.6	-56.5	0	0	110.7	V131 T283 L296 L298 S301	V131-Q287 HydrophobicContact CG1-CG 4.15Å; T283-Q287 WeakPolarHBondContact O-CB 3.37Å; T283-Q287 PolarHBondContact O-N 2.85Å; Q287-L296 PolarHBondContact NE2-O 2.83Å; Q287-L298 HydrophobicContact CB-CD1 4.47Å; Q287-L298 HydrophobicContact CG-CD1 4.27Å; Q287-S301 WeakPolarHBondContact CA-OG 3.33Å
288	H	87.9	Confident	86.5	Confident	12 Å²	12	24.9 Å²	24.9	6%	0.056	15%	0.145	C	C	.	.	H	α-helix	trans	-68.6	-47.7	-177.5	178.1	52.3	0	0	0	112.6	I164 F232 C284 G285 I286 R291	I164-H288 PolarHBondContact O-CE1 3.09Å; F232-H288 AromaticContact CD1-CD2 3.99Å; F232-H288 AromaticContact CD1-CE1 3.79Å; F232-H288 AromaticContact CD1-NE2 3.35Å; F232-H288 WeakPolarHBondContact CD1-NE2 3.17Å; F232-H288 AromaticContact CD2-CE1 3.27Å; F232-H288 WeakPolarHBondContact CD2-CE1 3.36Å; F232-H288 AromaticContact CD2-ND1 3.64Å; F232-H288 AromaticContact CD2-NE2 3.73Å; F232-H288 AromaticContact CE1-CD2 3.58Å; F232-H288 AromaticContact CE1-NE2 3.47Å; F232-H288 WeakPolarHBondContact CE1-NE2 3.2Å; F232-H288 AromaticContact CE2-CD2 3.98Å; F232-H288 AromaticContact CE2-CE1 3.51Å; F232-H288 AromaticContact CE2-CG 3.74Å; F232-H288 AromaticContact CE2-ND1 3.44Å; F232-H288 WeakPolarHBondContact CE2-ND1 3.42Å; F232-H288 AromaticContact CE2-NE2 3.83Å; F232-H288 AromaticContact CG-CE1 3.41Å; F232-H288 VanDerWaalsContact CG-CE1 3.41Å; F232-H288 WeakPolarHBondContact CG-CE1 3.3Å; F232-H288 AromaticContact CG-NE2 3.49Å; F232-H288 WeakPolarHBondContact CG-NE2 3.43Å; F232-H288 HydrophobicContact CZ-CB 4.37Å; F232-H288 AromaticContact CZ-CD2 3.57Å; F232-H288 AromaticContact CZ-CE1 3.87Å; F232-H288 AromaticContact CZ-CG 3.66Å; F232-H288 AromaticContact CZ-ND1 3.85Å; F232-H288 AromaticContact CZ-NE2 3.71Å; C284-H288 WeakPolarHBondContact O-CB 3.43Å; C284-H288 PolarHBondContact O-N 2.83Å; C284-H288 VanDerWaalsContact O-N 3.08Å; G285-H288 PolarHBondContact O-N 2.82Å; I286-H288 VanDerWaalsContact C-N 3.27Å; I286-H288 PolarHBondContact O-N 3.13Å; H288-R291 WeakPolarHBondContact O-CB 3.3Å; H288-R291 VanDerWaalsContact O-CD 3.25Å; H288-R291 WeakPolarHBondContact O-CD 3.32Å; H288-R291 VanDerWaalsContact O-CG 3.3Å; H288-R291 WeakPolarHBondContact O-CG 3.39Å; H288-R291 PolarHBondContact O-N 3.15Å
289	L	88.1	Confident	86.4	Confident	30 Å²	30	31.6 Å²	31.6	16%	0.157	18%	0.175	C	C	.	.	H	α-helix	trans	-69.8	-38.6	-176.7	-66.4	177.6	0	0	0	112.9	I164 G285 R291 A292 I321 P323 L327	I164-L289 HydrophobicContact CG2-CD2 4.36Å; G285-L289 WeakPolarHBondContact O-CG 3.37Å; G285-L289 PolarHBondContact O-N 3.2Å; L289-R291 PolarHBondContact O-N 2.99Å; L289-R291 VanDerWaalsContact O-N 3.12Å; L289-A292 PolarHBondContact O-N 3.17Å; L289-I321 VanDerWaalsContact O-CD1 3.32Å; L289-I321 WeakPolarHBondContact O-CD1 3.23Å; L289-P323 HydrophobicContact CD1-CB 4.36Å; L289-P323 WeakPolarHBondContact CD1-O 3.27Å; L289-P323 HydrophobicContact CD2-CB 4.42Å; L289-L327 HydrophobicContact CD1-CB 3.85Å; L289-L327 HydrophobicContact CD1-CD2 3.63Å; L289-L327 HydrophobicContact CD1-CG 4.35Å
290	E	87.2	Confident	86.3	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.009	19%	0.185	C	C	.	.	H	α-helix	trans	-67.1	-11.5	-179.1	-77.9	-65.7	142.9	0	0	114.4	I286 A292 G293 Q294 L296 P319 R320 S324	I286-E290 WeakPolarHBondContact O-CB 3.47Å; I286-E290 PolarHBondContact O-N 3.45Å; I286-E290 VanDerWaalsContact O-N 3.14Å; E290-A292 PolarHBondContact O-N 3.25Å; E290-A292 VanDerWaalsContact O-N 3.1Å; E290-G293 PolarHBondContact O-N 3.4Å; E290-Q294 CarbonylContact O-C 3.29Å; E290-Q294 VanDerWaalsContact O-C 3.29Å; E290-Q294 PolarHBondContact O-N 3.43Å; E290-Q294 VanDerWaalsContact O-O 3.06Å; E290-L296 HydrophobicContact CB-CD1 4.1Å; E290-L296 HydrophobicContact CB-CG 4.16Å; E290-L296 HydrophobicContact CG-CD1 3.94Å; E290-L296 HydrophobicContact CG-CG 4.47Å; E290-P319 WeakPolarHBondContact OE1-CA 3.41Å; E290-R320 PolarHBondContact OE1-N 2.76Å; E290-S324 VanDerWaalsContact OE1-CB 3.24Å; E290-S324 WeakPolarHBondContact OE1-CB 3.2Å; E290-S324 PolarHBondContact OE1-OG 3.39Å
291	R	83.2	Confident	86.2	Confident	16 Å²	16	31.8 Å²	31.8	6%	0.06	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-32.4	172.2	-70.7	169.6	171	-113.9	-7.5	113.6	D134 V167 H288 L289 G293 N295	D134-R291 IonicContact OD1-NH1 2.7Å; D134-R291 IonicContact OD2-CZ 3.15Å; D134-R291 IonicContact OD2-NH1 2.84Å; D134-R291 PolarHBondContact OD2-NH1 2.84Å; D134-R291 IonicContact OD2-NH2 2.67Å; D134-R291 PolarHBondContact OD2-NH2 3.47Å; V167-R291 VanDerWaalsContact CG1-NH1 3.32Å; H288-R291 WeakPolarHBondContact O-CB 3.3Å; H288-R291 VanDerWaalsContact O-CD 3.25Å; H288-R291 WeakPolarHBondContact O-CD 3.32Å; H288-R291 VanDerWaalsContact O-CG 3.3Å; H288-R291 WeakPolarHBondContact O-CG 3.39Å; H288-R291 PolarHBondContact O-N 3.15Å; L289-R291 PolarHBondContact O-N 2.99Å; L289-R291 VanDerWaalsContact O-N 3.12Å; R291-G293 VanDerWaalsContact C-N 3.3Å; R291-G293 PolarHBondContact O-N 3.01Å; R291-N295 PolarHBondContact O-OD1 2.82Å
292	A	77.4	Confident	86.2	Confident	10 Å²	10	35.3 Å²	35.3	8%	0.083	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-1.9	-179	0	0	0	0	0	114.6	I159 N160 I164 L289 E290 I321	I159-A292 HydrophobicContact CG2-CB 3.84Å; N160-A292 HydrophobicContact CB-CB 4.48Å; N160-A292 WeakPolarHBondContact O-CB 3.38Å; I164-A292 HydrophobicContact CD1-CB 3.85Å; I164-A292 HydrophobicContact CG1-CB 3.88Å; L289-A292 PolarHBondContact O-N 3.17Å; E290-A292 PolarHBondContact O-N 3.25Å; E290-A292 VanDerWaalsContact O-N 3.1Å; A292-I321 HydrophobicContact CB-CD1 3.98Å
293	G	72.2	Confident	86.3	Confident	46 Å²	46	39 Å²	39	47%	0.474	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.5	-54.3	-173.7	0	0	0	0	0	114.5	E290 R291 I321	E290-G293 PolarHBondContact O-N 3.4Å; R291-G293 VanDerWaalsContact C-N 3.3Å; R291-G293 PolarHBondContact O-N 3.01Å; G293-I321 VanDerWaalsContact N-CD1 3.32Å
294	Q	69.7	Low	86.3	Confident	90 Å²	90	39.5 Å²	39.5	42%	0.421	21%	0.207	S	C	.	.	S	Bend	trans	-143.4	112.4	173.7	-177.8	170.2	-15.5	0	0	109.9	E290 L296	E290-Q294 CarbonylContact O-C 3.29Å; E290-Q294 VanDerWaalsContact O-C 3.29Å; E290-Q294 PolarHBondContact O-N 3.43Å; E290-Q294 VanDerWaalsContact O-O 3.06Å; Q294-L296 PolarHBondContact O-N 3.47Å
295	N	75.3	Confident	86.4	Confident	96 Å²	96	39.6 Å²	39.6	51%	0.513	21%	0.208	S	C	.	.			trans	-62.7	86.3	-175.9	-76.2	-50.9	0	0	0	113.3	P136 R291	P136-N295 WeakPolarHBondContact CG-OD1 3.26Å; R291-N295 PolarHBondContact O-OD1 2.82Å
296	L	82.9	Confident	86.5	Confident	16 Å²	16	42.8 Å²	42.8	8%	0.084	22%	0.222	C	C	.	.			trans	-73.4	135.2	173.4	-63.9	-175.9	0	0	0	110.8	Q287 E290 Q294 N300 V317	Q287-L296 PolarHBondContact NE2-O 2.83Å; E290-L296 HydrophobicContact CB-CD1 4.1Å; E290-L296 HydrophobicContact CB-CG 4.16Å; E290-L296 HydrophobicContact CG-CD1 3.94Å; E290-L296 HydrophobicContact CG-CG 4.47Å; Q294-L296 PolarHBondContact O-N 3.47Å; L296-N300 HydrophobicContact CD2-CB 4.45Å; L296-V317 HydrophobicContact CD1-CG1 3.84Å; L296-V317 HydrophobicContact CD2-CG1 4.02Å
297	S	87.4	Confident	86.7	Confident	53 Å²	53	43.2 Å²	43.2	37%	0.371	23%	0.225	S	C	.	.			trans	-67.6	153.3	167.4	85.4	0	0	0	0	110.1	F299 N300 S301	S297-F299 PolarHBondContact O-N 3.32Å; S297-F299 VanDerWaalsContact O-N 3.14Å; S297-F299 PolarHBondContact OG-N 2.71Å; S297-N300 PolarHBondContact O-N 3.35Å; S297-N300 VanDerWaalsContact OG-CG 3.26Å; S297-N300 PolarHBondContact OG-N 2.88Å; S297-N300 PolarHBondContact OG-OD1 3.44Å; S297-S301 PolarHBondContact O-N 3.41Å; S297-S301 PolarHBondContact O-OG 3.46Å
298	L	88.6	Confident	86.8	Confident	38 Å²	38	43.8 Å²	43.8	20%	0.199	23%	0.23	C	C	.	.	H	α-helix	trans	-54.1	-33.9	174.7	-173.6	68.8	0	0	0	112.3	I128 V131 Q287 F302	I128-L298 HydrophobicContact CG1-CD2 4.37Å; I128-L298 HydrophobicContact CG2-CD2 4Å; V131-L298 HydrophobicContact CG1-CB 4.14Å; V131-L298 HydrophobicContact CG1-CD1 4.45Å; Q287-L298 HydrophobicContact CB-CD1 4.47Å; Q287-L298 HydrophobicContact CG-CD1 4.27Å; L298-F302 WeakPolarHBondContact O-CB 3.36Å; L298-F302 PolarHBondContact O-N 3Å
299	F	90.3	Very high	87	Confident	144 Å²	144	44.5 Å²	44.5	63%	0.632	23%	0.232	S	C	*	.	H	α-helix	trans	-71.7	-41.6	177	-174.9	-97	0	0	0	112.5	S297 S301 F302 Y303	S297-F299 PolarHBondContact O-N 3.32Å; S297-F299 VanDerWaalsContact O-N 3.14Å; S297-F299 PolarHBondContact OG-N 2.71Å; F299-S301 VanDerWaalsContact C-N 3.32Å; F299-S301 PolarHBondContact O-N 3.43Å; F299-F302 WeakPolarHBondContact O-CB 3.41Å; F299-F302 PolarHBondContact O-N 2.86Å; F299-Y303 WeakPolarHBondContact O-CB 3.4Å; F299-Y303 PolarHBondContact O-N 3.13Å
300	N	90.3	Very high	87.1	Confident	70 Å²	70	45.8 Å²	45.8	37%	0.374	24%	0.244	S	C	.	.	H	α-helix	trans	-65.4	-38.6	176.6	-65.5	26.2	0	0	0	110.7	L296 S297 F304	L296-N300 HydrophobicContact CD2-CB 4.45Å; S297-N300 PolarHBondContact O-N 3.35Å; S297-N300 VanDerWaalsContact OG-CG 3.26Å; S297-N300 PolarHBondContact OG-N 2.88Å; S297-N300 PolarHBondContact OG-OD1 3.44Å; N300-F304 VanDerWaalsContact O-CB 3.32Å; N300-F304 WeakPolarHBondContact O-CB 3.28Å; N300-F304 PolarHBondContact O-N 2.88Å
301	S	90.9	Very high	87.4	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-66.5	-35.8	172.6	-57	0	0	0	0	112.5	Q287 S297 F299 C305	Q287-S301 WeakPolarHBondContact CA-OG 3.33Å; S297-S301 PolarHBondContact O-N 3.41Å; S297-S301 PolarHBondContact O-OG 3.46Å; F299-S301 VanDerWaalsContact C-N 3.32Å; F299-S301 PolarHBondContact O-N 3.43Å; S301-C305 WeakPolarHBondContact O-CB 3.42Å; S301-C305 PolarHBondContact O-N 2.85Å; S301-C305 PolarHBondContact O-SG 3.35Å
302	F	93	Very high	87.9	Confident	89 Å²	89	53.7 Å²	53.7	39%	0.39	29%	0.294	S	S	.	.	H	α-helix	trans	-65.3	-48.5	173.6	172.9	-97.8	0	0	0	112.8	V279 T283 L298 F299 F304 C305 I306	V279-F302 HydrophobicContact CG1-CD2 3.98Å; V279-F302 HydrophobicContact CG1-CE2 3.91Å; T283-F302 VanDerWaalsContact CG2-CA 3.46Å; T283-F302 HydrophobicContact CG2-CB 3.8Å; T283-F302 HydrophobicContact CG2-CD2 3.86Å; T283-F302 HydrophobicContact CG2-CG 4.3Å; L298-F302 WeakPolarHBondContact O-CB 3.36Å; L298-F302 PolarHBondContact O-N 3Å; F299-F302 WeakPolarHBondContact O-CB 3.41Å; F299-F302 PolarHBondContact O-N 2.86Å; F302-F304 PolarHBondContact O-N 3.48Å; F302-C305 PolarHBondContact O-N 3.07Å; F302-I306 HydrophobicContact CD1-CD1 4.24Å; F302-I306 HydrophobicContact CD2-CD1 4.32Å; F302-I306 HydrophobicContact CE1-CD1 3.63Å; F302-I306 HydrophobicContact CE2-CD1 3.72Å; F302-I306 HydrophobicContact CZ-CD1 3.34Å; F302-I306 PolarHBondContact O-N 3.44Å
303	Y	93.8	Very high	88.6	Confident	78 Å²	78	55.7 Å²	55.7	31%	0.306	32%	0.316	S	S	.	.	H	α-helix	trans	-55.8	-50.6	173	169	-100.1	0	0	0	111.4	F299 C305 I306 V307 F314 D316 V317	F299-Y303 WeakPolarHBondContact O-CB 3.4Å; F299-Y303 PolarHBondContact O-N 3.13Å; Y303-C305 PolarHBondContact O-N 2.76Å; Y303-I306 PolarHBondContact O-N 3.46Å; Y303-V307 HydrophobicContact CD1-CG2 4.5Å; Y303-V307 HydrophobicContact CD2-CG2 4.08Å; Y303-V307 HydrophobicContact CE1-CG2 4.18Å; Y303-V307 HydrophobicContact CE2-CG2 3.72Å; Y303-V307 HydrophobicContact CG-CG2 4.46Å; Y303-V307 WeakPolarHBondContact O-CB 3.35Å; Y303-V307 WeakPolarHBondContact O-CG2 3.48Å; Y303-V307 PolarHBondContact O-N 2.88Å; Y303-F314 WeakPolarHBondContact OH-CD2 3.46Å; Y303-D316 WeakPolarHBondContact CE1-OD2 3.5Å; Y303-D316 VanDerWaalsContact CZ-OD2 3.31Å; Y303-D316 PolarHBondContact OH-OD2 2.85Å; Y303-V317 HydrophobicContact CD1-CG2 4.26Å; Y303-V317 HydrophobicContact CE1-CG2 4.37Å
304	F	92.4	Very high	89.5	Confident	17 Å²	17	60 Å²	60	8%	0.075	32%	0.321	C	S	.	.	H	α-helix	trans	-58.2	-43	177.3	173.8	-100	0	0	0	113.2	I286 N300 F302 V307 T308 V317 P319 V328	I286-F304 HydrophobicContact CD1-CD1 4.12Å; I286-F304 HydrophobicContact CD1-CE1 3.93Å; I286-F304 HydrophobicContact CG2-CD1 4.03Å; I286-F304 HydrophobicContact CG2-CE1 4.28Å; N300-F304 VanDerWaalsContact O-CB 3.32Å; N300-F304 WeakPolarHBondContact O-CB 3.28Å; N300-F304 PolarHBondContact O-N 2.88Å; F302-F304 PolarHBondContact O-N 3.48Å; F304-V307 PolarHBondContact O-N 2.85Å; F304-T308 WeakPolarHBondContact CE2-OG1 3.42Å; F304-T308 WeakPolarHBondContact CZ-OG1 3.14Å; F304-T308 VanDerWaalsContact O-CB 3.25Å; F304-T308 WeakPolarHBondContact O-CB 3.25Å; F304-T308 PolarHBondContact O-N 2.97Å; F304-T308 PolarHBondContact O-OG1 3.17Å; F304-V317 HydrophobicContact CB-CB 4.16Å; F304-V317 HydrophobicContact CB-CG1 3.89Å; F304-V317 HydrophobicContact CD2-CB 4.06Å; F304-V317 HydrophobicContact CD2-CG1 4.05Å; F304-V317 WeakPolarHBondContact CD2-O 3.47Å; F304-V317 VanDerWaalsContact CE2-O 3.26Å; F304-V317 WeakPolarHBondContact CE2-O 3.25Å; F304-V317 HydrophobicContact CG-CB 4.46Å; F304-V317 HydrophobicContact CG-CG1 4.11Å; F304-P319 HydrophobicContact CZ-CG 4.3Å; F304-V328 HydrophobicContact CE1-CG2 3.69Å; F304-V328 HydrophobicContact CZ-CG1 4.24Å; F304-V328 HydrophobicContact CZ-CG2 4.04Å
305	C	92.3	Very high	90.3	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.007	32%	0.324	C	S	.	.	H	α-helix	trans	-61.6	-46.3	176.5	-69.6	0	0	0	0	111.3	T283 I286 S301 F302 Y303 T308 F309	T283-C305 HydrophobicContact CG2-CB 4.2Å; T283-C305 PolarHBondContact N-SG 3.47Å; T283-C305 VanDerWaalsContact N-SG 3.42Å; I286-C305 VanDerWaalsContact CD1-SG 3.58Å; S301-C305 WeakPolarHBondContact O-CB 3.42Å; S301-C305 PolarHBondContact O-N 2.85Å; S301-C305 PolarHBondContact O-SG 3.35Å; F302-C305 PolarHBondContact O-N 3.07Å; Y303-C305 PolarHBondContact O-N 2.76Å; C305-T308 PolarHBondContact O-N 2.85Å; C305-F309 HydrophobicContact CB-CD2 4.37Å; C305-F309 HydrophobicContact CB-CE2 4.02Å; C305-F309 HydrophobicContact CB-CZ 4.47Å; C305-F309 VanDerWaalsContact O-CB 3.28Å; C305-F309 WeakPolarHBondContact O-CB 3.41Å; C305-F309 VanDerWaalsContact O-CD2 3.3Å; C305-F309 WeakPolarHBondContact O-CD2 3.31Å; C305-F309 WeakPolarHBondContact O-CG 3.16Å; C305-F309 PolarHBondContact O-N 3.42Å
306	I	92.6	Very high	90.9	Very high	75 Å²	75	57.7 Å²	57.7	39%	0.385	32%	0.323	S	S	.	.	H	α-helix	trans	-65.4	-43.8	179.3	-71.7	-179.1	0	0	0	111.5	F302 Y303 T308 F309 S310	F302-I306 HydrophobicContact CD1-CD1 4.24Å; F302-I306 HydrophobicContact CD2-CD1 4.32Å; F302-I306 HydrophobicContact CE1-CD1 3.63Å; F302-I306 HydrophobicContact CE2-CD1 3.72Å; F302-I306 HydrophobicContact CZ-CD1 3.34Å; F302-I306 PolarHBondContact O-N 3.44Å; Y303-I306 PolarHBondContact O-N 3.46Å; I306-T308 VanDerWaalsContact C-N 3.26Å; I306-T308 PolarHBondContact O-N 3.03Å; I306-F309 PolarHBondContact O-N 2.89Å; I306-S310 VanDerWaalsContact O-CB 3.3Å; I306-S310 WeakPolarHBondContact O-CB 3.36Å; I306-S310 PolarHBondContact O-N 2.88Å; I306-S310 PolarHBondContact O-OG 3.46Å
307	V	94.2	Very high	91.1	Very high	12 Å²	12	58 Å²	58	7%	0.073	33%	0.325	C	S	.	.	H	α-helix	trans	-63.8	-31.1	177.5	168.9	0	0	0	0	112.4	Y303 F304 S310 V312 G313 F314	Y303-V307 HydrophobicContact CD1-CG2 4.5Å; Y303-V307 HydrophobicContact CD2-CG2 4.08Å; Y303-V307 HydrophobicContact CE1-CG2 4.18Å; Y303-V307 HydrophobicContact CE2-CG2 3.72Å; Y303-V307 HydrophobicContact CG-CG2 4.46Å; Y303-V307 WeakPolarHBondContact O-CB 3.35Å; Y303-V307 WeakPolarHBondContact O-CG2 3.48Å; Y303-V307 PolarHBondContact O-N 2.88Å; F304-V307 PolarHBondContact O-N 2.85Å; V307-S310 PolarHBondContact O-OG 3.38Å; V307-V312 HydrophobicContact CG1-CB 4.45Å; V307-V312 PolarHBondContact O-N 3.45Å; V307-V312 VanDerWaalsContact O-N 3.08Å; V307-G313 PolarHBondContact O-N 3.22Å; V307-F314 HydrophobicContact CB-CD2 4.43Å; V307-F314 HydrophobicContact CG1-CB 4.23Å; V307-F314 HydrophobicContact CG1-CD2 3.64Å; V307-F314 HydrophobicContact CG1-CE2 4.41Å; V307-F314 HydrophobicContact CG1-CG 4.19Å; V307-F314 HydrophobicContact CG2-CD2 3.82Å; V307-F314 HydrophobicContact CG2-CE2 4.09Å
308	T	92.9	Very high	91.1	Very high	25 Å²	25	58.3 Å²	58.3	15%	0.153	33%	0.325	C	S	.	.	H	α-helix	trans	-78.3	-45.3	176.6	-61.4	0	0	0	0	111.3	F304 C305 I306 T311 I332	F304-T308 WeakPolarHBondContact CE2-OG1 3.42Å; F304-T308 WeakPolarHBondContact CZ-OG1 3.14Å; F304-T308 VanDerWaalsContact O-CB 3.25Å; F304-T308 WeakPolarHBondContact O-CB 3.25Å; F304-T308 PolarHBondContact O-N 2.97Å; F304-T308 PolarHBondContact O-OG1 3.17Å; C305-T308 PolarHBondContact O-N 2.85Å; I306-T308 VanDerWaalsContact C-N 3.26Å; I306-T308 PolarHBondContact O-N 3.03Å; T308-T311 WeakPolarHBondContact O-CA 3.18Å; T308-T311 PolarHBondContact O-N 2.98Å; T308-I332 HydrophobicContact CG2-CD1 3.82Å; T308-I332 HydrophobicContact CG2-CG1 3.53Å
309	F	91.8	Very high	91	Very high	26 Å²	26	57.7 Å²	57.7	11%	0.114	32%	0.324	C	S	.	.	H	α-helix	trans	-72.7	-25.9	-179.7	-65.3	-17.7	0	0	0	113.6	L278 V279 C305 I306 T311 M331 A335 L339	L278-F309 HydrophobicContact CD2-CD2 4.01Å; L278-F309 HydrophobicContact CD2-CE1 4.44Å; L278-F309 HydrophobicContact CD2-CE2 3.51Å; L278-F309 HydrophobicContact CD2-CZ 3.76Å; V279-F309 HydrophobicContact CG2-CD2 4.25Å; V279-F309 HydrophobicContact CG2-CE2 4.44Å; C305-F309 HydrophobicContact CB-CD2 4.37Å; C305-F309 HydrophobicContact CB-CE2 4.02Å; C305-F309 HydrophobicContact CB-CZ 4.47Å; C305-F309 VanDerWaalsContact O-CB 3.28Å; C305-F309 WeakPolarHBondContact O-CB 3.41Å; C305-F309 VanDerWaalsContact O-CD2 3.3Å; C305-F309 WeakPolarHBondContact O-CD2 3.31Å; C305-F309 WeakPolarHBondContact O-CG 3.16Å; C305-F309 PolarHBondContact O-N 3.42Å; I306-F309 PolarHBondContact O-N 2.89Å; F309-T311 PolarHBondContact O-N 2.74Å; F309-M331 HydrophobicContact CE1-CB 4.07Å; F309-M331 HydrophobicContact CE1-CE 4.47Å; F309-M331 HydrophobicContact CZ-CB 4.28Å; F309-M331 HydrophobicContact CZ-CE 3.76Å; F309-A335 HydrophobicContact CD1-CB 3.39Å; F309-A335 HydrophobicContact CE1-CB 3.72Å; F309-A335 HydrophobicContact CG-CB 4.01Å; F309-L339 HydrophobicContact CB-CD1 3.7Å; F309-L339 HydrophobicContact CG-CD1 4.13Å
310	S	91.2	Very high	90.6	Very high	58 Å²	58	58.8 Å²	58.8	41%	0.406	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	0.4	168.1	66.3	0	0	0	0	113.3	I306 V307 V312	I306-S310 VanDerWaalsContact O-CB 3.3Å; I306-S310 WeakPolarHBondContact O-CB 3.36Å; I306-S310 PolarHBondContact O-N 2.88Å; I306-S310 PolarHBondContact O-OG 3.46Å; V307-S310 PolarHBondContact O-OG 3.38Å; S310-V312 PolarHBondContact O-N 2.84Å; S310-V312 WeakPolarHBondContact OG-CG2 3.5Å
311	T	92.6	Very high	90.5	Very high	105 Å²	105	56 Å²	56	64%	0.644	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	16.3	-176.7	65.7	0	0	0	0	115.4	T308 F309 L336	T308-T311 WeakPolarHBondContact O-CA 3.18Å; T308-T311 PolarHBondContact O-N 2.98Å; F309-T311 PolarHBondContact O-N 2.74Å; T311-L336 HydrophobicContact CG2-CD2 3.8Å
312	V	94.9	Very high	90.2	Very high	78 Å²	78	64 Å²	64	47%	0.473	34%	0.339	S	S	.	.			trans	-77.3	-40.3	-178	173.1	0	0	0	0	112.4	V307 S310 F314	V307-V312 HydrophobicContact CG1-CB 4.45Å; V307-V312 PolarHBondContact O-N 3.45Å; V307-V312 VanDerWaalsContact O-N 3.08Å; S310-V312 PolarHBondContact O-N 2.84Å; S310-V312 WeakPolarHBondContact OG-CG2 3.5Å; V312-F314 HydrophobicContact CG1-CD1 3.89Å; V312-F314 HydrophobicContact CG1-CD2 4.04Å; V312-F314 HydrophobicContact CG1-CE1 3.54Å; V312-F314 HydrophobicContact CG1-CE2 3.71Å; V312-F314 HydrophobicContact CG1-CG 4.12Å; V312-F314 HydrophobicContact CG1-CZ 3.45Å; V312-F314 VanDerWaalsContact CG1-CZ 3.45Å; V312-F314 PolarHBondContact O-N 2.69Å
313	G	90.5	Very high	90	Very high	52 Å²	52	60.7 Å²	60.7	54%	0.536	33%	0.326	S	S	.	.			trans	59.4	45	165.8	0	0	0	0	0	117	V307 G315	V307-G313 PolarHBondContact O-N 3.22Å; G313-G315 PolarHBondContact O-N 2.76Å
314	F	92.3	Very high	89.7	Confident	136 Å²	136	57 Å²	57	60%	0.596	31%	0.312	S	S	*	.			trans	-53.8	-25.1	-176.7	-68.2	-56.4	0	0	0	116	Y303 V307 V312 D316	Y303-F314 WeakPolarHBondContact OH-CD2 3.46Å; V307-F314 HydrophobicContact CB-CD2 4.43Å; V307-F314 HydrophobicContact CG1-CB 4.23Å; V307-F314 HydrophobicContact CG1-CD2 3.64Å; V307-F314 HydrophobicContact CG1-CE2 4.41Å; V307-F314 HydrophobicContact CG1-CG 4.19Å; V307-F314 HydrophobicContact CG2-CD2 3.82Å; V307-F314 HydrophobicContact CG2-CE2 4.09Å; V312-F314 HydrophobicContact CG1-CD1 3.89Å; V312-F314 HydrophobicContact CG1-CD2 4.04Å; V312-F314 HydrophobicContact CG1-CE1 3.54Å; V312-F314 HydrophobicContact CG1-CE2 3.71Å; V312-F314 HydrophobicContact CG1-CG 4.12Å; V312-F314 HydrophobicContact CG1-CZ 3.45Å; V312-F314 VanDerWaalsContact CG1-CZ 3.45Å; V312-F314 PolarHBondContact O-N 2.69Å; F314-D316 PolarHBondContact O-N 2.9Å
315	G	86.1	Confident	89.6	Confident	46 Å²	46	60.4 Å²	60.4	47%	0.474	33%	0.328	S	S	.	.	S	Bend	trans	76.3	2.9	177.3	0	0	0	0	0	115.6	G313	G313-G315 PolarHBondContact O-N 2.76Å
316	D	88.4	Confident	89.6	Confident	93 Å²	93	64.2 Å²	64.2	50%	0.497	35%	0.348	S	S	.	.	S	Bend	trans	-70	-40.2	177.4	56.2	-9.3	0	0	0	113	Y303 F314	Y303-D316 WeakPolarHBondContact CE1-OD2 3.5Å; Y303-D316 VanDerWaalsContact CZ-OD2 3.31Å; Y303-D316 PolarHBondContact OH-OD2 2.85Å; F314-D316 PolarHBondContact O-N 2.9Å
317	V	87.6	Confident	89.5	Confident	21 Å²	21	62.5 Å²	62.5	13%	0.127	34%	0.339	C	S	.	.	S	Bend	trans	-109.6	128.4	164.6	-176.5	0	0	0	0	108	L296 Y303 F304	L296-V317 HydrophobicContact CD1-CG1 3.84Å; L296-V317 HydrophobicContact CD2-CG1 4.02Å; Y303-V317 HydrophobicContact CD1-CG2 4.26Å; Y303-V317 HydrophobicContact CE1-CG2 4.37Å; F304-V317 HydrophobicContact CB-CB 4.16Å; F304-V317 HydrophobicContact CB-CG1 3.89Å; F304-V317 HydrophobicContact CD2-CB 4.06Å; F304-V317 HydrophobicContact CD2-CG1 4.05Å; F304-V317 WeakPolarHBondContact CD2-O 3.47Å; F304-V317 VanDerWaalsContact CE2-O 3.26Å; F304-V317 WeakPolarHBondContact CE2-O 3.25Å; F304-V317 HydrophobicContact CG-CB 4.46Å; F304-V317 HydrophobicContact CG-CG1 4.11Å
318	T	87.4	Confident	89.4	Confident	61 Å²	61	62.6 Å²	62.6	37%	0.374	34%	0.34	S	S	.	.			trans	-143.2	141	-176.6	37.2	0	0	0	0	111.5
319	P	86.2	Confident	89.4	Confident	25 Å²	25	65.5 Å²	65.5	16%	0.162	36%	0.357	C	S	.	.			trans	-75.1	127.1	178.2	31.4	-35.3	0	0	0	110.8	E290 F304 Q325 V328	E290-P319 WeakPolarHBondContact OE1-CA 3.41Å; F304-P319 HydrophobicContact CZ-CG 4.3Å; P319-Q325 HydrophobicContact CB-CG 4.15Å; P319-Q325 HydrophobicContact CG-CG 4.11Å; P319-Q325 WeakPolarHBondContact O-CG 2.98Å; P319-Q325 PolarHBondContact O-NE2 2.88Å; P319-V328 HydrophobicContact CB-CG2 4.36Å; P319-V328 HydrophobicContact CG-CB 4.37Å; P319-V328 HydrophobicContact CG-CG2 4.08Å
320	R	82.1	Confident	89.5	Confident	167 Å²	167	68.4 Å²	68.4	63%	0.63	37%	0.373	S	S	*	.			trans	-105.8	-9.2	-172.2	-65.5	-172	177	-159.6	-1.4	114.3	E290	E290-R320 PolarHBondContact OE1-N 2.76Å
321	I	86.4	Confident	89.5	Confident	10 Å²	10	66.7 Å²	66.7	5%	0.051	36%	0.359	C	S	.	.	S	Bend	trans	-111.7	145.2	-172.2	-26.7	178.3	0	0	0	109.8	I159 L289 A292 G293 P323 S324 Q325	I159-I321 HydrophobicContact CB-CG2 4.49Å; I159-I321 HydrophobicContact CD1-CG2 3.62Å; I159-I321 HydrophobicContact CG1-CG2 3.74Å; I159-I321 HydrophobicContact CG2-CG2 3.94Å; L289-I321 VanDerWaalsContact O-CD1 3.32Å; L289-I321 WeakPolarHBondContact O-CD1 3.23Å; A292-I321 HydrophobicContact CB-CD1 3.98Å; G293-I321 VanDerWaalsContact N-CD1 3.32Å; I321-P323 HydrophobicContact CG2-CG 4.33Å; I321-S324 PolarHBondContact N-OG 3.15Å; I321-S324 PolarHBondContact O-N 3.09Å; I321-S324 PolarHBondContact O-OG 2.78Å; I321-Q325 WeakPolarHBondContact O-CB 3.4Å; I321-Q325 VanDerWaalsContact O-CG 3.31Å; I321-Q325 WeakPolarHBondContact O-CG 3.25Å; I321-Q325 PolarHBondContact O-N 3.5Å
322	W	86.1	Confident	89.5	Confident	169 Å²	169	64.5 Å²	64.5	64%	0.64	34%	0.343	S	S	*	.	H	α-helix	trans	-51.8	-47.1	-179.8	-178.2	82.7	0	0	0	115.2	Q325 L326	W322-Q325 PolarHBondContact O-N 3.45Å; W322-L326 HydrophobicContact CH2-CD2 3.89Å; W322-L326 HydrophobicContact CZ2-CD2 4.13Å; W322-L326 HydrophobicContact CZ3-CD2 4.39Å; W322-L326 WeakPolarHBondContact O-CB 3.48Å; W322-L326 PolarHBondContact O-N 3.15Å
323	P	88.4	Confident	89.5	Confident	19 Å²	19	64.4 Å²	64.4	12%	0.123	35%	0.345	C	S	.	.	H	α-helix	trans	-71.7	-31.2	-179.3	29	-34.6	0	0	0	113.1	W161 L289 I321 L327	W161-P323 HydrophobicContact CH2-CG 4.49Å; L289-P323 HydrophobicContact CD1-CB 4.36Å; L289-P323 WeakPolarHBondContact CD1-O 3.27Å; L289-P323 HydrophobicContact CD2-CB 4.42Å; I321-P323 HydrophobicContact CG2-CG 4.33Å; P323-L327 WeakPolarHBondContact O-CB 3.3Å; P323-L327 PolarHBondContact O-N 2.92Å
324	S	88.4	Confident	89.6	Confident	0 Å²	0	65 Å²	65	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-73.7	-35.9	175.8	54.3	0	0	0	0	111.6	E290 I321 L327 V328	E290-S324 VanDerWaalsContact OE1-CB 3.24Å; E290-S324 WeakPolarHBondContact OE1-CB 3.2Å; E290-S324 PolarHBondContact OE1-OG 3.39Å; I321-S324 PolarHBondContact N-OG 3.15Å; I321-S324 PolarHBondContact O-N 3.09Å; I321-S324 PolarHBondContact O-OG 2.78Å; S324-L327 PolarHBondContact O-N 2.58Å; S324-V328 WeakPolarHBondContact O-CB 3.15Å; S324-V328 VanDerWaalsContact O-CG2 3.29Å; S324-V328 WeakPolarHBondContact O-CG2 3.1Å; S324-V328 PolarHBondContact O-N 2.87Å
325	Q	90.2	Very high	89.5	Confident	90 Å²	90	58.7 Å²	58.7	42%	0.421	31%	0.311	S	S	.	.	H	α-helix	trans	-61.6	-46.8	170.2	-71.8	168.9	-2.1	0	0	111.5	P319 I321 W322 L327 V328 V329	P319-Q325 HydrophobicContact CB-CG 4.15Å; P319-Q325 HydrophobicContact CG-CG 4.11Å; P319-Q325 WeakPolarHBondContact O-CG 2.98Å; P319-Q325 PolarHBondContact O-NE2 2.88Å; I321-Q325 WeakPolarHBondContact O-CB 3.4Å; I321-Q325 VanDerWaalsContact O-CG 3.31Å; I321-Q325 WeakPolarHBondContact O-CG 3.25Å; I321-Q325 PolarHBondContact O-N 3.5Å; W322-Q325 PolarHBondContact O-N 3.45Å; Q325-L327 PolarHBondContact O-N 3.4Å; Q325-V328 PolarHBondContact O-N 2.82Å; Q325-V329 WeakPolarHBondContact O-CG2 3.11Å; Q325-V329 PolarHBondContact O-N 2.86Å
326	L	92.1	Very high	89.7	Confident	80 Å²	80	61.1 Å²	61.1	42%	0.419	31%	0.312	S	S	.	.	H	α-helix	trans	-61	-44.3	175.5	-179.8	60.3	0	0	0	112	W322 V328 V329 I330	W322-L326 HydrophobicContact CH2-CD2 3.89Å; W322-L326 HydrophobicContact CZ2-CD2 4.13Å; W322-L326 HydrophobicContact CZ3-CD2 4.39Å; W322-L326 WeakPolarHBondContact O-CB 3.48Å; W322-L326 PolarHBondContact O-N 3.15Å; L326-V328 VanDerWaalsContact C-N 3.32Å; L326-V328 PolarHBondContact O-N 3.19Å; L326-V329 PolarHBondContact O-N 2.96Å; L326-I330 HydrophobicContact CD1-CD1 4.24Å; L326-I330 HydrophobicContact CG-CD1 4.12Å; L326-I330 WeakPolarHBondContact O-CG1 3.42Å; L326-I330 PolarHBondContact O-N 3.3Å; L326-I330 VanDerWaalsContact O-N 3.07Å
327	L	90.4	Very high	89.9	Confident	40 Å²	40	61.3 Å²	61.3	21%	0.209	32%	0.316	C	S	.	.	H	α-helix	trans	-60.4	-41.6	174.7	179.5	64.4	0	0	0	111.6	G285 I286 L289 P323 S324 Q325 I330 M331	G285-L327 VanDerWaalsContact C-CD2 3.49Å; I286-L327 HydrophobicContact CG1-CD2 3.99Å; L289-L327 HydrophobicContact CD1-CB 3.85Å; L289-L327 HydrophobicContact CD1-CD2 3.63Å; L289-L327 HydrophobicContact CD1-CG 4.35Å; P323-L327 WeakPolarHBondContact O-CB 3.3Å; P323-L327 PolarHBondContact O-N 2.92Å; S324-L327 PolarHBondContact O-N 2.58Å; Q325-L327 PolarHBondContact O-N 3.4Å; L327-I330 PolarHBondContact O-N 3.16Å; L327-M331 HydrophobicContact CD1-CG 3.96Å; L327-M331 HydrophobicContact CG-CG 4.17Å; L327-M331 WeakPolarHBondContact O-CB 3.48Å; L327-M331 VanDerWaalsContact O-CG 3.29Å; L327-M331 WeakPolarHBondContact O-CG 3.26Å; L327-M331 PolarHBondContact O-N 3.09Å
328	V	91.8	Very high	90	Very high	13 Å²	13	62.6 Å²	62.6	8%	0.079	33%	0.325	C	S	.	.	H	α-helix	trans	-65.5	-41	178.8	165.5	0	0	0	0	111.7	I286 F304 P319 S324 Q325 L326 I330 M331 I332	I286-V328 HydrophobicContact CD1-CG2 3.78Å; I286-V328 HydrophobicContact CG1-CG2 3.99Å; F304-V328 HydrophobicContact CE1-CG2 3.69Å; F304-V328 HydrophobicContact CZ-CG1 4.24Å; F304-V328 HydrophobicContact CZ-CG2 4.04Å; P319-V328 HydrophobicContact CB-CG2 4.36Å; P319-V328 HydrophobicContact CG-CB 4.37Å; P319-V328 HydrophobicContact CG-CG2 4.08Å; S324-V328 WeakPolarHBondContact O-CB 3.15Å; S324-V328 VanDerWaalsContact O-CG2 3.29Å; S324-V328 WeakPolarHBondContact O-CG2 3.1Å; S324-V328 PolarHBondContact O-N 2.87Å; Q325-V328 PolarHBondContact O-N 2.82Å; L326-V328 VanDerWaalsContact C-N 3.32Å; L326-V328 PolarHBondContact O-N 3.19Å; V328-I330 PolarHBondContact O-N 3.49Å; V328-M331 PolarHBondContact O-N 3.08Å; V328-I332 HydrophobicContact CG1-CD1 3.68Å; V328-I332 HydrophobicContact CG1-CG1 4.34Å; V328-I332 WeakPolarHBondContact O-CB 3.34Å; V328-I332 WeakPolarHBondContact O-CD1 3.41Å; V328-I332 WeakPolarHBondContact O-CG1 3.46Å; V328-I332 PolarHBondContact O-N 2.65Å
329	V	93.5	Very high	90.1	Very high	87 Å²	87	60.6 Å²	60.6	53%	0.527	31%	0.311	S	S	.	.	H	α-helix	trans	-59.4	-47.5	173.1	172.7	0	0	0	0	111	Q325 L326 M331 I332 C333	Q325-V329 WeakPolarHBondContact O-CG2 3.11Å; Q325-V329 PolarHBondContact O-N 2.86Å; L326-V329 PolarHBondContact O-N 2.96Å; V329-M331 PolarHBondContact O-N 3.1Å; V329-I332 PolarHBondContact O-N 3.5Å; V329-C333 PolarHBondContact O-N 2.75Å; V329-C333 PolarHBondContact O-SG 3.04Å; V329-C333 VanDerWaalsContact O-SG 3.39Å
330	I	93.4	Very high	90.3	Very high	87 Å²	87	62.4 Å²	62.4	45%	0.446	32%	0.323	S	S	.	.	H	α-helix	trans	-61.2	-46.7	177.7	-66.7	165.7	0	0	0	111	L326 L327 V328 I332 C333 V334	L326-I330 HydrophobicContact CD1-CD1 4.24Å; L326-I330 HydrophobicContact CG-CD1 4.12Å; L326-I330 WeakPolarHBondContact O-CG1 3.42Å; L326-I330 PolarHBondContact O-N 3.3Å; L326-I330 VanDerWaalsContact O-N 3.07Å; L327-I330 PolarHBondContact O-N 3.16Å; V328-I330 PolarHBondContact O-N 3.49Å; I330-I332 VanDerWaalsContact C-N 3.34Å; I330-I332 PolarHBondContact O-N 3.19Å; I330-C333 PolarHBondContact O-N 3.23Å; I330-V334 WeakPolarHBondContact O-CG2 3.48Å; I330-V334 PolarHBondContact O-N 3.27Å
331	M	90.3	Very high	90.7	Very high	21 Å²	21	59.3 Å²	59.3	10%	0.103	32%	0.318	C	S	.	.	H	α-helix	trans	-67.5	-31.4	-179.8	-71.6	-57.6	-58	0	0	112.6	L278 F309 L327 V328 V329 A335	L278-M331 HydrophobicContact CD2-CE 4.03Å; L278-M331 HydrophobicContact CG-CE 4.41Å; F309-M331 HydrophobicContact CE1-CB 4.07Å; F309-M331 HydrophobicContact CE1-CE 4.47Å; F309-M331 HydrophobicContact CZ-CB 4.28Å; F309-M331 HydrophobicContact CZ-CE 3.76Å; L327-M331 HydrophobicContact CD1-CG 3.96Å; L327-M331 HydrophobicContact CG-CG 4.17Å; L327-M331 WeakPolarHBondContact O-CB 3.48Å; L327-M331 VanDerWaalsContact O-CG 3.29Å; L327-M331 WeakPolarHBondContact O-CG 3.26Å; L327-M331 PolarHBondContact O-N 3.09Å; V328-M331 PolarHBondContact O-N 3.08Å; V329-M331 PolarHBondContact O-N 3.1Å; M331-A335 WeakPolarHBondContact O-CB 3.49Å; M331-A335 PolarHBondContact O-N 3.13Å
332	I	93.1	Very high	90.8	Very high	59 Å²	59	60.2 Å²	60.2	30%	0.303	32%	0.323	S	S	.	.	H	α-helix	trans	-64.9	-48.6	170.7	-73.1	164.3	0	0	0	110.1	T308 V328 V329 I330 V334 A335 L336	T308-I332 HydrophobicContact CG2-CD1 3.82Å; T308-I332 HydrophobicContact CG2-CG1 3.53Å; V328-I332 HydrophobicContact CG1-CD1 3.68Å; V328-I332 HydrophobicContact CG1-CG1 4.34Å; V328-I332 WeakPolarHBondContact O-CB 3.34Å; V328-I332 WeakPolarHBondContact O-CD1 3.41Å; V328-I332 WeakPolarHBondContact O-CG1 3.46Å; V328-I332 PolarHBondContact O-N 2.65Å; V329-I332 PolarHBondContact O-N 3.5Å; I330-I332 VanDerWaalsContact C-N 3.34Å; I330-I332 PolarHBondContact O-N 3.19Å; I332-V334 VanDerWaalsContact C-N 3.33Å; I332-V334 PolarHBondContact O-N 3.49Å; I332-A335 PolarHBondContact O-N 3.48Å; I332-L336 HydrophobicContact CG2-CD1 3.64Å; I332-L336 HydrophobicContact CG2-CG 4.17Å; I332-L336 WeakPolarHBondContact O-CB 3.07Å; I332-L336 VanDerWaalsContact O-CG 3.31Å; I332-L336 WeakPolarHBondContact O-CG 3.11Å; I332-L336 PolarHBondContact O-N 3.21Å
333	C	94.1	Very high	90.9	Very high	77 Å²	77	56.9 Å²	56.9	52%	0.52	31%	0.313	S	S	.	.	H	α-helix	trans	-59.8	-42.1	177.6	-67.5	0	0	0	0	112.4	V329 I330 V337	V329-C333 PolarHBondContact O-N 2.75Å; V329-C333 PolarHBondContact O-SG 3.04Å; V329-C333 VanDerWaalsContact O-SG 3.39Å; I330-C333 PolarHBondContact O-N 3.23Å; C333-V337 WeakPolarHBondContact O-CG2 3.25Å; C333-V337 PolarHBondContact O-N 3.03Å
334	V	92.8	Very high	90.9	Very high	63 Å²	63	62.5 Å²	62.5	38%	0.382	34%	0.337	S	S	.	.	H	α-helix	trans	-66.6	-44.9	175.5	173.2	0	0	0	0	111.2	L278 I330 I332 V337 V338	L278-V334 HydrophobicContact CD1-CG1 4.24Å; I330-V334 WeakPolarHBondContact O-CG2 3.48Å; I330-V334 PolarHBondContact O-N 3.27Å; I332-V334 VanDerWaalsContact C-N 3.33Å; I332-V334 PolarHBondContact O-N 3.49Å; V334-V337 PolarHBondContact O-N 3.04Å; V334-V338 HydrophobicContact CG1-CG2 4.13Å; V334-V338 WeakPolarHBondContact O-CB 3.34Å; V334-V338 VanDerWaalsContact O-CG2 3.32Å; V334-V338 WeakPolarHBondContact O-CG2 3.42Å; V334-V338 PolarHBondContact O-N 3.04Å
335	A	90.3	Very high	91	Very high	4 Å²	4	65.5 Å²	65.5	3%	0.033	35%	0.351	C	S	.	.	H	α-helix	trans	-64.7	-43.8	-179.2	0	0	0	0	0	112.8	L278 F309 M331 I332 V337 V338 L339	L278-A335 HydrophobicContact CD2-CB 4.48Å; F309-A335 HydrophobicContact CD1-CB 3.39Å; F309-A335 HydrophobicContact CE1-CB 3.72Å; F309-A335 HydrophobicContact CG-CB 4.01Å; M331-A335 WeakPolarHBondContact O-CB 3.49Å; M331-A335 PolarHBondContact O-N 3.13Å; I332-A335 PolarHBondContact O-N 3.48Å; A335-V337 VanDerWaalsContact C-N 3.25Å; A335-V337 PolarHBondContact O-N 2.79Å; A335-V338 PolarHBondContact O-N 2.88Å; A335-L339 HydrophobicContact CB-CD1 3.78Å; A335-L339 HydrophobicContact CB-CG 4.21Å; A335-L339 VanDerWaalsContact O-CB 3.23Å; A335-L339 WeakPolarHBondContact O-CB 3.28Å; A335-L339 VanDerWaalsContact O-CG 3.28Å; A335-L339 WeakPolarHBondContact O-CG 3.41Å; A335-L339 PolarHBondContact O-N 3.23Å
336	L	91.3	Very high	90.8	Very high	98 Å²	98	62.7 Å²	62.7	51%	0.513	34%	0.339	S	S	.	.	H	α-helix	trans	-65.5	-25.2	179.9	-71.6	175	0	0	0	113.5	T311 I332 P340	T311-L336 HydrophobicContact CG2-CD2 3.8Å; I332-L336 HydrophobicContact CG2-CD1 3.64Å; I332-L336 HydrophobicContact CG2-CG 4.17Å; I332-L336 WeakPolarHBondContact O-CB 3.07Å; I332-L336 VanDerWaalsContact O-CG 3.31Å; I332-L336 WeakPolarHBondContact O-CG 3.11Å; I332-L336 PolarHBondContact O-N 3.21Å; L336-P340 WeakPolarHBondContact O-CD 3.41Å; L336-P340 WeakPolarHBondContact O-CG 3.47Å
337	V	92.1	Very high	90.6	Very high	96 Å²	96	63.5 Å²	63.5	58%	0.582	34%	0.343	S	S	*	.	H	α-helix	trans	-88.2	-46.9	173.9	176.2	0	0	0	0	111.4	C333 V334 A335 L341	C333-V337 WeakPolarHBondContact O-CG2 3.25Å; C333-V337 PolarHBondContact O-N 3.03Å; V334-V337 PolarHBondContact O-N 3.04Å; A335-V337 VanDerWaalsContact C-N 3.25Å; A335-V337 PolarHBondContact O-N 2.79Å; V337-L341 WeakPolarHBondContact O-CD1 3.34Å; V337-L341 WeakPolarHBondContact O-CG 3.29Å
338	V	90.4	Very high	90.5	Very high	49 Å²	49	68.5 Å²	68.5	30%	0.297	36%	0.36	S	S	.	.	H	α-helix	trans	-79.4	-43.3	-171	176.5	0	0	0	0	112.4	L278 V334 A335 Q342	L278-V338 HydrophobicContact CD1-CB 3.93Å; L278-V338 HydrophobicContact CD1-CG1 3.81Å; V334-V338 HydrophobicContact CG1-CG2 4.13Å; V334-V338 WeakPolarHBondContact O-CB 3.34Å; V334-V338 VanDerWaalsContact O-CG2 3.32Å; V334-V338 WeakPolarHBondContact O-CG2 3.42Å; V334-V338 PolarHBondContact O-N 3.04Å; A335-V338 PolarHBondContact O-N 2.88Å; V338-Q342 HydrophobicContact CG1-CG 3.8Å; V338-Q342 WeakPolarHBondContact O-CB 3.4Å; V338-Q342 WeakPolarHBondContact O-CG 3.47Å; V338-Q342 PolarHBondContact O-N 3.33Å
339	L	88.9	Confident	90.1	Very high	18 Å²	18	68.3 Å²	68.3	9%	0.094	36%	0.358	C	S	.	.	H	α-helix	trans	-65.5	-45.6	-171.7	-60	178.5	0	0	0	113.3	L275 L278 F309 A335 L341 Q342 F343	L275-L339 HydrophobicContact CD2-CD2 3.44Å; L275-L339 VanDerWaalsContact CD2-CD2 3.44Å; L278-L339 HydrophobicContact CD1-CD2 3.96Å; L278-L339 HydrophobicContact CD1-CG 4.42Å; L278-L339 HydrophobicContact CD2-CD2 4.38Å; F309-L339 HydrophobicContact CB-CD1 3.7Å; F309-L339 HydrophobicContact CG-CD1 4.13Å; A335-L339 HydrophobicContact CB-CD1 3.78Å; A335-L339 HydrophobicContact CB-CG 4.21Å; A335-L339 VanDerWaalsContact O-CB 3.23Å; A335-L339 WeakPolarHBondContact O-CB 3.28Å; A335-L339 VanDerWaalsContact O-CG 3.28Å; A335-L339 WeakPolarHBondContact O-CG 3.41Å; A335-L339 PolarHBondContact O-N 3.23Å; L339-L341 PolarHBondContact O-N 2.99Å; L339-Q342 PolarHBondContact O-N 2.87Å; L339-F343 HydrophobicContact CB-CD2 4.26Å; L339-F343 HydrophobicContact CB-CE2 4.17Å; L339-F343 WeakPolarHBondContact O-CB 3.48Å; L339-F343 WeakPolarHBondContact O-CD2 3.34Å; L339-F343 PolarHBondContact O-N 3.42Å
340	P	90.8	Very high	89.6	Confident	63 Å²	63	71.2 Å²	71.2	41%	0.409	36%	0.36	S	S	.	.	H	α-helix	trans	-60	-48.2	179	-24.8	36.4	0	0	0	112.2	L336 Q342 F343 E344	L336-P340 WeakPolarHBondContact O-CD 3.41Å; L336-P340 WeakPolarHBondContact O-CG 3.47Å; P340-Q342 VanDerWaalsContact C-N 3.34Å; P340-Q342 PolarHBondContact O-N 3.31Å; P340-F343 PolarHBondContact O-N 3.43Å; P340-E344 WeakPolarHBondContact O-CG 3.26Å; P340-E344 PolarHBondContact O-N 3.25Å
341	L	90.8	Very high	89.1	Confident	102 Å²	102	71.9 Å²	71.9	53%	0.534	36%	0.362	S	S	.	.	H	α-helix	trans	-59.4	-43.4	178.6	-64.3	175.7	0	0	0	112.1	V337 L339 E345	V337-L341 WeakPolarHBondContact O-CD1 3.34Å; V337-L341 WeakPolarHBondContact O-CG 3.29Å; L339-L341 PolarHBondContact O-N 2.99Å; L341-E345 WeakPolarHBondContact O-CB 3.4Å; L341-E345 PolarHBondContact O-N 2.93Å
342	Q	87.8	Confident	88.7	Confident	30 Å²	30	72.8 Å²	72.8	14%	0.14	37%	0.366	C	S	.	.	H	α-helix	trans	-71.2	-31.2	178.8	-64.2	-71.3	-99.4	0	0	112.7	L271 T274 L275 V338 L339 P340 E345 L346	L271-Q342 VanDerWaalsContact CD2-NE2 3.29Å; L271-Q342 VanDerWaalsContact CD2-OE1 3.32Å; T274-Q342 PolarHBondContact OG1-OE1 2.99Å; L275-Q342 HydrophobicContact CD2-CB 4.09Å; L275-Q342 HydrophobicContact CG-CB 4.49Å; V338-Q342 HydrophobicContact CG1-CG 3.8Å; V338-Q342 WeakPolarHBondContact O-CB 3.4Å; V338-Q342 WeakPolarHBondContact O-CG 3.47Å; V338-Q342 PolarHBondContact O-N 3.33Å; L339-Q342 PolarHBondContact O-N 2.87Å; P340-Q342 VanDerWaalsContact C-N 3.34Å; P340-Q342 PolarHBondContact O-N 3.31Å; Q342-E345 PolarHBondContact NE2-OE2 3.4Å; Q342-L346 WeakPolarHBondContact O-CB 3.49Å; Q342-L346 PolarHBondContact O-N 3.48Å
343	F	87.5	Confident	88.1	Confident	99 Å²	99	75.7 Å²	75.7	43%	0.434	37%	0.373	S	S	.	.	H	α-helix	trans	-73.5	-41.5	172.9	-78	-56.9	0	0	0	112.6	L275 L339 P340 L346 I347	L275-F343 HydrophobicContact CD1-CD1 4.27Å; L275-F343 HydrophobicContact CD1-CE1 3.83Å; L275-F343 HydrophobicContact CD1-CZ 4.26Å; L275-F343 HydrophobicContact CD2-CE1 4.41Å; L275-F343 HydrophobicContact CD2-CE2 4.27Å; L275-F343 HydrophobicContact CD2-CZ 4.11Å; L339-F343 HydrophobicContact CB-CD2 4.26Å; L339-F343 HydrophobicContact CB-CE2 4.17Å; L339-F343 WeakPolarHBondContact O-CB 3.48Å; L339-F343 WeakPolarHBondContact O-CD2 3.34Å; L339-F343 PolarHBondContact O-N 3.42Å; P340-F343 PolarHBondContact O-N 3.43Å; F343-L346 HydrophobicContact CD1-CD2 4.46Å; F343-L346 PolarHBondContact O-N 3.27Å; F343-I347 WeakPolarHBondContact O-CB 3.23Å; F343-I347 WeakPolarHBondContact O-CD1 3.48Å; F343-I347 WeakPolarHBondContact O-CG1 3.48Å; F343-I347 PolarHBondContact O-N 3.39Å
344	E	89.8	Confident	87.2	Confident	136 Å²	136	76.8 Å²	76.8	64%	0.636	37%	0.371	S	S	*	.	H	α-helix	trans	-62.7	-46.6	175.5	-73.4	-178.2	170.3	0	0	111.4	P340 L346 I347 Y348	P340-E344 WeakPolarHBondContact O-CG 3.26Å; P340-E344 PolarHBondContact O-N 3.25Å; E344-L346 PolarHBondContact O-N 3.26Å; E344-I347 PolarHBondContact O-N 2.92Å; E344-Y348 VanDerWaalsContact O-CB 3.27Å; E344-Y348 WeakPolarHBondContact O-CB 3.28Å; E344-Y348 PolarHBondContact O-N 2.88Å
345	E	88.9	Confident	86.4	Confident	64 Å²	64	76.6 Å²	76.6	30%	0.299	37%	0.365	S	S	.	.	H	α-helix	trans	-61.6	-44.6	175.5	-164.9	-169.3	157.6	0	0	111.5	Q267 L271 L341 Q342 Y348 L349	Q267-E345 PolarHBondContact NE2-OE1 2.9Å; L271-E345 HydrophobicContact CD1-CB 4.02Å; L271-E345 HydrophobicContact CD1-CG 3.8Å; L271-E345 WeakPolarHBondContact CD2-OE2 3.36Å; L341-E345 WeakPolarHBondContact O-CB 3.4Å; L341-E345 PolarHBondContact O-N 2.93Å; Q342-E345 PolarHBondContact NE2-OE2 3.4Å; E345-Y348 PolarHBondContact O-N 2.87Å; E345-L349 HydrophobicContact CG-CD1 4.07Å; E345-L349 HydrophobicContact CG-CG 4.5Å; E345-L349 WeakPolarHBondContact O-CB 3.47Å; E345-L349 VanDerWaalsContact O-CG 3.25Å; E345-L349 WeakPolarHBondContact O-CG 3.03Å; E345-L349 PolarHBondContact O-N 3.41Å
346	L	86.5	Confident	85.4	Confident	30 Å²	30	78.1 Å²	78.1	16%	0.157	38%	0.375	C	S	.	.	H	α-helix	trans	-62.4	-44.4	178.1	176.2	62	0	0	0	112.2	V268 L271 I272 L275 Q342 F343 E344 W350	V268-L346 HydrophobicContact CB-CD1 4.32Å; V268-L346 HydrophobicContact CG1-CD1 3.78Å; V268-L346 HydrophobicContact CG2-CD1 4.16Å; L271-L346 HydrophobicContact CB-CD1 4.47Å; L271-L346 HydrophobicContact CD1-CB 4.13Å; I272-L346 HydrophobicContact CG1-CD1 4.32Å; L275-L346 HydrophobicContact CD1-CD2 4.08Å; Q342-L346 WeakPolarHBondContact O-CB 3.49Å; Q342-L346 PolarHBondContact O-N 3.48Å; F343-L346 HydrophobicContact CD1-CD2 4.46Å; F343-L346 PolarHBondContact O-N 3.27Å; E344-L346 PolarHBondContact O-N 3.26Å; L346-W350 WeakPolarHBondContact O-CB 3.41Å; L346-W350 PolarHBondContact O-N 2.82Å
347	I	87.6	Confident	84.4	Confident	97 Å²	97	74.2 Å²	74.2	50%	0.497	36%	0.359	S	S	.	.	H	α-helix	trans	-67.3	-42.4	178.2	-70.5	166	0	0	0	110.3	F343 E344 W350 M351	F343-I347 WeakPolarHBondContact O-CB 3.23Å; F343-I347 WeakPolarHBondContact O-CD1 3.48Å; F343-I347 WeakPolarHBondContact O-CG1 3.48Å; F343-I347 PolarHBondContact O-N 3.39Å; E344-I347 PolarHBondContact O-N 2.92Å; I347-W350 PolarHBondContact O-N 2.89Å; I347-M351 HydrophobicContact CG2-CE 4.5Å; I347-M351 VanDerWaalsContact O-CB 3.28Å; I347-M351 WeakPolarHBondContact O-CB 3.26Å; I347-M351 PolarHBondContact O-N 3.4Å
348	Y	88.4	Confident	83.5	Confident	146 Å²	146	71.8 Å²	71.8	57%	0.573	35%	0.353	S	S	*	.	H	α-helix	trans	-59.4	-55.2	176.5	173.3	-107.4	0	0	0	111.6	E344 E345 W350 M351 E352	E344-Y348 VanDerWaalsContact O-CB 3.27Å; E344-Y348 WeakPolarHBondContact O-CB 3.28Å; E344-Y348 PolarHBondContact O-N 2.88Å; E345-Y348 PolarHBondContact O-N 2.87Å; Y348-W350 VanDerWaalsContact C-N 3.28Å; Y348-W350 PolarHBondContact O-N 3.44Å; Y348-M351 PolarHBondContact O-N 3.13Å; Y348-E352 VanDerWaalsContact O-CB 3.3Å; Y348-E352 WeakPolarHBondContact O-CB 3.32Å; Y348-E352 PolarHBondContact O-N 3.5Å
349	L	85	Confident	83.2	Confident	8 Å²	8	74.1 Å²	74.1	4%	0.042	36%	0.364	C	S	.	.	H	α-helix	trans	-62	-35	-180	-64.8	169.8	0	0	0	112.7	M264 Q267 V268 L271 E345 R353	M264-L349 HydrophobicContact CE-CB 4.34Å; M264-L349 HydrophobicContact CE-CD2 3.51Å; M264-L349 HydrophobicContact SD-CD2 3.95Å; Q267-L349 HydrophobicContact CB-CD1 4.09Å; Q267-L349 VanDerWaalsContact CD-CD1 3.47Å; Q267-L349 HydrophobicContact CG-CD1 3.55Å; V268-L349 HydrophobicContact CG2-CB 3.86Å; V268-L349 HydrophobicContact CG2-CD1 4.36Å; L271-L349 HydrophobicContact CD1-CD1 3.62Å; E345-L349 HydrophobicContact CG-CD1 4.07Å; E345-L349 HydrophobicContact CG-CG 4.5Å; E345-L349 WeakPolarHBondContact O-CB 3.47Å; E345-L349 VanDerWaalsContact O-CG 3.25Å; E345-L349 WeakPolarHBondContact O-CG 3.03Å; E345-L349 PolarHBondContact O-N 3.41Å; L349-R353 WeakPolarHBondContact O-CB 3.35Å; L349-R353 PolarHBondContact O-N 2.93Å; L349-R353 VanDerWaalsContact O-N 3.1Å
350	W	81.6	Confident	83.1	Confident	148 Å²	148	73.7 Å²	73.7	56%	0.561	36%	0.361	S	S	*	.	H	α-helix	trans	-71.6	-40.5	176.8	-173.9	84.3	0	0	0	112.3	L346 I347 Y348 Q354	L346-W350 WeakPolarHBondContact O-CB 3.41Å; L346-W350 PolarHBondContact O-N 2.82Å; I347-W350 PolarHBondContact O-N 2.89Å; Y348-W350 VanDerWaalsContact C-N 3.28Å; Y348-W350 PolarHBondContact O-N 3.44Å; W350-Q354 VanDerWaalsContact CZ3-NE2 3.32Å; W350-Q354 PolarHBondContact O-N 3.06Å
351	M	84.1	Confident	82.9	Confident	101 Å²	101	73.6 Å²	73.6	50%	0.498	36%	0.362	S	S	.	.	H	α-helix	trans	-69.4	-41.1	175.8	-170.8	-179.7	-60.1	0	0	111.8	I347 Y348 R353 Q354 K355	I347-M351 HydrophobicContact CG2-CE 4.5Å; I347-M351 VanDerWaalsContact O-CB 3.28Å; I347-M351 WeakPolarHBondContact O-CB 3.26Å; I347-M351 PolarHBondContact O-N 3.4Å; Y348-M351 PolarHBondContact O-N 3.13Å; M351-R353 VanDerWaalsContact C-N 3.3Å; M351-R353 PolarHBondContact O-N 2.86Å; M351-Q354 WeakPolarHBondContact O-CA 3.4Å; M351-Q354 WeakPolarHBondContact O-CB 3.46Å; M351-Q354 PolarHBondContact O-N 3.01Å; M351-K355 PolarHBondContact O-N 2.89Å
352	E	82	Confident	82.7	Confident	40 Å²	40	76.4 Å²	76.4	19%	0.187	37%	0.365	C	S	.	.	H	α-helix	trans	-63.9	-36.4	177.1	-165.4	58.4	-149.4	0	0	111.3	M264 Y348 Q354 K355 S356	M264-E352 HydrophobicContact CE-CB 4.06Å; M264-E352 HydrophobicContact CE-CG 4.1Å; Y348-E352 VanDerWaalsContact O-CB 3.3Å; Y348-E352 WeakPolarHBondContact O-CB 3.32Å; Y348-E352 PolarHBondContact O-N 3.5Å; E352-Q354 VanDerWaalsContact C-N 3.3Å; E352-Q354 PolarHBondContact O-N 3.49Å; E352-K355 PolarHBondContact O-N 3.5Å; E352-K355 WeakPolarHBondContact OE2-CD 3.3Å; E352-K355 IonicContact OE2-NZ 2.72Å; E352-K355 PolarHBondContact OE2-NZ 3.45Å; E352-K355 VanDerWaalsContact OE2-NZ 3.13Å; E352-S356 WeakPolarHBondContact O-CB 3.4Å; E352-S356 PolarHBondContact O-N 2.92Å; E352-S356 PolarHBondContact O-OG 2.92Å
353	R	79.3	Confident	82.7	Confident	120 Å²	120	81.9 Å²	81.9	45%	0.453	39%	0.391	S	S	.	.	H	α-helix	trans	-64.9	-29.1	169	-176.2	176.9	176.5	-174.5	0.2	113.5	L349 M351 G357	L349-R353 WeakPolarHBondContact O-CB 3.35Å; L349-R353 PolarHBondContact O-N 2.93Å; L349-R353 VanDerWaalsContact O-N 3.1Å; M351-R353 VanDerWaalsContact C-N 3.3Å; M351-R353 PolarHBondContact O-N 2.86Å; R353-G357 PolarHBondContact O-N 3.22Å
354	Q	74.8	Confident	82.8	Confident	100 Å²	100	81.3 Å²	81.3	47%	0.467	39%	0.386	S	S	.	.	H	α-helix	trans	-77.4	-41.5	173.9	-72.4	-172.5	4.6	0	0	112.6	W350 M351 E352 G357	W350-Q354 VanDerWaalsContact CZ3-NE2 3.32Å; W350-Q354 PolarHBondContact O-N 3.06Å; M351-Q354 WeakPolarHBondContact O-CA 3.4Å; M351-Q354 WeakPolarHBondContact O-CB 3.46Å; M351-Q354 PolarHBondContact O-N 3.01Å; E352-Q354 VanDerWaalsContact C-N 3.3Å; E352-Q354 PolarHBondContact O-N 3.49Å; Q354-G357 PolarHBondContact O-N 3.43Å
355	K	76.8	Confident	82.6	Confident	60 Å²	60	75.3 Å²	75.3	26%	0.261	36%	0.359	S	S	.	.	H	α-helix	trans	-58.7	-53.9	174.7	-73.7	164.1	137.6	-140.7	0	111.5	M351 E352 G357 E408	M351-K355 PolarHBondContact O-N 2.89Å; E352-K355 PolarHBondContact O-N 3.5Å; E352-K355 WeakPolarHBondContact OE2-CD 3.3Å; E352-K355 IonicContact OE2-NZ 2.72Å; E352-K355 PolarHBondContact OE2-NZ 3.45Å; E352-K355 VanDerWaalsContact OE2-NZ 3.13Å; K355-G357 PolarHBondContact O-N 2.92Å; K355-E408 WeakPolarHBondContact CE-OE2 3.09Å; K355-E408 IonicContact NZ-OE1 3.19Å; K355-E408 PolarHBondContact NZ-OE1 3.2Å; K355-E408 IonicContact NZ-OE2 3.36Å; K355-E408 PolarHBondContact NZ-OE2 3.27Å
356	S	69.2	Low	82.6	Confident	35 Å²	35	77.6 Å²	77.6	25%	0.245	37%	0.37	C	S	.	.	H	α-helix	trans	-66.4	-24.1	-178.1	54	0	0	0	0	112.7	E352 Q430 R441	E352-S356 WeakPolarHBondContact O-CB 3.4Å; E352-S356 PolarHBondContact O-N 2.92Å; E352-S356 PolarHBondContact O-OG 2.92Å; S356-Q430 WeakPolarHBondContact O-CB 3.4Å; S356-Q430 PolarHBondContact O-N 3Å; S356-R441 PolarHBondContact O-NH2 3.13Å
357	G	69.7	Low	82.7	Confident	16 Å²	16	80.6 Å²	80.6	17%	0.165	39%	0.39	C	S	.	.			trans	94.6	172.3	171.4	0	0	0	0	0	114.4	R353 Q354 K355 R441	R353-G357 PolarHBondContact O-N 3.22Å; Q354-G357 PolarHBondContact O-N 3.43Å; K355-G357 PolarHBondContact O-N 2.92Å; G357-R441 VanDerWaalsContact C-NH2 3.29Å; G357-R441 PolarHBondContact O-NH2 3.08Å
358	G	74.5	Confident	82.7	Confident	46 Å²	46	79.2 Å²	79.2	47%	0.474	38%	0.381	S	S	.	.			trans	-73.8	-159.6	-178.8	0	0	0	0	0	114.7	L429 R441	G358-L429 VanDerWaalsContact O-CD2 3.31Å; G358-L429 WeakPolarHBondContact O-CD2 3.43Å; G358-R441 VanDerWaalsContact O-CZ 3.31Å; G358-R441 PolarHBondContact O-NE 3.34Å; G358-R441 PolarHBondContact O-NH2 2.81Å
359	N	82.9	Confident	82.9	Confident	98 Å²	98	76.8 Å²	76.8	52%	0.524	37%	0.373	S	S	.	.			trans	-111.4	142.7	158.8	-71.7	48	0	0	0	107.2	N261 S361 R441	N261-N359 PolarHBondContact ND2-OD1 3.41Å; N359-S361 PolarHBondContact O-N 2.89Å; N359-R441 HydrophobicContact CB-CG 4.28Å
360	Y	86.5	Confident	83.3	Confident	9 Å²	9	76.4 Å²	76.4	4%	0.035	37%	0.372	C	S	.	.			trans	-68.1	126.2	163.4	-161.9	-109.3	0	0	0	107.9	R364 A365 H370 V402 I427 R441 K443	Y360-R364 HydrophobicContact CE1-CB 4.49Å; Y360-R364 HydrophobicContact CE1-CG 4.31Å; Y360-R364 HydrophobicContact CE2-CG 4.07Å; Y360-R364 WeakPolarHBondContact OH-CD 3.48Å; Y360-R364 WeakPolarHBondContact OH-CG 3.47Å; Y360-A365 HydrophobicContact CD1-CB 3.93Å; Y360-A365 HydrophobicContact CE1-CB 3.68Å; Y360-H370 HydrophobicContact CE1-CB 3.99Å; Y360-H370 AromaticContact CE1-CD2 3.9Å; Y360-H370 AromaticContact CE1-CE1 3.91Å; Y360-H370 AromaticContact CE1-CG 3.51Å; Y360-H370 AromaticContact CE1-ND1 3.51Å; Y360-H370 AromaticContact CZ-CG 3.88Å; Y360-V402 HydrophobicContact CD2-CG2 3.68Å; Y360-V402 HydrophobicContact CE2-CG2 3.84Å; Y360-V402 HydrophobicContact CG-CG2 4.07Å; Y360-I427 HydrophobicContact CD2-CD1 3.68Å; Y360-I427 HydrophobicContact CE2-CD1 3.64Å; Y360-R441 WeakPolarHBondContact CB-O 3.26Å; Y360-R441 PolarHBondContact N-O 3.1Å; Y360-K443 HydrophobicContact CD1-CB 4.07Å; Y360-K443 HydrophobicContact CD1-CG 4.27Å
361	S	86.7	Confident	84	Confident	60 Å²	60	69.4 Å²	69.4	42%	0.42	35%	0.345	S	S	.	.			trans	-84.7	138.9	-167	78.7	0	0	0	0	110.8	N359 H363 R364 A365	N359-S361 PolarHBondContact O-N 2.89Å; S361-H363 VanDerWaalsContact C-N 3.27Å; S361-H363 PolarHBondContact O-N 3.07Å; S361-R364 WeakPolarHBondContact O-CB 3.48Å; S361-R364 PolarHBondContact O-N 3.05Å; S361-R364 VanDerWaalsContact OG-CB 3.26Å; S361-R364 WeakPolarHBondContact OG-CB 3.16Å; S361-R364 PolarHBondContact OG-N 3.16Å; S361-A365 PolarHBondContact O-N 3.11Å
362	R	86.6	Confident	84.6	Confident	161 Å²	161	64.6 Å²	64.6	61%	0.608	32%	0.322	S	S	*	.	H	α-helix	trans	-59.8	-37.1	-177.9	-172.6	-179.6	-172.6	173.8	10.3	112.8	R364 A365 Q366 K443	R362-R364 VanDerWaalsContact C-N 3.27Å; R362-R364 PolarHBondContact O-N 3.15Å; R362-A365 PolarHBondContact O-N 3.05Å; R362-Q366 HydrophobicContact CG-CG 4.44Å; R362-Q366 VanDerWaalsContact O-CG 3.32Å; R362-Q366 WeakPolarHBondContact O-CG 3.45Å; R362-Q366 PolarHBondContact O-N 2.87Å; R362-K443 HydrophobicContact CB-CD 4.48Å
363	H	88.6	Confident	85.3	Confident	145 Å²	145	63 Å²	63	67%	0.671	31%	0.314	S	S	*	.	H	α-helix	trans	-59.7	-43.7	176.3	-177.2	27.1	0	0	0	110.8	S361 Q366 T367	S361-H363 VanDerWaalsContact C-N 3.27Å; S361-H363 PolarHBondContact O-N 3.07Å; H363-Q366 PolarHBondContact O-N 3.29Å; H363-T367 PolarHBondContact O-N 3.38Å; H363-T367 PolarHBondContact O-OG1 3.3Å; H363-T367 VanDerWaalsContact O-OG1 3.14Å
364	R	88.6	Confident	86	Confident	88 Å²	88	57.2 Å²	57.2	33%	0.332	29%	0.292	S	S	.	.	H	α-helix	trans	-62.9	-50.7	178	-172.4	175.6	-92.6	159.3	-1.3	112.2	Y360 S361 R362 Q366 T367 E368	Y360-R364 HydrophobicContact CE1-CB 4.49Å; Y360-R364 HydrophobicContact CE1-CG 4.31Å; Y360-R364 HydrophobicContact CE2-CG 4.07Å; Y360-R364 WeakPolarHBondContact OH-CD 3.48Å; Y360-R364 WeakPolarHBondContact OH-CG 3.47Å; S361-R364 WeakPolarHBondContact O-CB 3.48Å; S361-R364 PolarHBondContact O-N 3.05Å; S361-R364 VanDerWaalsContact OG-CB 3.26Å; S361-R364 WeakPolarHBondContact OG-CB 3.16Å; S361-R364 PolarHBondContact OG-N 3.16Å; R362-R364 VanDerWaalsContact C-N 3.27Å; R362-R364 PolarHBondContact O-N 3.15Å; R364-Q366 PolarHBondContact O-N 3.23Å; R364-T367 PolarHBondContact O-N 2.89Å; R364-T367 PolarHBondContact O-OG1 2.84Å; R364-E368 WeakPolarHBondContact CD-OE2 3.34Å; R364-E368 HydrophobicContact CG-CB 4.14Å; R364-E368 HydrophobicContact CG-CG 4.32Å; R364-E368 WeakPolarHBondContact CG-OE2 3.28Å; R364-E368 IonicContact CZ-OE2 3.94Å; R364-E368 IonicContact NE-OE2 3.26Å; R364-E368 PolarHBondContact NE-OE2 3Å; R364-E368 PolarHBondContact O-N 3.28Å
365	A	87.1	Confident	86.8	Confident	9 Å²	9	52.8 Å²	52.8	7%	0.074	27%	0.272	C	S	.	.	H	α-helix	trans	-58.2	-17.4	178.9	0	0	0	0	0	114.5	Y360 S361 R362 K443 D446	Y360-A365 HydrophobicContact CD1-CB 3.93Å; Y360-A365 HydrophobicContact CE1-CB 3.68Å; S361-A365 PolarHBondContact O-N 3.11Å; R362-A365 PolarHBondContact O-N 3.05Å; A365-K443 HydrophobicContact CB-CB 3.93Å; A365-K443 HydrophobicContact CB-CD 4.11Å; A365-K443 HydrophobicContact CB-CG 3.98Å; A365-D446 HydrophobicContact CB-CB 4Å
366	Q	88.4	Confident	87.3	Confident	112 Å²	112	50.5 Å²	50.5	52%	0.523	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-5.8	179	-65.7	-176.6	-32	0	0	113.4	R362 H363 R364	R362-Q366 HydrophobicContact CG-CG 4.44Å; R362-Q366 VanDerWaalsContact O-CG 3.32Å; R362-Q366 WeakPolarHBondContact O-CG 3.45Å; R362-Q366 PolarHBondContact O-N 2.87Å; H363-Q366 PolarHBondContact O-N 3.29Å; R364-Q366 PolarHBondContact O-N 3.23Å
367	T	88.3	Confident	88	Confident	94 Å²	94	51.9 Å²	51.9	58%	0.577	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.5	-29.5	178.9	55.3	0	0	0	0	113.7	H363 R364	H363-T367 PolarHBondContact O-N 3.38Å; H363-T367 PolarHBondContact O-OG1 3.3Å; H363-T367 VanDerWaalsContact O-OG1 3.14Å; R364-T367 PolarHBondContact O-N 2.89Å; R364-T367 PolarHBondContact O-OG1 2.84Å
368	E	88.3	Confident	88.7	Confident	67 Å²	67	51.8 Å²	51.8	31%	0.313	27%	0.273	S	S	.	.	S	Bend	trans	-122.3	140.1	-175.9	-60.2	-178.4	140.8	0	0	108.5	R364 Y400	R364-E368 WeakPolarHBondContact CD-OE2 3.34Å; R364-E368 HydrophobicContact CG-CB 4.14Å; R364-E368 HydrophobicContact CG-CG 4.32Å; R364-E368 WeakPolarHBondContact CG-OE2 3.28Å; R364-E368 IonicContact CZ-OE2 3.94Å; R364-E368 IonicContact NE-OE2 3.26Å; R364-E368 PolarHBondContact NE-OE2 3Å; R364-E368 PolarHBondContact O-N 3.28Å; E368-Y400 HydrophobicContact CB-CD2 3.93Å; E368-Y400 HydrophobicContact CB-CE2 3.78Å; E368-Y400 VanDerWaalsContact CD-CZ 3.48Å; E368-Y400 HydrophobicContact CG-CE2 3.96Å; E368-Y400 PolarHBondContact OE1-OH 2.83Å; E368-Y400 WeakPolarHBondContact OE2-CE2 3.3Å; E368-Y400 PolarHBondContact OE2-OH 2.93Å
369	K	91.7	Very high	89.2	Confident	95 Å²	95	52.8 Å²	52.8	41%	0.413	26%	0.264	S	S	.	.			trans	-79.2	132.9	179.6	-68.8	161.9	156.9	-85.3	0	110.3	Y399 Y400 E448	K369-Y399 HydrophobicContact CB-CD1 3.86Å; K369-Y399 HydrophobicContact CB-CE1 3.88Å; K369-Y399 HydrophobicContact CB-CG 4.28Å; K369-Y399 HydrophobicContact CD-CE1 4Å; K369-Y399 HydrophobicContact CD-CE2 3.95Å; K369-Y399 HydrophobicContact CG-CE1 4.48Å; K369-Y399 PolarHBondContact NZ-OH 3.11Å; K369-Y399 WeakPolarHBondContact O-CA 3.44Å; K369-Y400 PolarHBondContact O-N 2.92Å; K369-E448 HydrophobicContact CG-CG 4.49Å; K369-E448 IonicContact NZ-OE1 2.69Å; K369-E448 PolarHBondContact NZ-OE1 3.18Å; K369-E448 IonicContact NZ-OE2 2.76Å; K369-E448 PolarHBondContact NZ-OE2 2.97Å
370	H	94.7	Very high	89.4	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	151.6	174.3	61.8	-68.1	0	0	0	113.5	Y360 Y400 V402 K443 D446 A447 E448	Y360-H370 HydrophobicContact CE1-CB 3.99Å; Y360-H370 AromaticContact CE1-CD2 3.9Å; Y360-H370 AromaticContact CE1-CE1 3.91Å; Y360-H370 AromaticContact CE1-CG 3.51Å; Y360-H370 AromaticContact CE1-ND1 3.51Å; Y360-H370 AromaticContact CZ-CG 3.88Å; H370-Y400 VanDerWaalsContact CA-O 3.25Å; H370-Y400 WeakPolarHBondContact CA-O 3.38Å; H370-V402 HydrophobicContact CB-CG2 4.21Å; H370-K443 PolarHBondContact NE2-O 3.11Å; H370-D446 VanDerWaalsContact CE1-C 3.45Å; H370-D446 PolarHBondContact CE1-O 3.31Å; H370-D446 VanDerWaalsContact CE1-O 3.23Å; H370-A447 WeakPolarHBondContact NE2-CA 3.35Å; H370-E448 PolarHBondContact O-N 3.33Å
371	V	95.9	Very high	89.2	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.006	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	139.1	174.5	172.4	0	0	0	0	107.9	F390 Y399 Y400 V402 A449 F451 F983	V371-F390 HydrophobicContact CB-CZ 4.24Å; V371-F390 HydrophobicContact CG2-CE2 4.34Å; V371-F390 HydrophobicContact CG2-CZ 4Å; V371-Y399 HydrophobicContact CG2-CD1 4.18Å; V371-Y400 PolarHBondContact N-O 3.42Å; V371-V402 PolarHBondContact O-N 3.29Å; V371-A449 HydrophobicContact CG1-CB 4.08Å; V371-A449 HydrophobicContact CG2-CB 4.26Å; V371-F451 HydrophobicContact CG1-CD2 3.61Å; V371-F451 HydrophobicContact CG1-CE2 3.66Å; V371-F983 HydrophobicContact CG2-CE2 4.16Å; V371-F983 HydrophobicContact CG2-CZ 4.19Å
372	V	96.2	Very high	89.2	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	125.7	-176.5	-172.5	0	0	0	0	110.8	V402 L404 A442 M444 A447 A449 C450 F451	V372-V402 CarbonylContact C-O 3.51Å; V372-V402 VanDerWaalsContact CA-O 3.29Å; V372-V402 WeakPolarHBondContact CA-O 3.39Å; V372-V402 HydrophobicContact CG2-CB 4.33Å; V372-L404 HydrophobicContact CG1-CB 4.5Å; V372-L404 HydrophobicContact CG1-CD1 3.9Å; V372-L404 HydrophobicContact CG1-CG 4.12Å; V372-A442 HydrophobicContact CG1-CB 4.3Å; V372-A442 HydrophobicContact CG2-CB 4.43Å; V372-M444 HydrophobicContact CB-SD 3.52Å; V372-M444 VanDerWaalsContact CB-SD 3.52Å; V372-M444 HydrophobicContact CG1-SD 3.68Å; V372-M444 HydrophobicContact CG2-CG 4.36Å; V372-M444 HydrophobicContact CG2-SD 3.51Å; V372-M444 VanDerWaalsContact CG2-SD 3.51Å; V372-A447 HydrophobicContact CG2-CB 4.03Å; V372-A449 PolarHBondContact N-O 2.89Å; V372-C450 WeakPolarHBondContact O-CA 3.37Å; V372-F451 PolarHBondContact O-N 3.16Å
373	L	95.9	Very high	89.4	Confident	5 Å²	5	44.8 Å²	44.8	3%	0.026	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	114.8	177.9	178.4	62.4	0	0	0	110	F386 V401 V402 I403 L404 F451 L453	L373-F386 HydrophobicContact CD1-CD2 4.41Å; L373-F386 HydrophobicContact CD1-CE2 4.25Å; L373-F386 HydrophobicContact CD1-CZ 4.49Å; L373-F386 HydrophobicContact CD2-CD1 3.87Å; L373-F386 HydrophobicContact CD2-CE1 4.04Å; L373-F386 HydrophobicContact CD2-CG 4.14Å; L373-F386 HydrophobicContact CD2-CZ 4.44Å; L373-V401 HydrophobicContact CB-CG1 4.47Å; L373-V402 PolarHBondContact N-O 3.17Å; L373-I403 HydrophobicContact CD2-CG1 4.49Å; L373-I403 CarbonylContact O-C 3.58Å; L373-I403 WeakPolarHBondContact O-CA 3.36Å; L373-L404 PolarHBondContact O-N 3.02Å; L373-F451 HydrophobicContact CD1-CB 3.76Å; L373-L453 HydrophobicContact CD1-CD1 3.76Å; L373-L453 HydrophobicContact CD1-CG 3.9Å
374	C	94.5	Very high	89.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	121.3	-175.3	-66.8	0	0	0	0	111	L404 V433 F451 I452 L453	C374-L404 WeakPolarHBondContact CA-O 3.31Å; C374-V433 HydrophobicContact CB-CG2 3.63Å; C374-V433 WeakPolarHBondContact SG-CG2 3.19Å; C374-F451 VanDerWaalsContact CB-O 3.31Å; C374-F451 WeakPolarHBondContact CB-O 3.2Å; C374-F451 PolarHBondContact N-O 3.34Å; C374-I452 HydrophobicContact CB-CG1 4.1Å; C374-L453 PolarHBondContact O-N 3.16Å
375	V	91.6	Very high	89.2	Confident	6 Å²	6	37 Å²	37	4%	0.036	20%	0.197	C	C	.	.			trans	-147.6	156	-175.5	68.8	0	0	0	0	112	A377 L378 L382 L404 C405 P406 L453	V375-A377 WeakPolarHBondContact CG2-O 3.25Å; V375-L378 HydrophobicContact CG1-CB 3.98Å; V375-L378 HydrophobicContact CG1-CD1 4.09Å; V375-L378 HydrophobicContact CG1-CG 4.38Å; V375-L382 HydrophobicContact CG2-CD2 4.2Å; V375-L404 PolarHBondContact N-O 2.81Å; V375-L404 VanDerWaalsContact N-O 3.17Å; V375-C405 HydrophobicContact CG1-CB 4.11Å; V375-P406 WeakPolarHBondContact O-CD 3.34Å; V375-L453 HydrophobicContact CG2-CB 4.31Å
376	S	86.9	Confident	89.4	Confident	13 Å²	13	36.5 Å²	36.5	9%	0.091	19%	0.194	C	C	.	.	S	Bend	trans	-76.3	-50.5	179.6	-43.9	0	0	0	0	112.8	P406 S455 Q467 R471	S376-P406 WeakPolarHBondContact O-CD 3.17Å; S376-P406 WeakPolarHBondContact O-CG 3.39Å; S376-S455 VanDerWaalsContact CB-OG 3.25Å; S376-S455 WeakPolarHBondContact CB-OG 3.36Å; S376-S455 PolarHBondContact OG-OG 3.16Å; S376-Q467 PolarHBondContact OG-OE1 3.43Å; S376-R471 VanDerWaalsContact CA-NH2 3.3Å; S376-R471 PolarHBondContact OG-NH1 3.29Å; S376-R471 PolarHBondContact OG-NH2 3.26Å
377	A	85.1	Confident	89.5	Confident	63 Å²	63	31.2 Å²	31.2	52%	0.521	17%	0.169	S	C	.	.	S	Bend	trans	-147	140.9	176.1	0	0	0	0	0	107.7	V375	V375-A377 WeakPolarHBondContact CG2-O 3.25Å
378	L	84.3	Confident	89.5	Confident	14 Å²	14	28.5 Å²	28.5	7%	0.073	15%	0.151	C	C	.	.			trans	-113.2	99.6	-165.5	-173	156.6	0	0	0	110.7	V375 L383 I403 V413 Y428	V375-L378 HydrophobicContact CG1-CB 3.98Å; V375-L378 HydrophobicContact CG1-CD1 4.09Å; V375-L378 HydrophobicContact CG1-CG 4.38Å; L378-L383 HydrophobicContact CD1-CD1 4.45Å; L378-L383 HydrophobicContact CD2-CB 3.7Å; L378-L383 HydrophobicContact CD2-CD2 3.88Å; L378-L383 HydrophobicContact CD2-CG 4.26Å; L378-L383 HydrophobicContact CG-CB 4.31Å; L378-I403 HydrophobicContact CD1-CD1 4Å; L378-I403 HydrophobicContact CD1-CG2 3.55Å; L378-V413 HydrophobicContact CD2-CB 4.24Å; L378-V413 HydrophobicContact CD2-CG1 3.72Å; L378-V413 HydrophobicContact CD2-CG2 3.43Å; L378-V413 VanDerWaalsContact CD2-CG2 3.43Å; L378-V413 WeakPolarHBondContact O-CG2 3.34Å; L378-Y428 HydrophobicContact CD1-CE2 4.45Å
379	K	85	Confident	89.5	Confident	67 Å²	67	25.5 Å²	25.5	29%	0.291	14%	0.137	S	C	.	.			trans	-72.3	155.8	170.6	-76.2	-167.1	173.1	-174	0	111.2	L383 N457 D894	K379-L383 PolarHBondContact O-N 3.31Å; K379-N457 WeakPolarHBondContact CE-OD1 3.47Å; K379-N457 PolarHBondContact NZ-OD1 2.91Å; K379-N457 VanDerWaalsContact NZ-OD1 3.15Å; K379-D894 IonicContact NZ-OD1 2.76Å; K379-D894 PolarHBondContact NZ-OD1 2.82Å
380	I	86.6	Confident	89.5	Confident	56 Å²	56	21 Å²	21	29%	0.287	12%	0.118	S	C	.	.	H	α-helix	trans	-56.9	-53	178.7	-49.6	166.7	0	0	0	110.9	L382 L383 M384 Q412 V416	I380-L382 PolarHBondContact O-N 3.23Å; I380-L383 PolarHBondContact O-N 3.48Å; I380-M384 HydrophobicContact CG2-CG 3.91Å; I380-M384 WeakPolarHBondContact O-CB 3.41Å; I380-M384 WeakPolarHBondContact O-CG 3.49Å; I380-M384 PolarHBondContact O-N 3Å; I380-Q412 HydrophobicContact CD1-CB 3.46Å; I380-Q412 VanDerWaalsContact CD1-CB 3.46Å; I380-Q412 HydrophobicContact CD1-CG 3.79Å; I380-Q412 HydrophobicContact CG1-CB 3.56Å; I380-Q412 HydrophobicContact CG1-CG 4.31Å; I380-V416 HydrophobicContact CG2-CG2 4.21Å
381	D	82.4	Confident	89.2	Confident	66 Å²	66	21.6 Å²	21.6	35%	0.353	12%	0.12	S	C	.	.	H	α-helix	trans	-65.8	-43	-169.1	-54.9	-69.7	0	0	0	111	L383 M384 D385 R950	D381-L383 VanDerWaalsContact C-N 3.33Å; D381-L383 PolarHBondContact O-N 2.98Å; D381-M384 PolarHBondContact O-N 3.04Å; D381-M384 VanDerWaalsContact O-N 3.13Å; D381-D385 WeakPolarHBondContact O-CB 3.21Å; D381-D385 VanDerWaalsContact O-CG 3.26Å; D381-D385 PolarHBondContact O-N 2.96Å; D381-R950 IonicContact OD1-NH2 3.86Å
382	L	86.9	Confident	88.6	Confident	35 Å²	35	22 Å²	22	18%	0.183	12%	0.123	C	C	.	.	H	α-helix	trans	-56.3	-43.7	174.5	-170.1	73.3	0	0	0	112.6	V375 I380 F386 L453 Y980	V375-L382 HydrophobicContact CG2-CD2 4.2Å; I380-L382 PolarHBondContact O-N 3.23Å; L382-F386 VanDerWaalsContact O-CB 3.27Å; L382-F386 WeakPolarHBondContact O-CB 3.32Å; L382-F386 PolarHBondContact O-N 3Å; L382-F386 VanDerWaalsContact O-N 3.09Å; L382-L453 HydrophobicContact CD1-CD1 4.22Å; L382-L453 HydrophobicContact CD2-CD1 3.92Å; L382-L453 HydrophobicContact CG-CD1 4.11Å; L382-Y980 WeakPolarHBondContact CD1-OH 3.49Å
383	L	89.8	Confident	87.9	Confident	3 Å²	3	23.2 Å²	23.2	2%	0.016	13%	0.129	C	C	.	.	H	α-helix	trans	-70.3	-41.6	175.9	176.9	67	0	0	0	111.9	L378 K379 I380 D381 F386 L387 I403 V413 V416 L417	L378-L383 HydrophobicContact CD1-CD1 4.45Å; L378-L383 HydrophobicContact CD2-CB 3.7Å; L378-L383 HydrophobicContact CD2-CD2 3.88Å; L378-L383 HydrophobicContact CD2-CG 4.26Å; L378-L383 HydrophobicContact CG-CB 4.31Å; K379-L383 PolarHBondContact O-N 3.31Å; I380-L383 PolarHBondContact O-N 3.48Å; D381-L383 VanDerWaalsContact C-N 3.33Å; D381-L383 PolarHBondContact O-N 2.98Å; L383-F386 PolarHBondContact O-N 3.11Å; L383-L387 HydrophobicContact CD1-CD1 3.71Å; L383-L387 HydrophobicContact CD1-CD2 4.27Å; L383-L387 HydrophobicContact CD1-CG 3.74Å; L383-L387 HydrophobicContact CD2-CD1 4.17Å; L383-L387 HydrophobicContact CG-CD1 3.7Å; L383-L387 HydrophobicContact CG-CG 4.1Å; L383-L387 WeakPolarHBondContact O-CB 3.39Å; L383-L387 WeakPolarHBondContact O-CG 3.13Å; L383-L387 PolarHBondContact O-N 2.87Å; L383-I403 HydrophobicContact CD1-CD1 3.83Å; L383-V413 HydrophobicContact CD2-CG1 4.02Å; L383-V416 HydrophobicContact CD2-CG1 4.22Å; L383-L417 HydrophobicContact CD2-CD2 4.13Å
384	M	87.1	Confident	87.1	Confident	36 Å²	36	26.2 Å²	26.2	18%	0.177	15%	0.149	C	C	.	.	H	α-helix	trans	-62.4	-47.4	179.7	-80.8	-63.1	-42.8	0	0	111.1	I380 D381 L387 N388 V416 W422	I380-M384 HydrophobicContact CG2-CG 3.91Å; I380-M384 WeakPolarHBondContact O-CB 3.41Å; I380-M384 WeakPolarHBondContact O-CG 3.49Å; I380-M384 PolarHBondContact O-N 3Å; D381-M384 PolarHBondContact O-N 3.04Å; D381-M384 VanDerWaalsContact O-N 3.13Å; M384-L387 PolarHBondContact O-N 2.78Å; M384-N388 WeakPolarHBondContact O-CB 3.44Å; M384-N388 PolarHBondContact O-N 2.93Å; M384-N388 PolarHBondContact O-ND2 3.43Å; M384-V416 HydrophobicContact SD-CG1 3.94Å; M384-V416 HydrophobicContact SD-CG2 4.26Å; M384-W422 HydrophobicContact CE-CH2 3.61Å; M384-W422 HydrophobicContact CE-CZ2 3.98Å; M384-W422 HydrophobicContact SD-CH2 3.67Å; M384-W422 HydrophobicContact SD-CZ2 4.26Å; M384-W422 HydrophobicContact SD-CZ3 4.02Å
385	D	86.9	Confident	86.5	Confident	33 Å²	33	33.8 Å²	33.8	18%	0.176	18%	0.177	C	C	.	.	H	α-helix	trans	-66.4	-40.7	179.7	-64.5	-17.3	0	0	0	110.6	D381 E389	D381-D385 WeakPolarHBondContact O-CB 3.21Å; D381-D385 VanDerWaalsContact O-CG 3.26Å; D381-D385 PolarHBondContact O-N 2.96Å; D385-E389 VanDerWaalsContact O-CB 3.3Å; D385-E389 WeakPolarHBondContact O-CB 3.24Å; D385-E389 PolarHBondContact O-N 3.33Å
386	F	91.5	Very high	86.2	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-58.8	-54	171.2	179.1	-94.5	0	0	0	112.7	L373 L382 L383 N388 E389 F390 V401 F451 Y980	L373-F386 HydrophobicContact CD1-CD2 4.41Å; L373-F386 HydrophobicContact CD1-CE2 4.25Å; L373-F386 HydrophobicContact CD1-CZ 4.49Å; L373-F386 HydrophobicContact CD2-CD1 3.87Å; L373-F386 HydrophobicContact CD2-CE1 4.04Å; L373-F386 HydrophobicContact CD2-CG 4.14Å; L373-F386 HydrophobicContact CD2-CZ 4.44Å; L382-F386 VanDerWaalsContact O-CB 3.27Å; L382-F386 WeakPolarHBondContact O-CB 3.32Å; L382-F386 PolarHBondContact O-N 3Å; L382-F386 VanDerWaalsContact O-N 3.09Å; L383-F386 PolarHBondContact O-N 3.11Å; F386-N388 VanDerWaalsContact C-N 3.33Å; F386-N388 PolarHBondContact O-N 2.75Å; F386-E389 PolarHBondContact O-N 2.84Å; F386-F390 HydrophobicContact CE1-CB 4.35Å; F386-F390 HydrophobicContact CE1-CG 4.42Å; F386-F390 HydrophobicContact CZ-CB 4.37Å; F386-F390 HydrophobicContact CZ-CD2 4.13Å; F386-F390 HydrophobicContact CZ-CG 4.25Å; F386-F390 WeakPolarHBondContact O-CB 3.33Å; F386-F390 PolarHBondContact O-N 3.03Å; F386-V401 HydrophobicContact CE1-CB 4.5Å; F386-V401 HydrophobicContact CE1-CG1 3.76Å; F386-V401 HydrophobicContact CE1-CG2 3.86Å; F386-F451 AromaticContact CE2-CD2 3.61Å; F386-F451 HydrophobicContact CE2-CD2 3.61Å; F386-F451 AromaticContact CE2-CE2 3.62Å; F386-F451 HydrophobicContact CE2-CE2 3.62Å; F386-F451 HydrophobicContact CE2-CG 4.16Å; F386-F451 HydrophobicContact CE2-CZ 4.2Å; F386-F451 AromaticContact CZ-CD2 3.79Å; F386-F451 HydrophobicContact CZ-CD2 3.79Å; F386-F451 AromaticContact CZ-CE2 3.8Å; F386-F451 HydrophobicContact CZ-CE2 3.8Å; F386-Y980 VanDerWaalsContact CA-CE2 3.46Å; F386-Y980 HydrophobicContact CB-CD2 4.17Å; F386-Y980 HydrophobicContact CB-CE2 3.72Å; F386-Y980 AromaticContact CD2-CD1 3.53Å; F386-Y980 HydrophobicContact CD2-CD1 3.53Å; F386-Y980 AromaticContact CD2-CD2 3.92Å; F386-Y980 HydrophobicContact CD2-CD2 3.92Å; F386-Y980 AromaticContact CD2-CE1 3.62Å; F386-Y980 HydrophobicContact CD2-CE1 3.62Å; F386-Y980 AromaticContact CD2-CE2 3.98Å; F386-Y980 HydrophobicContact CD2-CE2 3.98Å; F386-Y980 AromaticContact CD2-CG 3.69Å; F386-Y980 HydrophobicContact CD2-CG 3.69Å; F386-Y980 AromaticContact CD2-CZ 3.82Å; F386-Y980 AromaticContact CE2-CD1 3.98Å; F386-Y980 HydrophobicContact CE2-CD1 3.98Å; F386-Y980 HydrophobicContact CE2-CE1 4.34Å; F386-Y980 HydrophobicContact CE2-CG 4.27Å; F386-Y980 HydrophobicContact CG-CE2 4.37Å
387	L	90.6	Very high	86.1	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-66.2	-36.4	-177	-69	177	0	0	0	112	L383 M384 Y391 V401 W422 V426	L383-L387 HydrophobicContact CD1-CD1 3.71Å; L383-L387 HydrophobicContact CD1-CD2 4.27Å; L383-L387 HydrophobicContact CD1-CG 3.74Å; L383-L387 HydrophobicContact CD2-CD1 4.17Å; L383-L387 HydrophobicContact CG-CD1 3.7Å; L383-L387 HydrophobicContact CG-CG 4.1Å; L383-L387 WeakPolarHBondContact O-CB 3.39Å; L383-L387 WeakPolarHBondContact O-CG 3.13Å; L383-L387 PolarHBondContact O-N 2.87Å; M384-L387 PolarHBondContact O-N 2.78Å; L387-Y391 HydrophobicContact CD2-CD2 4.28Å; L387-Y391 HydrophobicContact CD2-CE2 3.86Å; L387-Y391 WeakPolarHBondContact O-CB 3.35Å; L387-Y391 WeakPolarHBondContact O-CD2 3.49Å; L387-Y391 PolarHBondContact O-N 2.94Å; L387-Y391 VanDerWaalsContact O-N 3.1Å; L387-V401 HydrophobicContact CD2-CG1 4.4Å; L387-V401 HydrophobicContact CD2-CG2 4.42Å; L387-W422 HydrophobicContact CD1-CD2 4.24Å; L387-W422 HydrophobicContact CD1-CG 4.06Å; L387-V426 HydrophobicContact CD1-CG2 4.12Å; L387-V426 HydrophobicContact CD2-CG1 4.33Å; L387-V426 HydrophobicContact CD2-CG2 3.48Å; L387-V426 VanDerWaalsContact CD2-CG2 3.48Å; L387-V426 HydrophobicContact CG-CG2 4.48Å
388	N	87.2	Confident	86.2	Confident	36 Å²	36	39.9 Å²	39.9	19%	0.193	20%	0.198	C	C	.	.	H	α-helix	trans	-68	-45.8	178.8	-77.3	-18.4	0	0	0	111.8	M384 F386 A392 N955	M384-N388 WeakPolarHBondContact O-CB 3.44Å; M384-N388 PolarHBondContact O-N 2.93Å; M384-N388 PolarHBondContact O-ND2 3.43Å; F386-N388 VanDerWaalsContact C-N 3.33Å; F386-N388 PolarHBondContact O-N 2.75Å; N388-A392 VanDerWaalsContact O-CB 3.29Å; N388-A392 WeakPolarHBondContact O-CB 3.43Å; N388-A392 PolarHBondContact O-N 2.99Å; N388-N955 WeakPolarHBondContact CB-OD1 3.46Å; N388-N955 PolarHBondContact O-ND2 3.06Å
389	E	88.6	Confident	86.6	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.019	20%	0.2	C	C	.	.	H	α-helix	trans	-69.7	-50.8	177.2	176.7	53.7	-141	0	0	111.4	D385 F386 Y391 A392 T533 T977 Y980	D385-E389 VanDerWaalsContact O-CB 3.3Å; D385-E389 WeakPolarHBondContact O-CB 3.24Å; D385-E389 PolarHBondContact O-N 3.33Å; F386-E389 PolarHBondContact O-N 2.84Å; E389-Y391 PolarHBondContact O-N 2.96Å; E389-A392 VanDerWaalsContact O-CB 3.26Å; E389-A392 WeakPolarHBondContact O-CB 3.37Å; E389-A392 PolarHBondContact O-N 3.29Å; E389-T533 VanDerWaalsContact CD-OG1 3.24Å; E389-T533 WeakPolarHBondContact OE1-CG2 3.16Å; E389-T533 PolarHBondContact OE1-OG1 3.02Å; E389-T533 WeakPolarHBondContact OE2-CB 3.13Å; E389-T533 WeakPolarHBondContact OE2-CG2 3.44Å; E389-T533 PolarHBondContact OE2-N 3.39Å; E389-T533 PolarHBondContact OE2-OG1 3.31Å; E389-T977 HydrophobicContact CB-CG2 4.13Å; E389-T977 HydrophobicContact CG-CG2 4.12Å; E389-Y980 HydrophobicContact CB-CD2 4.38Å; E389-Y980 HydrophobicContact CG-CD2 4.47Å
390	F	90.7	Very high	87	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.009	19%	0.192	C	C	.	.	H	α-helix	trans	-58.6	-48.8	-178.7	-172.7	-96.3	0	0	0	111.6	V371 F386 A392 L396 Y399 V401 F451 F983	V371-F390 HydrophobicContact CB-CZ 4.24Å; V371-F390 HydrophobicContact CG2-CE2 4.34Å; V371-F390 HydrophobicContact CG2-CZ 4Å; F386-F390 HydrophobicContact CE1-CB 4.35Å; F386-F390 HydrophobicContact CE1-CG 4.42Å; F386-F390 HydrophobicContact CZ-CB 4.37Å; F386-F390 HydrophobicContact CZ-CD2 4.13Å; F386-F390 HydrophobicContact CZ-CG 4.25Å; F386-F390 WeakPolarHBondContact O-CB 3.33Å; F386-F390 PolarHBondContact O-N 3.03Å; F390-A392 VanDerWaalsContact C-N 3.26Å; F390-A392 PolarHBondContact O-N 2.9Å; F390-L396 HydrophobicContact CD1-CD1 4.32Å; F390-L396 HydrophobicContact CD2-CD1 3.76Å; F390-L396 HydrophobicContact CE1-CB 4.5Å; F390-L396 HydrophobicContact CE1-CD1 4.35Å; F390-L396 HydrophobicContact CE1-CD2 3.89Å; F390-L396 HydrophobicContact CE1-CG 4.49Å; F390-L396 HydrophobicContact CE2-CD1 3.78Å; F390-L396 HydrophobicContact CE2-CD2 3.85Å; F390-L396 HydrophobicContact CE2-CG 4.46Å; F390-L396 HydrophobicContact CG-CD1 4.04Å; F390-L396 HydrophobicContact CZ-CD1 4.09Å; F390-L396 HydrophobicContact CZ-CD2 3.45Å; F390-L396 VanDerWaalsContact CZ-CD2 3.45Å; F390-L396 HydrophobicContact CZ-CG 4.31Å; F390-L396 VanDerWaalsContact O-CB 3.28Å; F390-L396 WeakPolarHBondContact O-CB 3.4Å; F390-L396 WeakPolarHBondContact O-CD1 3.42Å; F390-Y399 HydrophobicContact CZ-CD1 4.41Å; F390-Y399 HydrophobicContact CZ-CG 4.48Å; F390-V401 HydrophobicContact CD1-CG2 3.9Å; F390-V401 HydrophobicContact CE1-CG2 3.8Å; F390-F451 HydrophobicContact CD2-CE2 4.32Å; F390-F451 HydrophobicContact CE2-CE2 4.23Å; F390-F983 HydrophobicContact CE2-CD1 4.18Å; F390-F983 HydrophobicContact CE2-CE1 4.45Å
391	Y	89	Confident	87.4	Confident	12 Å²	12	36.5 Å²	36.5	5%	0.047	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-0.3	178	-69.5	-64.4	0	0	0	114.4	L387 E389 L396 Y399 V401 R425 V426 R535	L387-Y391 HydrophobicContact CD2-CD2 4.28Å; L387-Y391 HydrophobicContact CD2-CE2 3.86Å; L387-Y391 WeakPolarHBondContact O-CB 3.35Å; L387-Y391 WeakPolarHBondContact O-CD2 3.49Å; L387-Y391 PolarHBondContact O-N 2.94Å; L387-Y391 VanDerWaalsContact O-N 3.1Å; E389-Y391 PolarHBondContact O-N 2.96Å; Y391-L396 WeakPolarHBondContact CD1-O 3.17Å; Y391-L396 WeakPolarHBondContact CE1-O 3.42Å; Y391-Y399 WeakPolarHBondContact CE1-O 3.48Å; Y391-Y399 PolarHBondContact OH-O 3.05Å; Y391-V401 HydrophobicContact CE2-CG2 4.12Å; Y391-V401 WeakPolarHBondContact OH-CG2 3.47Å; Y391-R425 WeakPolarHBondContact OH-CB 3.49Å; Y391-V426 HydrophobicContact CE2-CG2 4.4Å; Y391-R535 PolarHBondContact O-NH1 2.97Å; Y391-R535 PolarHBondContact O-NH2 2.68Å
392	A	84.2	Confident	88	Confident	10 Å²	10	33.3 Å²	33.3	8%	0.083	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-26.4	175.4	0	0	0	0	0	113.6	N388 E389 F390 T533 R535	N388-A392 VanDerWaalsContact O-CB 3.29Å; N388-A392 WeakPolarHBondContact O-CB 3.43Å; N388-A392 PolarHBondContact O-N 2.99Å; E389-A392 VanDerWaalsContact O-CB 3.26Å; E389-A392 WeakPolarHBondContact O-CB 3.37Å; E389-A392 PolarHBondContact O-N 3.29Å; F390-A392 VanDerWaalsContact C-N 3.26Å; F390-A392 PolarHBondContact O-N 2.9Å; A392-T533 WeakPolarHBondContact CB-OG1 3.4Å; A392-R535 VanDerWaalsContact C-CZ 3.47Å; A392-R535 VanDerWaalsContact CA-CZ 3.45Å; A392-R535 HydrophobicContact CB-CG 4.3Å; A392-R535 PolarHBondContact O-NE 2.94Å; A392-R535 PolarHBondContact O-NH2 3.39Å
393	H	81.5	Confident	88.3	Confident	25 Å²	25	31.7 Å²	31.7	12%	0.116	15%	0.153	C	C	.	.	S	Bend	trans	-75.9	137	171.1	-87.8	72.5	0	0	0	111.4	R395 L396 R535 V984	H393-R395 VanDerWaalsContact C-N 3.33Å; H393-R395 PolarHBondContact O-N 3.32Å; H393-L396 HydrophobicContact CB-CB 4.31Å; H393-L396 HydrophobicContact CB-CD1 4.26Å; H393-L396 HydrophobicContact CB-CG 4.41Å; H393-L396 PolarHBondContact O-N 2.88Å; H393-R535 PolarHBondContact O-NH2 3.03Å; H393-V984 HydrophobicContact CB-CG2 4.44Å
394	P	79.4	Confident	88.5	Confident	69 Å²	69	31.5 Å²	31.5	45%	0.448	15%	0.152	S	C	.	.	G	3₁₀ helix	trans	-68.2	-33.8	-178.5	26.6	-33.5	0	0	0	112.1	L396 Q397	P394-L396 PolarHBondContact O-N 2.9Å; P394-Q397 WeakPolarHBondContact O-CG 3.43Å; P394-Q397 PolarHBondContact O-N 3.45Å
395	R	81.6	Confident	88.8	Confident	159 Å²	159	29.8 Å²	29.8	60%	0.6	14%	0.144	S	C	*	.	G	3₁₀ helix	trans	-67.2	-14.8	177	-59.3	-177	-174.6	-171.3	0	113.6	H393 Y399 E640	H393-R395 VanDerWaalsContact C-N 3.33Å; H393-R395 PolarHBondContact O-N 3.32Å; R395-Y399 WeakPolarHBondContact O-CE2 3.29Å; R395-E640 IonicContact CZ-OE2 2.65Å; R395-E640 VanDerWaalsContact NH2-CD 3.33Å; R395-E640 IonicContact NH2-OE1 3.17Å; R395-E640 PolarHBondContact NH2-OE1 2.7Å; R395-E640 VanDerWaalsContact NH2-OE1 3.14Å; R395-E640 IonicContact NH2-OE2 2.64Å; R395-E640 PolarHBondContact NH2-OE2 3.48Å
396	L	85.3	Confident	89	Confident	5 Å²	5	31 Å²	31	3%	0.026	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-98.3	-0.6	-177.9	-84.8	180	0	0	0	114	F390 Y391 H393 P394 D398 Y399 F983 V984	F390-L396 HydrophobicContact CD1-CD1 4.32Å; F390-L396 HydrophobicContact CD2-CD1 3.76Å; F390-L396 HydrophobicContact CE1-CB 4.5Å; F390-L396 HydrophobicContact CE1-CD1 4.35Å; F390-L396 HydrophobicContact CE1-CD2 3.89Å; F390-L396 HydrophobicContact CE1-CG 4.49Å; F390-L396 HydrophobicContact CE2-CD1 3.78Å; F390-L396 HydrophobicContact CE2-CD2 3.85Å; F390-L396 HydrophobicContact CE2-CG 4.46Å; F390-L396 HydrophobicContact CG-CD1 4.04Å; F390-L396 HydrophobicContact CZ-CD1 4.09Å; F390-L396 HydrophobicContact CZ-CD2 3.45Å; F390-L396 VanDerWaalsContact CZ-CD2 3.45Å; F390-L396 HydrophobicContact CZ-CG 4.31Å; F390-L396 VanDerWaalsContact O-CB 3.28Å; F390-L396 WeakPolarHBondContact O-CB 3.4Å; F390-L396 WeakPolarHBondContact O-CD1 3.42Å; Y391-L396 WeakPolarHBondContact CD1-O 3.17Å; Y391-L396 WeakPolarHBondContact CE1-O 3.42Å; H393-L396 HydrophobicContact CB-CB 4.31Å; H393-L396 HydrophobicContact CB-CD1 4.26Å; H393-L396 HydrophobicContact CB-CG 4.41Å; H393-L396 PolarHBondContact O-N 2.88Å; P394-L396 PolarHBondContact O-N 2.9Å; L396-D398 PolarHBondContact O-N 3.13Å; L396-Y399 HydrophobicContact CD2-CD1 3.77Å; L396-Y399 HydrophobicContact CD2-CD2 3.61Å; L396-Y399 HydrophobicContact CD2-CE1 3.95Å; L396-Y399 HydrophobicContact CD2-CE2 3.8Å; L396-Y399 HydrophobicContact CD2-CG 3.58Å; L396-Y399 PolarHBondContact O-N 3.09Å; L396-F983 HydrophobicContact CD1-CD1 4.22Å; L396-F983 HydrophobicContact CD1-CE1 4.48Å; L396-F983 HydrophobicContact CD2-CD1 4.19Å; L396-F983 HydrophobicContact CD2-CE1 3.65Å; L396-F983 HydrophobicContact CG-CE1 4.49Å; L396-V984 HydrophobicContact CD1-CG2 3.54Å; L396-V984 HydrophobicContact CG-CG2 4.25Å
397	Q	83.4	Confident	88.8	Confident	72 Å²	72	33.4 Å²	33.4	34%	0.336	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-23.4	-173.7	-66.4	-170.2	23.9	0	0	114.5	P394 R425 R535	P394-Q397 WeakPolarHBondContact O-CG 3.43Å; P394-Q397 PolarHBondContact O-N 3.45Å; Q397-R425 PolarHBondContact O-NE 3.02Å; Q397-R425 PolarHBondContact O-NH1 2.93Å; Q397-R425 PolarHBondContact O-NH2 3.29Å; Q397-R535 VanDerWaalsContact NE2-NH2 3.12Å
398	D	87.9	Confident	88.6	Confident	133 Å²	133	37.5 Å²	37.5	71%	0.711	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.9	3.3	-177.3	-51.7	-43.3	0	0	0	113.4	L396	L396-D398 PolarHBondContact O-N 3.13Å
399	Y	92.1	Very high	88.4	Confident	33 Å²	33	38.1 Å²	38.1	13%	0.129	19%	0.192	C	C	.	.			trans	-86.6	143.9	-178.4	-76.4	-117.8	0	0	0	111.6	K369 V371 F390 Y391 R395 L396 E448 F983	K369-Y399 HydrophobicContact CB-CD1 3.86Å; K369-Y399 HydrophobicContact CB-CE1 3.88Å; K369-Y399 HydrophobicContact CB-CG 4.28Å; K369-Y399 HydrophobicContact CD-CE1 4Å; K369-Y399 HydrophobicContact CD-CE2 3.95Å; K369-Y399 HydrophobicContact CG-CE1 4.48Å; K369-Y399 PolarHBondContact NZ-OH 3.11Å; K369-Y399 WeakPolarHBondContact O-CA 3.44Å; V371-Y399 HydrophobicContact CG2-CD1 4.18Å; F390-Y399 HydrophobicContact CZ-CD1 4.41Å; F390-Y399 HydrophobicContact CZ-CG 4.48Å; Y391-Y399 WeakPolarHBondContact CE1-O 3.48Å; Y391-Y399 PolarHBondContact OH-O 3.05Å; R395-Y399 WeakPolarHBondContact O-CE2 3.29Å; L396-Y399 HydrophobicContact CD2-CD1 3.77Å; L396-Y399 HydrophobicContact CD2-CD2 3.61Å; L396-Y399 HydrophobicContact CD2-CE1 3.95Å; L396-Y399 HydrophobicContact CD2-CE2 3.8Å; L396-Y399 HydrophobicContact CD2-CG 3.58Å; L396-Y399 PolarHBondContact O-N 3.09Å; Y399-E448 WeakPolarHBondContact CE1-OE2 3.39Å; Y399-E448 PolarHBondContact OH-OE2 2.77Å; Y399-F983 HydrophobicContact CE1-CE1 4.29Å; Y399-F983 HydrophobicContact CE1-CZ 4.01Å
400	Y	93.8	Very high	88.3	Confident	32 Å²	32	41.9 Å²	41.9	13%	0.125	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	134.3	173.2	-73.6	-102.4	0	0	0	111.5	E368 K369 H370 V371 Q424 R425 I427	E368-Y400 HydrophobicContact CB-CD2 3.93Å; E368-Y400 HydrophobicContact CB-CE2 3.78Å; E368-Y400 VanDerWaalsContact CD-CZ 3.48Å; E368-Y400 HydrophobicContact CG-CE2 3.96Å; E368-Y400 PolarHBondContact OE1-OH 2.83Å; E368-Y400 WeakPolarHBondContact OE2-CE2 3.3Å; E368-Y400 PolarHBondContact OE2-OH 2.93Å; K369-Y400 PolarHBondContact O-N 2.92Å; H370-Y400 VanDerWaalsContact CA-O 3.25Å; H370-Y400 WeakPolarHBondContact CA-O 3.38Å; V371-Y400 PolarHBondContact N-O 3.42Å; Y400-Q424 WeakPolarHBondContact CE1-O 3.27Å; Y400-R425 WeakPolarHBondContact CA-O 3.47Å; Y400-I427 HydrophobicContact CD1-CD1 4.09Å
401	V	95	Very high	88.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	113.9	173.8	170.1	0	0	0	0	108.5	L373 F386 L387 F390 Y391 I403 R425 V426 I427	L373-V401 HydrophobicContact CB-CG1 4.47Å; F386-V401 HydrophobicContact CE1-CB 4.5Å; F386-V401 HydrophobicContact CE1-CG1 3.76Å; F386-V401 HydrophobicContact CE1-CG2 3.86Å; L387-V401 HydrophobicContact CD2-CG1 4.4Å; L387-V401 HydrophobicContact CD2-CG2 4.42Å; F390-V401 HydrophobicContact CD1-CG2 3.9Å; F390-V401 HydrophobicContact CE1-CG2 3.8Å; Y391-V401 HydrophobicContact CE2-CG2 4.12Å; Y391-V401 WeakPolarHBondContact OH-CG2 3.47Å; V401-I403 HydrophobicContact CG1-CG1 4.15Å; V401-R425 PolarHBondContact N-O 3.47Å; V401-V426 HydrophobicContact CB-CG1 4.35Å; V401-V426 HydrophobicContact CB-CG2 4.43Å; V401-V426 HydrophobicContact CG1-CG1 4.18Å; V401-V426 CarbonylContact O-C 3.59Å; V401-V426 WeakPolarHBondContact O-CA 3.46Å; V401-I427 PolarHBondContact O-N 3.22Å
402	V	94.7	Very high	88.1	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	114	177.1	179.3	0	0	0	0	108.4	Y360 H370 V371 V372 L373 I427 L429 A442	Y360-V402 HydrophobicContact CD2-CG2 3.68Å; Y360-V402 HydrophobicContact CE2-CG2 3.84Å; Y360-V402 HydrophobicContact CG-CG2 4.07Å; H370-V402 HydrophobicContact CB-CG2 4.21Å; V371-V402 PolarHBondContact O-N 3.29Å; V372-V402 CarbonylContact C-O 3.51Å; V372-V402 VanDerWaalsContact CA-O 3.29Å; V372-V402 WeakPolarHBondContact CA-O 3.39Å; V372-V402 HydrophobicContact CG2-CB 4.33Å; L373-V402 PolarHBondContact N-O 3.17Å; V402-I427 WeakPolarHBondContact CA-O 3.46Å; V402-L429 HydrophobicContact CG1-CD1 3.42Å; V402-L429 VanDerWaalsContact CG1-CD1 3.42Å; V402-L429 HydrophobicContact CG1-CG 4.02Å; V402-A442 HydrophobicContact CG1-CB 3.96Å
403	I	94.8	Very high	88.3	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	124.3	-178.2	-52	172.6	0	0	0	108.9	L373 L378 L383 V401 C405 V426 I427 Y428 L429	L373-I403 HydrophobicContact CD2-CG1 4.49Å; L373-I403 CarbonylContact O-C 3.58Å; L373-I403 WeakPolarHBondContact O-CA 3.36Å; L378-I403 HydrophobicContact CD1-CD1 4Å; L378-I403 HydrophobicContact CD1-CG2 3.55Å; L383-I403 HydrophobicContact CD1-CD1 3.83Å; V401-I403 HydrophobicContact CG1-CG1 4.15Å; I403-C405 HydrophobicContact CG2-CB 4.4Å; I403-V426 HydrophobicContact CD1-CG1 3.62Å; I403-V426 HydrophobicContact CG1-CG1 4.11Å; I403-I427 PolarHBondContact N-O 3Å; I403-Y428 HydrophobicContact CB-CD2 4.08Å; I403-Y428 HydrophobicContact CD1-CD2 4.19Å; I403-Y428 HydrophobicContact CG2-CD2 3.96Å; I403-Y428 HydrophobicContact CG2-CE2 4.12Å; I403-L429 WeakPolarHBondContact O-CA 3.34Å; I403-L429 WeakPolarHBondContact O-CB 3.35Å; I403-L429 PolarHBondContact O-N 3.25Å; I403-L429 VanDerWaalsContact O-O 3.11Å
404	L	94.3	Very high	88.6	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	116.7	165.4	-80.8	176.4	0	0	0	109.6	V372 L373 C374 V375 L429 D438 L439 A442	V372-L404 HydrophobicContact CG1-CB 4.5Å; V372-L404 HydrophobicContact CG1-CD1 3.9Å; V372-L404 HydrophobicContact CG1-CG 4.12Å; L373-L404 PolarHBondContact O-N 3.02Å; C374-L404 WeakPolarHBondContact CA-O 3.31Å; V375-L404 PolarHBondContact N-O 2.81Å; V375-L404 VanDerWaalsContact N-O 3.17Å; L404-L429 HydrophobicContact CD2-CB 4.02Å; L404-L429 HydrophobicContact CD2-CD1 4.49Å; L404-D438 HydrophobicContact CD2-CB 4.26Å; L404-L439 HydrophobicContact CD1-CD2 4.33Å; L404-A442 HydrophobicContact CD1-CB 3.72Å; L404-A442 HydrophobicContact CD2-CB 4.17Å; L404-A442 HydrophobicContact CG-CB 3.93Å
405	C	92.9	Very high	89.1	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	134.4	178.7	-177.1	0	0	0	0	109.7	V375 I403 Y428 L429 Q430 G431	V375-C405 HydrophobicContact CG1-CB 4.11Å; I403-C405 HydrophobicContact CG2-CB 4.4Å; C405-Y428 HydrophobicContact CB-CE2 4.04Å; C405-L429 PolarHBondContact N-O 2.81Å; C405-Q430 CarbonylContact O-C 3.57Å; C405-Q430 VanDerWaalsContact O-CA 3.27Å; C405-Q430 WeakPolarHBondContact O-CA 3.23Å; C405-G431 CarbonylContact C-O 3.6Å; C405-G431 PolarHBondContact N-O 3.02Å; C405-G431 PolarHBondContact O-N 3.49Å
406	P	91.2	Very high	89.4	Confident	59 Å²	59	52.8 Å²	52.8	38%	0.383	26%	0.256	S	S	.	.	S	Bend	trans	-75.3	-25.8	-179.4	29.8	-34.8	0	0	0	113.2	V375 S376 Q430	V375-P406 WeakPolarHBondContact O-CD 3.34Å; S376-P406 WeakPolarHBondContact O-CD 3.17Å; S376-P406 WeakPolarHBondContact O-CG 3.39Å; P406-Q430 PolarHBondContact O-NE2 3.4Å
407	S	87.7	Confident	89.5	Confident	50 Å²	50	53.5 Å²	53.5	35%	0.35	26%	0.26	S	S	.	.	S	Bend	trans	-65.6	163.1	175.3	-171.9	0	0	0	0	112.2	Y428 Q430	S407-Y428 PolarHBondContact O-OH 3.38Å; S407-Q430 WeakPolarHBondContact O-CG 3.36Å
408	E	85.4	Confident	89.7	Confident	87 Å²	87	55.8 Å²	55.8	41%	0.407	27%	0.271	S	S	.	.			trans	-70.4	163.7	160.8	-73.7	-164.4	-136.3	0	0	111.3	K355 Y428	K355-E408 WeakPolarHBondContact CE-OE2 3.09Å; K355-E408 IonicContact NZ-OE1 3.19Å; K355-E408 PolarHBondContact NZ-OE1 3.2Å; K355-E408 IonicContact NZ-OE2 3.36Å; K355-E408 PolarHBondContact NZ-OE2 3.27Å; E408-Y428 PolarHBondContact O-OH 3.18Å
409	M	83.4	Confident	89.8	Confident	48 Å²	48	52.8 Å²	52.8	24%	0.236	25%	0.254	C	S	.	.			trans	-80.8	113.8	177.3	174.9	-177.8	50.6	0	0	111.7	V413 R414 L417 Y428	M409-V413 HydrophobicContact CG-CB 4.25Å; M409-V413 HydrophobicContact CG-CG1 4.02Å; M409-R414 HydrophobicContact CE-CB 3.99Å; M409-R414 HydrophobicContact CE-CG 3.79Å; M409-R414 HydrophobicContact CG-CB 4.14Å; M409-R414 HydrophobicContact SD-CB 3.87Å; M409-R414 HydrophobicContact SD-CG 4.18Å; M409-L417 HydrophobicContact SD-CD1 3.89Å; M409-Y428 HydrophobicContact CB-CD1 4.11Å; M409-Y428 HydrophobicContact CB-CE1 3.81Å; M409-Y428 HydrophobicContact CB-CE2 4.44Å
410	D	86.8	Confident	89.5	Confident	84 Å²	84	55.9 Å²	55.9	45%	0.449	28%	0.278	S	S	.	.			trans	-52.5	146.9	175	-77.4	-5.1	0	0	0	114	Q412 V413 R414	D410-Q412 PolarHBondContact O-N 3.43Å; D410-V413 HydrophobicContact CB-CB 4.21Å; D410-V413 HydrophobicContact CB-CG2 3.96Å; D410-V413 PolarHBondContact O-N 2.67Å; D410-V413 VanDerWaalsContact O-N 3.15Å; D410-R414 WeakPolarHBondContact O-CB 3.34Å; D410-R414 PolarHBondContact O-N 2.84Å
411	L	87.3	Confident	89	Confident	137 Å²	137	59.5 Å²	59.5	72%	0.717	30%	0.299	S	S	*	.	H	α-helix	trans	-56.6	-25.6	174.7	-64.9	176.1	0	0	0	113.6	R415	L411-R415 PolarHBondContact O-N 3.45Å
412	Q	87.1	Confident	88.7	Confident	88 Å²	88	61.2 Å²	61.2	41%	0.411	31%	0.306	S	S	.	.	H	α-helix	trans	-78.4	-51.1	177.1	-54.8	-71.3	15.2	0	0	111.1	I380 D410 R414 R415 V416	I380-Q412 HydrophobicContact CD1-CB 3.46Å; I380-Q412 VanDerWaalsContact CD1-CB 3.46Å; I380-Q412 HydrophobicContact CD1-CG 3.79Å; I380-Q412 HydrophobicContact CG1-CB 3.56Å; I380-Q412 HydrophobicContact CG1-CG 4.31Å; D410-Q412 PolarHBondContact O-N 3.43Å; Q412-R414 VanDerWaalsContact C-N 3.27Å; Q412-R414 PolarHBondContact O-N 2.98Å; Q412-R415 WeakPolarHBondContact O-CB 3.22Å; Q412-R415 PolarHBondContact O-N 3.23Å; Q412-V416 PolarHBondContact O-N 2.91Å; Q412-V416 VanDerWaalsContact O-N 3.12Å
413	V	88	Confident	88.4	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.006	33%	0.327	C	S	.	.	H	α-helix	trans	-58.3	-40.9	175.5	175.5	0	0	0	0	110.6	L378 L383 M409 D410 R415 V416 L417	L378-V413 HydrophobicContact CD2-CB 4.24Å; L378-V413 HydrophobicContact CD2-CG1 3.72Å; L378-V413 HydrophobicContact CD2-CG2 3.43Å; L378-V413 VanDerWaalsContact CD2-CG2 3.43Å; L378-V413 WeakPolarHBondContact O-CG2 3.34Å; L383-V413 HydrophobicContact CD2-CG1 4.02Å; M409-V413 HydrophobicContact CG-CB 4.25Å; M409-V413 HydrophobicContact CG-CG1 4.02Å; D410-V413 HydrophobicContact CB-CB 4.21Å; D410-V413 HydrophobicContact CB-CG2 3.96Å; D410-V413 PolarHBondContact O-N 2.67Å; D410-V413 VanDerWaalsContact O-N 3.15Å; V413-R415 VanDerWaalsContact C-N 3.3Å; V413-R415 PolarHBondContact O-N 3.44Å; V413-V416 WeakPolarHBondContact O-CB 3.5Å; V413-V416 PolarHBondContact O-N 2.94Å; V413-V416 VanDerWaalsContact O-N 3.12Å; V413-L417 HydrophobicContact CG1-CD1 3.89Å; V413-L417 HydrophobicContact CG1-CG 4.19Å; V413-L417 WeakPolarHBondContact O-CG 3.28Å; V413-L417 PolarHBondContact O-N 2.87Å
414	R	88.6	Confident	87.9	Confident	110 Å²	110	71.1 Å²	71.1	42%	0.415	36%	0.359	S	S	.	.	H	α-helix	trans	-57.8	-39.1	174.4	-173	174.7	-177.5	163.3	2.9	112.8	M409 D410 Q412 Q418	M409-R414 HydrophobicContact CE-CB 3.99Å; M409-R414 HydrophobicContact CE-CG 3.79Å; M409-R414 HydrophobicContact CG-CB 4.14Å; M409-R414 HydrophobicContact SD-CB 3.87Å; M409-R414 HydrophobicContact SD-CG 4.18Å; D410-R414 WeakPolarHBondContact O-CB 3.34Å; D410-R414 PolarHBondContact O-N 2.84Å; Q412-R414 VanDerWaalsContact C-N 3.27Å; Q412-R414 PolarHBondContact O-N 2.98Å; R414-Q418 WeakPolarHBondContact O-CB 3.42Å; R414-Q418 WeakPolarHBondContact O-CG 3.29Å; R414-Q418 PolarHBondContact O-N 3.19Å; R414-Q418 VanDerWaalsContact O-N 3.12Å
415	R	89.1	Confident	87.7	Confident	152 Å²	152	74.5 Å²	74.5	57%	0.574	37%	0.372	S	S	*	.	H	α-helix	trans	-70	-36.5	175.7	-75.4	-170.5	-75.5	-174.3	-6	112.4	L411 Q412 V413	L411-R415 PolarHBondContact O-N 3.45Å; Q412-R415 WeakPolarHBondContact O-CB 3.22Å; Q412-R415 PolarHBondContact O-N 3.23Å; V413-R415 VanDerWaalsContact C-N 3.3Å; V413-R415 PolarHBondContact O-N 3.44Å
416	V	88.1	Confident	87.7	Confident	17 Å²	17	75 Å²	75	10%	0.103	37%	0.374	C	S	.	.	H	α-helix	trans	-61.3	-55.9	171.4	172.6	0	0	0	0	109.9	I380 L383 M384 Q412 V413 Q418 I419 W422	I380-V416 HydrophobicContact CG2-CG2 4.21Å; L383-V416 HydrophobicContact CD2-CG1 4.22Å; M384-V416 HydrophobicContact SD-CG1 3.94Å; M384-V416 HydrophobicContact SD-CG2 4.26Å; Q412-V416 PolarHBondContact O-N 2.91Å; Q412-V416 VanDerWaalsContact O-N 3.12Å; V413-V416 WeakPolarHBondContact O-CB 3.5Å; V413-V416 PolarHBondContact O-N 2.94Å; V413-V416 VanDerWaalsContact O-N 3.12Å; V416-Q418 PolarHBondContact O-N 2.94Å; V416-Q418 VanDerWaalsContact O-N 3.09Å; V416-I419 WeakPolarHBondContact O-CB 3.08Å; V416-I419 PolarHBondContact O-N 2.84Å; V416-W422 HydrophobicContact CG1-CD2 4.43Å; V416-W422 HydrophobicContact CG1-CE3 3.65Å; V416-W422 HydrophobicContact CG1-CZ3 3.8Å
417	L	88.2	Confident	87.7	Confident	20 Å²	20	73.9 Å²	73.9	11%	0.105	37%	0.365	C	S	.	.	H	α-helix	trans	-65.8	-14.6	-177	-62.8	-179.5	0	0	0	114.3	L383 M409 V413 S423 V426 Y428	L383-L417 HydrophobicContact CD2-CD2 4.13Å; M409-L417 HydrophobicContact SD-CD1 3.89Å; V413-L417 HydrophobicContact CG1-CD1 3.89Å; V413-L417 HydrophobicContact CG1-CG 4.19Å; V413-L417 WeakPolarHBondContact O-CG 3.28Å; V413-L417 PolarHBondContact O-N 2.87Å; L417-S423 VanDerWaalsContact O-CA 3.26Å; L417-S423 WeakPolarHBondContact O-CA 3.37Å; L417-S423 WeakPolarHBondContact O-CB 3.45Å; L417-V426 HydrophobicContact CD2-CB 3.79Å; L417-V426 HydrophobicContact CD2-CG1 3.47Å; L417-V426 VanDerWaalsContact CD2-CG1 3.47Å; L417-Y428 HydrophobicContact CD1-CD2 4.4Å; L417-Y428 HydrophobicContact CD1-CG 4.5Å
418	Q	88.2	Confident	87.9	Confident	120 Å²	120	72.6 Å²	72.6	56%	0.561	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-15	172	-81	173.4	-24.2	0	0	114.1	R414 V416	R414-Q418 WeakPolarHBondContact O-CB 3.42Å; R414-Q418 WeakPolarHBondContact O-CG 3.29Å; R414-Q418 PolarHBondContact O-N 3.19Å; R414-Q418 VanDerWaalsContact O-N 3.12Å; V416-Q418 PolarHBondContact O-N 2.94Å; V416-Q418 VanDerWaalsContact O-N 3.09Å
419	I	88.5	Confident	88.2	Confident	70 Å²	70	68.5 Å²	68.5	36%	0.359	33%	0.333	S	S	.	.	S	Bend	trans	-67.9	132.4	179.6	-73.1	163.7	0	0	0	109.9	V416 L421 W422 S423	V416-I419 WeakPolarHBondContact O-CB 3.08Å; V416-I419 PolarHBondContact O-N 2.84Å; I419-L421 HydrophobicContact CG2-CB 4.31Å; I419-L421 PolarHBondContact O-N 3.11Å; I419-W422 HydrophobicContact CB-CE3 3.86Å; I419-W422 HydrophobicContact CB-CZ3 4.2Å; I419-W422 HydrophobicContact CD1-CE3 4.13Å; I419-W422 HydrophobicContact CD1-CZ3 3.65Å; I419-W422 HydrophobicContact CG2-CE3 3.98Å; I419-W422 HydrophobicContact CG2-CZ3 4.17Å; I419-W422 PolarHBondContact O-N 2.85Å; I419-S423 PolarHBondContact O-N 3.3Å; I419-S423 PolarHBondContact O-OG 3.27Å
420	P	86.3	Confident	88.6	Confident	98 Å²	98	68.2 Å²	68.2	64%	0.636	33%	0.331	S	S	*	.	H	α-helix	trans	-53.5	-27.8	-172.5	-31.5	36.4	0	0	0	116.6	S423	P420-S423 WeakPolarHBondContact CA-OG 3.26Å
421	L	83.9	Confident	88.8	Confident	109 Å²	109	64.5 Å²	64.5	57%	0.571	31%	0.313	S	S	*	.	H	α-helix	trans	-68.4	-33	177.6	-63.4	174.2	0	0	0	113.1	I419 R425	I419-L421 HydrophobicContact CG2-CB 4.31Å; I419-L421 PolarHBondContact O-N 3.11Å; L421-R425 WeakPolarHBondContact O-CD 3.46Å
422	W	88.8	Confident	89	Confident	36 Å²	36	59 Å²	59	14%	0.136	29%	0.287	C	S	.	.	H	α-helix	trans	-106.1	-30.2	-175.8	-60.8	-50.9	0	0	0	112.3	M384 L387 V416 I419 Q424 R425 V426	M384-W422 HydrophobicContact CE-CH2 3.61Å; M384-W422 HydrophobicContact CE-CZ2 3.98Å; M384-W422 HydrophobicContact SD-CH2 3.67Å; M384-W422 HydrophobicContact SD-CZ2 4.26Å; M384-W422 HydrophobicContact SD-CZ3 4.02Å; L387-W422 HydrophobicContact CD1-CD2 4.24Å; L387-W422 HydrophobicContact CD1-CG 4.06Å; V416-W422 HydrophobicContact CG1-CD2 4.43Å; V416-W422 HydrophobicContact CG1-CE3 3.65Å; V416-W422 HydrophobicContact CG1-CZ3 3.8Å; I419-W422 HydrophobicContact CB-CE3 3.86Å; I419-W422 HydrophobicContact CB-CZ3 4.2Å; I419-W422 HydrophobicContact CD1-CE3 4.13Å; I419-W422 HydrophobicContact CD1-CZ3 3.65Å; I419-W422 HydrophobicContact CG2-CE3 3.98Å; I419-W422 HydrophobicContact CG2-CZ3 4.17Å; I419-W422 PolarHBondContact O-N 2.85Å; W422-Q424 PolarHBondContact O-N 2.97Å; W422-Q424 VanDerWaalsContact O-N 3.11Å; W422-R425 PolarHBondContact O-N 3.46Å; W422-V426 HydrophobicContact CB-CG2 3.93Å; W422-V426 HydrophobicContact CG-CG2 4.4Å; W422-V426 PolarHBondContact O-N 3.08Å
423	S	87.1	Confident	89.3	Confident	63 Å²	63	55 Å²	55	44%	0.441	27%	0.268	S	S	.	.	H	α-helix	trans	-61.2	-22.6	-179.4	67.9	0	0	0	0	114.6	L417 I419 P420	L417-S423 VanDerWaalsContact O-CA 3.26Å; L417-S423 WeakPolarHBondContact O-CA 3.37Å; L417-S423 WeakPolarHBondContact O-CB 3.45Å; I419-S423 PolarHBondContact O-N 3.3Å; I419-S423 PolarHBondContact O-OG 3.27Å; P420-S423 WeakPolarHBondContact CA-OG 3.26Å
424	Q	86.1	Confident	89.5	Confident	144 Å²	144	58.9 Å²	58.9	67%	0.673	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-24.8	173.3	-65.4	-174	-12.5	0	0	113.6	Y400 W422	Y400-Q424 WeakPolarHBondContact CE1-O 3.27Å; W422-Q424 PolarHBondContact O-N 2.97Å; W422-Q424 VanDerWaalsContact O-N 3.11Å
425	R	89.6	Confident	89.7	Confident	72 Å²	72	59.6 Å²	59.6	27%	0.272	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-28.2	-165.3	-62.2	-177.2	172.4	-174.4	-5.7	114.3	Y391 Q397 Y400 V401 L421 W422	Y391-R425 WeakPolarHBondContact OH-CB 3.49Å; Q397-R425 PolarHBondContact O-NE 3.02Å; Q397-R425 PolarHBondContact O-NH1 2.93Å; Q397-R425 PolarHBondContact O-NH2 3.29Å; Y400-R425 WeakPolarHBondContact CA-O 3.47Å; V401-R425 PolarHBondContact N-O 3.47Å; L421-R425 WeakPolarHBondContact O-CD 3.46Å; W422-R425 PolarHBondContact O-N 3.46Å
426	V	92.4	Very high	89.8	Confident	9 Å²	9	57 Å²	57	6%	0.055	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.8	-172.4	-169.5	0	0	0	0	109.3	L387 Y391 V401 I403 L417 W422	L387-V426 HydrophobicContact CD1-CG2 4.12Å; L387-V426 HydrophobicContact CD2-CG1 4.33Å; L387-V426 HydrophobicContact CD2-CG2 3.48Å; L387-V426 VanDerWaalsContact CD2-CG2 3.48Å; L387-V426 HydrophobicContact CG-CG2 4.48Å; Y391-V426 HydrophobicContact CE2-CG2 4.4Å; V401-V426 HydrophobicContact CB-CG1 4.35Å; V401-V426 HydrophobicContact CB-CG2 4.43Å; V401-V426 HydrophobicContact CG1-CG1 4.18Å; V401-V426 CarbonylContact O-C 3.59Å; V401-V426 WeakPolarHBondContact O-CA 3.46Å; I403-V426 HydrophobicContact CD1-CG1 3.62Å; I403-V426 HydrophobicContact CG1-CG1 4.11Å; L417-V426 HydrophobicContact CD2-CB 3.79Å; L417-V426 HydrophobicContact CD2-CG1 3.47Å; L417-V426 VanDerWaalsContact CD2-CG1 3.47Å; W422-V426 HydrophobicContact CB-CG2 3.93Å; W422-V426 HydrophobicContact CG-CG2 4.4Å; W422-V426 PolarHBondContact O-N 3.08Å
427	I	91.8	Very high	89.8	Confident	37 Å²	37	60.4 Å²	60.4	19%	0.19	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	112.1	-173.7	-62.1	170.5	0	0	0	108.5	Y360 Y400 V401 V402 I403 L429	Y360-I427 HydrophobicContact CD2-CD1 3.68Å; Y360-I427 HydrophobicContact CE2-CD1 3.64Å; Y400-I427 HydrophobicContact CD1-CD1 4.09Å; V401-I427 PolarHBondContact O-N 3.22Å; V402-I427 WeakPolarHBondContact CA-O 3.46Å; I403-I427 PolarHBondContact N-O 3Å; I427-L429 HydrophobicContact CG2-CD2 4.04Å; I427-L429 HydrophobicContact CG2-CG 4.37Å
428	Y	92.3	Very high	89.9	Confident	23 Å²	23	60.2 Å²	60.2	9%	0.09	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	128.1	176.2	-169	-87.7	0	0	0	111.1	L378 I403 C405 S407 E408 M409 L417 Q430	L378-Y428 HydrophobicContact CD1-CE2 4.45Å; I403-Y428 HydrophobicContact CB-CD2 4.08Å; I403-Y428 HydrophobicContact CD1-CD2 4.19Å; I403-Y428 HydrophobicContact CG2-CD2 3.96Å; I403-Y428 HydrophobicContact CG2-CE2 4.12Å; C405-Y428 HydrophobicContact CB-CE2 4.04Å; S407-Y428 PolarHBondContact O-OH 3.38Å; E408-Y428 PolarHBondContact O-OH 3.18Å; M409-Y428 HydrophobicContact CB-CD1 4.11Å; M409-Y428 HydrophobicContact CB-CE1 3.81Å; M409-Y428 HydrophobicContact CB-CE2 4.44Å; L417-Y428 HydrophobicContact CD1-CD2 4.4Å; L417-Y428 HydrophobicContact CD1-CG 4.5Å; Y428-Q430 HydrophobicContact CE1-CB 4.33Å
429	L	91.6	Very high	90.1	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	114.5	174.7	-56.8	-179.1	0	0	0	108.6	G358 V402 I403 L404 C405 I427 G431 R441 A442	G358-L429 VanDerWaalsContact O-CD2 3.31Å; G358-L429 WeakPolarHBondContact O-CD2 3.43Å; V402-L429 HydrophobicContact CG1-CD1 3.42Å; V402-L429 VanDerWaalsContact CG1-CD1 3.42Å; V402-L429 HydrophobicContact CG1-CG 4.02Å; I403-L429 WeakPolarHBondContact O-CA 3.34Å; I403-L429 WeakPolarHBondContact O-CB 3.35Å; I403-L429 PolarHBondContact O-N 3.25Å; I403-L429 VanDerWaalsContact O-O 3.11Å; L404-L429 HydrophobicContact CD2-CB 4.02Å; L404-L429 HydrophobicContact CD2-CD1 4.49Å; C405-L429 PolarHBondContact N-O 2.81Å; I427-L429 HydrophobicContact CG2-CD2 4.04Å; I427-L429 HydrophobicContact CG2-CG 4.37Å; L429-G431 PolarHBondContact O-N 3.08Å; L429-R441 HydrophobicContact CD1-CG 4.47Å; L429-A442 HydrophobicContact CD1-CB 3.96Å
430	Q	91.3	Very high	90.2	Very high	42 Å²	42	54.8 Å²	54.8	20%	0.196	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	118.8	171.7	-174.1	175.6	17.8	0	0	109.4	S356 C405 P406 S407 Y428 R441	S356-Q430 WeakPolarHBondContact O-CB 3.4Å; S356-Q430 PolarHBondContact O-N 3Å; C405-Q430 CarbonylContact O-C 3.57Å; C405-Q430 VanDerWaalsContact O-CA 3.27Å; C405-Q430 WeakPolarHBondContact O-CA 3.23Å; P406-Q430 PolarHBondContact O-NE2 3.4Å; S407-Q430 WeakPolarHBondContact O-CG 3.36Å; Y428-Q430 HydrophobicContact CE1-CB 4.33Å; Q430-R441 PolarHBondContact O-NH1 3.13Å
431	G	90.4	Very high	90.4	Very high	7 Å²	7	50.9 Å²	50.9	7%	0.072	25%	0.253	C	S	.	.			trans	176.1	162.4	-174.8	0	0	0	0	0	112.5	C405 L429 D438	C405-G431 CarbonylContact C-O 3.6Å; C405-G431 PolarHBondContact N-O 3.02Å; C405-G431 PolarHBondContact O-N 3.49Å; L429-G431 PolarHBondContact O-N 3.08Å; G431-D438 VanDerWaalsContact CA-CG 3.5Å; G431-D438 VanDerWaalsContact CA-OD2 3.26Å; G431-D438 WeakPolarHBondContact CA-OD2 3.32Å
432	S	91.3	Very high	90.8	Very high	22 Å²	22	45.7 Å²	45.7	15%	0.154	23%	0.226	C	C	.	.			trans	-113.9	131.9	178.2	-176.7	0	0	0	0	111.2	L434 K435 D438	S432-L434 PolarHBondContact O-N 3.21Å; S432-L434 PolarHBondContact OG-N 3.19Å; S432-K435 WeakPolarHBondContact O-CB 3.42Å; S432-K435 PolarHBondContact O-N 3.35Å; S432-D438 PolarHBondContact N-OD2 2.95Å
433	V	93.3	Very high	91	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.018	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-29	175.2	-168	0	0	0	0	112.6	C374 K435 L439 R471 V475	C374-V433 HydrophobicContact CB-CG2 3.63Å; C374-V433 WeakPolarHBondContact SG-CG2 3.19Å; V433-K435 PolarHBondContact O-N 3.38Å; V433-K435 VanDerWaalsContact O-N 3.12Å; V433-L439 HydrophobicContact CB-CD2 4.39Å; V433-L439 HydrophobicContact CG1-CD2 3.8Å; V433-R471 HydrophobicContact CB-CB 4.33Å; V433-R471 HydrophobicContact CB-CG 4.02Å; V433-R471 HydrophobicContact CG1-CB 4.18Å; V433-R471 HydrophobicContact CG1-CG 4.42Å; V433-R471 HydrophobicContact CG2-CG 4.24Å; V433-V475 HydrophobicContact CG1-CG2 3.41Å; V433-V475 VanDerWaalsContact CG1-CG2 3.41Å
434	L	93.1	Very high	91.3	Very high	82 Å²	82	42 Å²	42	43%	0.429	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	3.4	178.1	-53.8	178.6	0	0	0	113.7	S432 L470 R471 A474	S432-L434 PolarHBondContact O-N 3.21Å; S432-L434 PolarHBondContact OG-N 3.19Å; L434-L470 HydrophobicContact CD2-CB 3.99Å; L434-R471 HydrophobicContact CD2-CG 4.21Å; L434-A474 HydrophobicContact CD2-CB 4.14Å
435	K	92	Very high	91.5	Very high	125 Å²	125	39 Å²	39	54%	0.543	19%	0.192	S	C	.	.			trans	-123.3	114.9	178.6	-63.3	175.8	-179.5	173.8	0	110.5	S432 V433 Q437 D438 L439	S432-K435 WeakPolarHBondContact O-CB 3.42Å; S432-K435 PolarHBondContact O-N 3.35Å; V433-K435 PolarHBondContact O-N 3.38Å; V433-K435 VanDerWaalsContact O-N 3.12Å; K435-Q437 PolarHBondContact O-N 2.92Å; K435-D438 HydrophobicContact CB-CB 4.49Å; K435-D438 PolarHBondContact O-N 3.31Å; K435-L439 PolarHBondContact O-N 3.34Å
436	D	91	Very high	91.7	Very high	97 Å²	97	38.2 Å²	38.2	52%	0.519	19%	0.193	S	C	.	.	H	α-helix	trans	-51.4	-31.3	177.1	-52.2	9.6	0	0	0	113.2	D438 L439 L440 F478	D436-D438 VanDerWaalsContact C-N 3.34Å; D436-D438 PolarHBondContact O-N 3.47Å; D436-L439 PolarHBondContact O-N 3.07Å; D436-L440 VanDerWaalsContact O-CB 3.31Å; D436-L440 WeakPolarHBondContact O-CB 3.35Å; D436-L440 VanDerWaalsContact O-CG 3.26Å; D436-L440 WeakPolarHBondContact O-CG 3.42Å; D436-L440 PolarHBondContact O-N 3.39Å; D436-F478 HydrophobicContact CB-CD2 4.42Å; D436-F478 HydrophobicContact CB-CE2 4.43Å
437	Q	87.8	Confident	91.7	Very high	89 Å²	89	38.3 Å²	38.3	42%	0.416	20%	0.195	S	C	.	.	H	α-helix	trans	-63.8	-36.6	176.7	-62.5	-169.5	7	0	0	112.9	Q258 T260 K435 R441	Q258-Q437 PolarHBondContact O-NE2 3.44Å; T260-Q437 PolarHBondContact OG1-OE1 2.99Å; K435-Q437 PolarHBondContact O-N 2.92Å; Q437-R441 VanDerWaalsContact O-CB 3.27Å; Q437-R441 WeakPolarHBondContact O-CB 3.33Å; Q437-R441 PolarHBondContact O-N 3.41Å
438	D	91.4	Very high	91.8	Very high	16 Å²	16	40 Å²	40	9%	0.086	20%	0.202	C	C	.	.	H	α-helix	trans	-79.4	-35.6	179	-67.8	-35.5	0	0	0	110.7	L404 G431 S432 K435 D436 R441 A442	L404-D438 HydrophobicContact CD2-CB 4.26Å; G431-D438 VanDerWaalsContact CA-CG 3.5Å; G431-D438 VanDerWaalsContact CA-OD2 3.26Å; G431-D438 WeakPolarHBondContact CA-OD2 3.32Å; S432-D438 PolarHBondContact N-OD2 2.95Å; K435-D438 HydrophobicContact CB-CB 4.49Å; K435-D438 PolarHBondContact O-N 3.31Å; D436-D438 VanDerWaalsContact C-N 3.34Å; D436-D438 PolarHBondContact O-N 3.47Å; D438-R441 WeakPolarHBondContact O-CB 3.3Å; D438-R441 PolarHBondContact O-N 3.17Å; D438-R441 VanDerWaalsContact O-N 3.16Å; D438-R441 IonicContact OD1-NH1 2.9Å; D438-A442 PolarHBondContact O-N 3.21Å
439	L	92.3	Very high	91.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.5	-45.4	170.2	-56.3	180	0	0	0	111.8	L404 V433 K435 D436 R441 A442 K443 M444 F478	L404-L439 HydrophobicContact CD1-CD2 4.33Å; V433-L439 HydrophobicContact CB-CD2 4.39Å; V433-L439 HydrophobicContact CG1-CD2 3.8Å; K435-L439 PolarHBondContact O-N 3.34Å; D436-L439 PolarHBondContact O-N 3.07Å; L439-R441 PolarHBondContact O-N 3.44Å; L439-A442 PolarHBondContact O-N 3.07Å; L439-K443 PolarHBondContact O-N 3.45Å; L439-M444 HydrophobicContact CB-CB 4.25Å; L439-M444 HydrophobicContact CB-CG 4.11Å; L439-M444 HydrophobicContact CD2-CE 4.01Å; L439-M444 HydrophobicContact CD2-CG 3.9Å; L439-M444 PolarHBondContact O-N 3.3Å; L439-F478 HydrophobicContact CB-CD1 3.91Å; L439-F478 HydrophobicContact CB-CD2 4.21Å; L439-F478 HydrophobicContact CB-CE1 3.86Å; L439-F478 HydrophobicContact CB-CE2 4.14Å; L439-F478 HydrophobicContact CB-CG 4.11Å; L439-F478 HydrophobicContact CB-CZ 3.97Å; L439-F478 HydrophobicContact CD1-CB 3.62Å; L439-F478 HydrophobicContact CD1-CD1 4.01Å; L439-F478 HydrophobicContact CD1-CD2 3.91Å; L439-F478 HydrophobicContact CD1-CG 3.56Å; L439-F478 HydrophobicContact CG-CG 4.49Å
440	L	91.1	Very high	92.1	Very high	77 Å²	77	38.9 Å²	38.9	40%	0.403	20%	0.197	S	C	.	.	H	α-helix	trans	-60.5	-30.5	173.8	-80.4	167.2	0	0	0	112.8	D436 K443 F478	D436-L440 VanDerWaalsContact O-CB 3.31Å; D436-L440 WeakPolarHBondContact O-CB 3.35Å; D436-L440 VanDerWaalsContact O-CG 3.26Å; D436-L440 WeakPolarHBondContact O-CG 3.42Å; D436-L440 PolarHBondContact O-N 3.39Å; L440-K443 WeakPolarHBondContact O-CE 3.39Å; L440-K443 PolarHBondContact O-NZ 3.44Å; L440-F478 HydrophobicContact CD2-CE2 4.22Å; L440-F478 HydrophobicContact CD2-CZ 3.82Å; L440-F478 HydrophobicContact CG-CE2 3.9Å; L440-F478 HydrophobicContact CG-CZ 3.77Å
441	R	90	Very high	92.4	Very high	15 Å²	15	36.9 Å²	36.9	6%	0.057	19%	0.188	C	C	.	.	H	α-helix	trans	-83.2	-29.7	-178.7	178.5	-176.9	173.9	-144.2	-12.6	113.4	N261 S356 G357 G358 N359 Y360 L429 Q430 Q437 D438 L439	N261-R441 WeakPolarHBondContact ND2-CD 3.39Å; N261-R441 PolarHBondContact ND2-NE 3.09Å; S356-R441 PolarHBondContact O-NH2 3.13Å; G357-R441 VanDerWaalsContact C-NH2 3.29Å; G357-R441 PolarHBondContact O-NH2 3.08Å; G358-R441 VanDerWaalsContact O-CZ 3.31Å; G358-R441 PolarHBondContact O-NE 3.34Å; G358-R441 PolarHBondContact O-NH2 2.81Å; N359-R441 HydrophobicContact CB-CG 4.28Å; Y360-R441 WeakPolarHBondContact CB-O 3.26Å; Y360-R441 PolarHBondContact N-O 3.1Å; L429-R441 HydrophobicContact CD1-CG 4.47Å; Q430-R441 PolarHBondContact O-NH1 3.13Å; Q437-R441 VanDerWaalsContact O-CB 3.27Å; Q437-R441 WeakPolarHBondContact O-CB 3.33Å; Q437-R441 PolarHBondContact O-N 3.41Å; D438-R441 WeakPolarHBondContact O-CB 3.3Å; D438-R441 PolarHBondContact O-N 3.17Å; D438-R441 VanDerWaalsContact O-N 3.16Å; D438-R441 IonicContact OD1-NH1 2.9Å; L439-R441 PolarHBondContact O-N 3.44Å
442	A	92.1	Very high	92.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-83.2	-12.3	169.9	0	0	0	0	0	113.6	V372 V402 L404 L429 D438 L439 M444	V372-A442 HydrophobicContact CG1-CB 4.3Å; V372-A442 HydrophobicContact CG2-CB 4.43Å; V402-A442 HydrophobicContact CG1-CB 3.96Å; L404-A442 HydrophobicContact CD1-CB 3.72Å; L404-A442 HydrophobicContact CD2-CB 4.17Å; L404-A442 HydrophobicContact CG-CB 3.93Å; L429-A442 HydrophobicContact CD1-CB 3.96Å; D438-A442 PolarHBondContact O-N 3.21Å; L439-A442 PolarHBondContact O-N 3.07Å; A442-M444 HydrophobicContact CB-CG 4.31Å
443	K	92.8	Very high	92.7	Very high	20 Å²	20	35.6 Å²	35.6	9%	0.087	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	49.1	-175.2	-70.4	-92.2	118.4	-76.3	0	113.1	Y360 R362 A365 H370 L439 L440 D445 D446 A447	Y360-K443 HydrophobicContact CD1-CB 4.07Å; Y360-K443 HydrophobicContact CD1-CG 4.27Å; R362-K443 HydrophobicContact CB-CD 4.48Å; A365-K443 HydrophobicContact CB-CB 3.93Å; A365-K443 HydrophobicContact CB-CD 4.11Å; A365-K443 HydrophobicContact CB-CG 3.98Å; H370-K443 PolarHBondContact NE2-O 3.11Å; L439-K443 PolarHBondContact O-N 3.45Å; L440-K443 WeakPolarHBondContact O-CE 3.39Å; L440-K443 PolarHBondContact O-NZ 3.44Å; K443-D445 WeakPolarHBondContact CA-OD1 3.4Å; K443-D445 IonicContact NZ-OD1 3.5Å; K443-D445 PolarHBondContact NZ-OD1 3.05Å; K443-D445 IonicContact NZ-OD2 2.79Å; K443-D445 PolarHBondContact NZ-OD2 2.78Å; K443-D445 PolarHBondContact O-N 2.77Å; K443-D446 WeakPolarHBondContact CD-OD2 3.41Å; K443-D446 PolarHBondContact O-N 3.07Å; K443-D446 VanDerWaalsContact O-N 3.08Å; K443-A447 PolarHBondContact O-N 3.12Å
444	M	92.9	Very high	92.6	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.5	174.6	-72.4	-77.9	-81.5	0	0	113.9	V372 L439 A442 C450 V475 F478 A479	V372-M444 HydrophobicContact CB-SD 3.52Å; V372-M444 VanDerWaalsContact CB-SD 3.52Å; V372-M444 HydrophobicContact CG1-SD 3.68Å; V372-M444 HydrophobicContact CG2-CG 4.36Å; V372-M444 HydrophobicContact CG2-SD 3.51Å; V372-M444 VanDerWaalsContact CG2-SD 3.51Å; L439-M444 HydrophobicContact CB-CB 4.25Å; L439-M444 HydrophobicContact CB-CG 4.11Å; L439-M444 HydrophobicContact CD2-CE 4.01Å; L439-M444 HydrophobicContact CD2-CG 3.9Å; L439-M444 PolarHBondContact O-N 3.3Å; A442-M444 HydrophobicContact CB-CG 4.31Å; M444-C450 HydrophobicContact CE-CB 3.87Å; M444-C450 VanDerWaalsContact CE-SG 3.59Å; M444-C450 HydrophobicContact SD-CB 4.31Å; M444-V475 HydrophobicContact CE-CB 4.05Å; M444-V475 HydrophobicContact CE-CG1 3.5Å; M444-V475 VanDerWaalsContact CE-CG1 3.5Å; M444-V475 HydrophobicContact CE-CG2 3.41Å; M444-V475 VanDerWaalsContact CE-CG2 3.41Å; M444-F478 HydrophobicContact CB-CD1 3.99Å; M444-F478 HydrophobicContact CB-CE1 3.87Å; M444-A479 WeakPolarHBondContact O-CB 3.25Å
445	D	91.6	Very high	92.2	Very high	81 Å²	81	32.7 Å²	32.7	43%	0.433	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-31.9	173.1	44.9	-30.3	0	0	0	113.7	K443 F478	K443-D445 WeakPolarHBondContact CA-OD1 3.4Å; K443-D445 IonicContact NZ-OD1 3.5Å; K443-D445 PolarHBondContact NZ-OD1 3.05Å; K443-D445 IonicContact NZ-OD2 2.79Å; K443-D445 PolarHBondContact NZ-OD2 2.78Å; K443-D445 PolarHBondContact O-N 2.77Å; D445-F478 HydrophobicContact CB-CE1 4.32Å
446	D	92.3	Very high	91.8	Very high	57 Å²	57	28.9 Å²	28.9	31%	0.305	15%	0.147	S	C	.	.	S	Bend	trans	-105.1	4.2	178.8	-64.8	-49.6	0	0	0	112	A365 H370 K443	A365-D446 HydrophobicContact CB-CB 4Å; H370-D446 VanDerWaalsContact CE1-C 3.45Å; H370-D446 PolarHBondContact CE1-O 3.31Å; H370-D446 VanDerWaalsContact CE1-O 3.23Å; K443-D446 WeakPolarHBondContact CD-OD2 3.41Å; K443-D446 PolarHBondContact O-N 3.07Å; K443-D446 VanDerWaalsContact O-N 3.08Å
447	A	93.6	Very high	90.9	Very high	11 Å²	11	26.8 Å²	26.8	9%	0.091	14%	0.136	C	C	.	.			trans	-83.2	142.4	-170.8	0	0	0	0	0	114	H370 V372 K443	H370-A447 WeakPolarHBondContact NE2-CA 3.35Å; V372-A447 HydrophobicContact CG2-CB 4.03Å; K443-A447 PolarHBondContact O-N 3.12Å
448	E	93.1	Very high	90.4	Very high	71 Å²	71	26.1 Å²	26.1	33%	0.332	13%	0.132	S	C	.	.	S	Bend	trans	-84	-18.7	-178.5	-60.5	-152.4	142.7	0	0	114.6	K369 H370 Y399 P483	K369-E448 HydrophobicContact CG-CG 4.49Å; K369-E448 IonicContact NZ-OE1 2.69Å; K369-E448 PolarHBondContact NZ-OE1 3.18Å; K369-E448 IonicContact NZ-OE2 2.76Å; K369-E448 PolarHBondContact NZ-OE2 2.97Å; H370-E448 PolarHBondContact O-N 3.33Å; Y399-E448 WeakPolarHBondContact CE1-OE2 3.39Å; Y399-E448 PolarHBondContact OH-OE2 2.77Å; E448-P483 VanDerWaalsContact O-CD 3.28Å; E448-P483 WeakPolarHBondContact O-CD 3.4Å; E448-P483 WeakPolarHBondContact O-CG 3.4Å
449	A	94.8	Very high	89.7	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	158.7	170	0	0	0	0	0	111.8	V371 V372 C482 P483 Y485 F983	V371-A449 HydrophobicContact CG1-CB 4.08Å; V371-A449 HydrophobicContact CG2-CB 4.26Å; V372-A449 PolarHBondContact N-O 2.89Å; A449-C482 VanDerWaalsContact C-SG 3.55Å; A449-P483 HydrophobicContact CB-CG 4.21Å; A449-Y485 HydrophobicContact CB-CD2 3.96Å; A449-Y485 HydrophobicContact CB-CE2 3.64Å; A449-F983 HydrophobicContact CB-CD2 3.59Å; A449-F983 HydrophobicContact CB-CE2 3.5Å; A449-F983 VanDerWaalsContact CB-CE2 3.5Å
450	C	96.2	Very high	89.4	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	123.7	165.9	-178.6	0	0	0	0	111	V372 M444 V475 P483 L484 Y485	V372-C450 WeakPolarHBondContact O-CA 3.37Å; M444-C450 HydrophobicContact CE-CB 3.87Å; M444-C450 VanDerWaalsContact CE-SG 3.59Å; M444-C450 HydrophobicContact SD-CB 4.31Å; C450-V475 HydrophobicContact CB-CG1 4.31Å; C450-P483 PolarHBondContact N-O 3.22Å; C450-P483 VanDerWaalsContact N-O 3.15Å; C450-L484 HydrophobicContact CB-CD1 3.87Å; C450-Y485 PolarHBondContact O-N 2.86Å
451	F	96.8	Very high	89.2	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	129.4	168.4	-70.6	-73.4	0	0	0	109.8	V371 V372 L373 C374 F386 F390 Y485 L979 F983	V371-F451 HydrophobicContact CG1-CD2 3.61Å; V371-F451 HydrophobicContact CG1-CE2 3.66Å; V372-F451 PolarHBondContact O-N 3.16Å; L373-F451 HydrophobicContact CD1-CB 3.76Å; C374-F451 VanDerWaalsContact CB-O 3.31Å; C374-F451 WeakPolarHBondContact CB-O 3.2Å; C374-F451 PolarHBondContact N-O 3.34Å; F386-F451 AromaticContact CE2-CD2 3.61Å; F386-F451 HydrophobicContact CE2-CD2 3.61Å; F386-F451 AromaticContact CE2-CE2 3.62Å; F386-F451 HydrophobicContact CE2-CE2 3.62Å; F386-F451 HydrophobicContact CE2-CG 4.16Å; F386-F451 HydrophobicContact CE2-CZ 4.2Å; F386-F451 AromaticContact CZ-CD2 3.79Å; F386-F451 HydrophobicContact CZ-CD2 3.79Å; F386-F451 AromaticContact CZ-CE2 3.8Å; F386-F451 HydrophobicContact CZ-CE2 3.8Å; F390-F451 HydrophobicContact CD2-CE2 4.32Å; F390-F451 HydrophobicContact CE2-CE2 4.23Å; F451-Y485 CarbonylContact C-O 3.49Å; F451-Y485 WeakPolarHBondContact CA-O 3.47Å; F451-Y485 VanDerWaalsContact CD1-CB 3.44Å; F451-Y485 HydrophobicContact CD1-CG 4.04Å; F451-Y485 HydrophobicContact CE1-CD1 4.16Å; F451-Y485 HydrophobicContact CE1-CD2 4.49Å; F451-Y485 AromaticContact CE1-CG 3.9Å; F451-Y485 HydrophobicContact CE1-CG 3.9Å; F451-L979 HydrophobicContact CD1-CD2 4.4Å; F451-L979 HydrophobicContact CD1-CG 4.27Å; F451-L979 HydrophobicContact CE1-CG 4.42Å; F451-F983 HydrophobicContact CE1-CB 4.5Å; F451-F983 HydrophobicContact CZ-CB 3.8Å; F451-F983 HydrophobicContact CZ-CG 4.43Å
452	I	95.9	Very high	89.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	114.4	172.2	-61.8	175.3	0	0	0	108.5	C374 T468 R471 A472 V475 L484 Y485 V486 Q487	C374-I452 HydrophobicContact CB-CG1 4.1Å; I452-T468 HydrophobicContact CG2-CG2 4.06Å; I452-R471 HydrophobicContact CD1-CB 3.97Å; I452-R471 HydrophobicContact CG2-CB 4.19Å; I452-A472 HydrophobicContact CD1-CB 4.08Å; I452-V475 HydrophobicContact CD1-CG2 4.24Å; I452-L484 HydrophobicContact CD1-CD1 3.82Å; I452-L484 HydrophobicContact CD1-CD2 4.39Å; I452-L484 HydrophobicContact CD1-CG 4.39Å; I452-L484 HydrophobicContact CG1-CD1 4.32Å; I452-Y485 PolarHBondContact N-O 3.26Å; I452-V486 HydrophobicContact CB-CG1 4.25Å; I452-V486 HydrophobicContact CB-CG2 4.37Å; I452-V486 HydrophobicContact CD1-CG2 4.43Å; I452-V486 HydrophobicContact CG2-CG1 4.32Å; I452-Q487 PolarHBondContact O-N 3.49Å
453	L	93.2	Very high	89.2	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.01	20%	0.199	C	C	.	.			trans	-103	142.9	179.6	-49.5	-171.3	0	0	0	111.2	L373 C374 V375 L382 Q487 L979 Y980	L373-L453 HydrophobicContact CD1-CD1 3.76Å; L373-L453 HydrophobicContact CD1-CG 3.9Å; C374-L453 PolarHBondContact O-N 3.16Å; V375-L453 HydrophobicContact CG2-CB 4.31Å; L382-L453 HydrophobicContact CD1-CD1 4.22Å; L382-L453 HydrophobicContact CD2-CD1 3.92Å; L382-L453 HydrophobicContact CG-CD1 4.11Å; L453-Q487 HydrophobicContact CD2-CB 4.42Å; L453-L979 HydrophobicContact CD2-CD2 3.71Å; L453-Y980 HydrophobicContact CD1-CE1 4.09Å; L453-Y980 WeakPolarHBondContact CD1-OH 3.32Å; L453-Y980 HydrophobicContact CD2-CE1 3.9Å
454	S	90.6	Very high	89.1	Confident	7 Å²	7	35.6 Å²	35.6	5%	0.049	20%	0.195	C	C	.	.			trans	-92.6	150.8	-180	-158.9	0	0	0	0	112	R456 D465	S454-R456 PolarHBondContact O-N 2.71Å; S454-D465 PolarHBondContact OG-OD1 3.19Å
455	S	85.3	Confident	89.1	Confident	18 Å²	18	35.6 Å²	35.6	13%	0.126	20%	0.195	C	C	.	.			trans	-88.1	94.7	-174.3	-2.4	0	0	0	0	111.7	S376 N457 E458	S376-S455 VanDerWaalsContact CB-OG 3.25Å; S376-S455 WeakPolarHBondContact CB-OG 3.36Å; S376-S455 PolarHBondContact OG-OG 3.16Å; S455-N457 VanDerWaalsContact C-N 3.27Å; S455-N457 PolarHBondContact O-N 3.05Å; S455-E458 WeakPolarHBondContact CB-OE2 3.45Å; S455-E458 PolarHBondContact O-N 3.45Å; S455-E458 PolarHBondContact OG-OE2 3.14Å
456	R	82.4	Confident	89.3	Confident	45 Å²	45	36.3 Å²	36.3	17%	0.17	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-29.1	-177.7	-69.8	-171.2	-179.2	121.6	1.3	116	S454 R461 L489 E506 I972 D976	S454-R456 PolarHBondContact O-N 2.71Å; R456-R461 PolarHBondContact O-NH1 3.13Å; R456-L489 HydrophobicContact CG-CD2 4.28Å; R456-E506 IonicContact CZ-OE1 3.38Å; R456-E506 IonicContact NE-OE1 2.67Å; R456-E506 PolarHBondContact NE-OE1 2.87Å; R456-E506 IonicContact NE-OE2 3.54Å; R456-E506 PolarHBondContact NE-OE2 3.17Å; R456-E506 IonicContact NH2-OE1 3.9Å; R456-E506 PolarHBondContact NH2-OE1 2.86Å; R456-I972 PolarHBondContact NH2-O 3.37Å; R456-D976 IonicContact CZ-OD1 2.7Å; R456-D976 IonicContact CZ-OD2 3.65Å; R456-D976 IonicContact NH1-OD1 3.86Å; R456-D976 PolarHBondContact NH1-OD1 3.1Å; R456-D976 IonicContact NH1-OD2 3.73Å; R456-D976 PolarHBondContact NH1-OD2 2.87Å; R456-D976 IonicContact NH2-OD1 2.88Å; R456-D976 PolarHBondContact NH2-OD1 2.86Å; R456-D976 IonicContact NH2-OD2 2.67Å; R456-D976 PolarHBondContact NH2-OD2 3.23Å; R456-D976 VanDerWaalsContact NH2-OD2 3.15Å
457	N	72.9	Confident	89.3	Confident	53 Å²	53	36.6 Å²	36.6	28%	0.283	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	6.2	-174.4	-65.5	106.8	0	0	0	113.6	K379 S455 M889	K379-N457 WeakPolarHBondContact CE-OD1 3.47Å; K379-N457 PolarHBondContact NZ-OD1 2.91Å; K379-N457 VanDerWaalsContact NZ-OD1 3.15Å; S455-N457 VanDerWaalsContact C-N 3.27Å; S455-N457 PolarHBondContact O-N 3.05Å; N457-M889 PolarHBondContact ND2-O 3.18Å
458	E	77.3	Confident	89.4	Confident	74 Å²	74	36 Å²	36	35%	0.346	19%	0.191	S	C	.	.	S	Bend	trans	-71.3	144.9	171.3	-82.2	178.5	136.7	0	0	111	S455 D460 A464	S455-E458 WeakPolarHBondContact CB-OE2 3.45Å; S455-E458 PolarHBondContact O-N 3.45Å; S455-E458 PolarHBondContact OG-OE2 3.14Å; E458-D460 PolarHBondContact O-N 3.01Å; E458-A464 HydrophobicContact CB-CB 4.38Å; E458-A464 WeakPolarHBondContact OE2-CB 3.4Å
459	V	77.3	Confident	89.5	Confident	130 Å²	130	32.9 Å²	32.9	79%	0.788	18%	0.176	S	C	*	.	S	Bend	trans	-65.6	-26.8	-174	-177.3	0	0	0	0	112.5
460	D	85.6	Confident	89.6	Confident	81 Å²	81	37 Å²	37	43%	0.433	20%	0.198	S	C	.	.			trans	-119.2	115.8	170.7	175	24.3	0	0	0	110.7	E458 M462 A463 A464	E458-D460 PolarHBondContact O-N 3.01Å; D460-M462 VanDerWaalsContact C-N 3.28Å; D460-M462 PolarHBondContact O-N 3.06Å; D460-M462 WeakPolarHBondContact OD1-CB 3.31Å; D460-M462 PolarHBondContact OD1-N 3.47Å; D460-A463 HydrophobicContact CB-CB 4.01Å; D460-A463 VanDerWaalsContact CG-N 3.34Å; D460-A463 PolarHBondContact O-N 3.26Å; D460-A463 VanDerWaalsContact OD2-CB 3.24Å; D460-A463 WeakPolarHBondContact OD2-CB 3.33Å; D460-A463 PolarHBondContact OD2-N 2.88Å; D460-A464 PolarHBondContact O-N 3.39Å
461	R	87.1	Confident	89.5	Confident	17 Å²	17	37.3 Å²	37.3	6%	0.064	20%	0.199	C	C	.	.	H	α-helix	trans	-68.2	-27.4	177.3	-52.2	-171.5	79.2	73.5	-3.2	112	R456 D465 L489 E506	R456-R461 PolarHBondContact O-NH1 3.13Å; R461-D465 PolarHBondContact O-N 3.11Å; R461-L489 HydrophobicContact CB-CD1 3.86Å; R461-L489 HydrophobicContact CG-CD1 4.32Å; R461-E506 IonicContact NH2-OE2 2.71Å
462	M	89.9	Confident	89.5	Confident	48 Å²	48	37.3 Å²	37.3	24%	0.236	20%	0.199	C	C	.	.	H	α-helix	trans	-72.8	-45.4	175.7	-65.7	-60.2	-76.7	0	0	110.9	D460 A464 D465 H466 K490 N493	D460-M462 VanDerWaalsContact C-N 3.28Å; D460-M462 PolarHBondContact O-N 3.06Å; D460-M462 WeakPolarHBondContact OD1-CB 3.31Å; D460-M462 PolarHBondContact OD1-N 3.47Å; M462-A464 VanDerWaalsContact C-N 3.29Å; M462-A464 PolarHBondContact O-N 3.01Å; M462-D465 PolarHBondContact O-N 3.05Å; M462-H466 PolarHBondContact O-N 2.88Å; M462-H466 PolarHBondContact O-ND1 3.13Å; M462-K490 HydrophobicContact CG-CD 4.48Å; M462-K490 HydrophobicContact SD-CB 4.27Å; M462-K490 HydrophobicContact SD-CD 3.66Å; M462-K490 HydrophobicContact SD-CG 4.49Å; M462-N493 PolarHBondContact SD-ND2 3.46Å
463	A	91.2	Very high	89.5	Confident	52 Å²	52	43 Å²	43	43%	0.43	22%	0.22	S	C	.	.	H	α-helix	trans	-57.2	-41.1	173.5	0	0	0	0	0	112.6	D460 H466 Q467	D460-A463 HydrophobicContact CB-CB 4.01Å; D460-A463 VanDerWaalsContact CG-N 3.34Å; D460-A463 PolarHBondContact O-N 3.26Å; D460-A463 VanDerWaalsContact OD2-CB 3.24Å; D460-A463 WeakPolarHBondContact OD2-CB 3.33Å; D460-A463 PolarHBondContact OD2-N 2.88Å; A463-H466 PolarHBondContact O-N 2.98Å; A463-Q467 WeakPolarHBondContact O-CB 3.09Å; A463-Q467 PolarHBondContact O-N 3.48Å
464	A	90.9	Very high	89.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.9	-49	175.5	0	0	0	0	0	112.1	E458 D460 M462 Q467 T468 L489	E458-A464 HydrophobicContact CB-CB 4.38Å; E458-A464 WeakPolarHBondContact OE2-CB 3.4Å; D460-A464 PolarHBondContact O-N 3.39Å; M462-A464 VanDerWaalsContact C-N 3.29Å; M462-A464 PolarHBondContact O-N 3.01Å; A464-Q467 WeakPolarHBondContact O-CB 3.25Å; A464-Q467 PolarHBondContact O-N 3.45Å; A464-T468 PolarHBondContact O-N 3.32Å; A464-L489 HydrophobicContact CB-CD1 4.05Å
465	D	93.9	Very high	89.9	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-68.6	-38.3	178	-81.5	-12	0	0	0	113.4	S454 R461 M462 Q467 T468 I469 I488 L489 K490 N493	S454-D465 PolarHBondContact OG-OD1 3.19Å; R461-D465 PolarHBondContact O-N 3.11Å; M462-D465 PolarHBondContact O-N 3.05Å; D465-Q467 PolarHBondContact O-N 2.86Å; D465-T468 PolarHBondContact O-N 2.89Å; D465-T468 VanDerWaalsContact O-N 3.09Å; D465-T468 PolarHBondContact O-OG1 3.37Å; D465-I469 VanDerWaalsContact O-CG1 3.32Å; D465-I469 WeakPolarHBondContact O-CG1 3.34Å; D465-I469 PolarHBondContact O-N 2.95Å; D465-I488 HydrophobicContact CB-CG2 4.4Å; D465-I488 WeakPolarHBondContact OD2-CG2 3.48Å; D465-L489 WeakPolarHBondContact OD1-CG 3.16Å; D465-L489 PolarHBondContact OD1-N 2.85Å; D465-L489 PolarHBondContact OD2-N 2.97Å; D465-L489 VanDerWaalsContact OD2-N 3.17Å; D465-K490 PolarHBondContact OD2-N 3.19Å; D465-N493 HydrophobicContact CB-CB 3.98Å; D465-N493 WeakPolarHBondContact CB-ND2 3.41Å; D465-N493 PolarHBondContact OD2-ND2 3.11Å
466	H	94.4	Very high	90.3	Very high	96 Å²	96	45.2 Å²	45.2	44%	0.444	23%	0.231	S	C	.	.	H	α-helix	trans	-59	-35.8	171.2	-74.8	98.1	0	0	0	111	M462 A463 L470	M462-H466 PolarHBondContact O-N 2.88Å; M462-H466 PolarHBondContact O-ND1 3.13Å; A463-H466 PolarHBondContact O-N 2.98Å; H466-L470 VanDerWaalsContact O-CG 3.28Å; H466-L470 WeakPolarHBondContact O-CG 3.34Å; H466-L470 PolarHBondContact O-N 3.38Å
467	Q	93.3	Very high	90.9	Very high	63 Å²	63	48.2 Å²	48.2	29%	0.294	25%	0.25	S	C	.	.	H	α-helix	trans	-68.4	-37.5	174.5	-159.3	-176.8	75.4	0	0	112.3	S376 A463 A464 D465 R471	S376-Q467 PolarHBondContact OG-OE1 3.43Å; A463-Q467 WeakPolarHBondContact O-CB 3.09Å; A463-Q467 PolarHBondContact O-N 3.48Å; A464-Q467 WeakPolarHBondContact O-CB 3.25Å; A464-Q467 PolarHBondContact O-N 3.45Å; D465-Q467 PolarHBondContact O-N 2.86Å; Q467-R471 WeakPolarHBondContact O-CG 3.41Å; Q467-R471 PolarHBondContact O-N 3.06Å; Q467-R471 VanDerWaalsContact OE1-CZ 3.28Å
468	T	94.6	Very high	92	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-69.9	-37.2	174.6	63.8	0	0	0	0	112.5	I452 A464 D465 R471 A472	I452-T468 HydrophobicContact CG2-CG2 4.06Å; A464-T468 PolarHBondContact O-N 3.32Å; D465-T468 PolarHBondContact O-N 2.89Å; D465-T468 VanDerWaalsContact O-N 3.09Å; D465-T468 PolarHBondContact O-OG1 3.37Å; T468-R471 PolarHBondContact O-N 3.32Å; T468-A472 WeakPolarHBondContact O-CB 3.39Å; T468-A472 PolarHBondContact O-N 2.81Å
469	I	96.4	Very high	92.8	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-57.9	-50.6	171.7	-66.8	161	0	0	0	110.5	D465 R471 A472 W473 N493 H496 V497	D465-I469 VanDerWaalsContact O-CG1 3.32Å; D465-I469 WeakPolarHBondContact O-CG1 3.34Å; D465-I469 PolarHBondContact O-N 2.95Å; I469-R471 VanDerWaalsContact C-N 3.32Å; I469-R471 PolarHBondContact O-N 3.31Å; I469-A472 WeakPolarHBondContact O-CB 3.19Å; I469-A472 PolarHBondContact O-N 2.96Å; I469-A472 VanDerWaalsContact O-N 3.11Å; I469-W473 HydrophobicContact CG2-CD2 4.02Å; I469-W473 HydrophobicContact CG2-CE3 4.21Å; I469-W473 HydrophobicContact CG2-CH2 3.75Å; I469-W473 HydrophobicContact CG2-CZ2 3.52Å; I469-W473 HydrophobicContact CG2-CZ3 4.09Å; I469-W473 PolarHBondContact O-N 3.15Å; I469-N493 HydrophobicContact CD1-CB 4.1Å; I469-H496 HydrophobicContact CD1-CB 3.87Å; I469-H496 HydrophobicContact CG1-CB 4.09Å; I469-H496 HydrophobicContact CG2-CB 4.06Å; I469-V497 HydrophobicContact CB-CG2 4.3Å; I469-V497 HydrophobicContact CG1-CG2 3.56Å
470	L	95.9	Very high	93.6	Very high	87 Å²	87	42.7 Å²	42.7	46%	0.455	22%	0.221	S	C	.	.	H	α-helix	trans	-63.1	-36.5	179	-70.1	172.2	0	0	0	112.5	L434 H466 W473 A474	L434-L470 HydrophobicContact CD2-CB 3.99Å; H466-L470 VanDerWaalsContact O-CG 3.28Å; H466-L470 WeakPolarHBondContact O-CG 3.34Å; H466-L470 PolarHBondContact O-N 3.38Å; L470-W473 HydrophobicContact CD2-CE3 3.91Å; L470-W473 HydrophobicContact CD2-CZ3 4Å; L470-A474 WeakPolarHBondContact O-CB 3.08Å; L470-A474 PolarHBondContact O-N 3.48Å
471	R	95.3	Very high	93.9	Very high	5 Å²	5	46.4 Å²	46.4	2%	0.019	24%	0.241	C	C	.	.	H	α-helix	trans	-63.7	-44.4	171.5	-70.7	170.7	177.4	159.6	4.4	111.4	S376 V433 L434 I452 Q467 T468 I469 W473 A474 V475	S376-R471 VanDerWaalsContact CA-NH2 3.3Å; S376-R471 PolarHBondContact OG-NH1 3.29Å; S376-R471 PolarHBondContact OG-NH2 3.26Å; V433-R471 HydrophobicContact CB-CB 4.33Å; V433-R471 HydrophobicContact CB-CG 4.02Å; V433-R471 HydrophobicContact CG1-CB 4.18Å; V433-R471 HydrophobicContact CG1-CG 4.42Å; V433-R471 HydrophobicContact CG2-CG 4.24Å; L434-R471 HydrophobicContact CD2-CG 4.21Å; I452-R471 HydrophobicContact CD1-CB 3.97Å; I452-R471 HydrophobicContact CG2-CB 4.19Å; Q467-R471 WeakPolarHBondContact O-CG 3.41Å; Q467-R471 PolarHBondContact O-N 3.06Å; Q467-R471 VanDerWaalsContact OE1-CZ 3.28Å; T468-R471 PolarHBondContact O-N 3.32Å; I469-R471 VanDerWaalsContact C-N 3.32Å; I469-R471 PolarHBondContact O-N 3.31Å; R471-W473 PolarHBondContact O-N 2.63Å; R471-A474 PolarHBondContact O-N 3.38Å; R471-V475 WeakPolarHBondContact O-CG2 3.24Å; R471-V475 PolarHBondContact O-N 3.21Å
472	A	95.9	Very high	94.3	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.3	-42.4	-179.5	0	0	0	0	0	111.9	I452 T468 I469 K476 L484 V486 V497 F499	I452-A472 HydrophobicContact CD1-CB 4.08Å; T468-A472 WeakPolarHBondContact O-CB 3.39Å; T468-A472 PolarHBondContact O-N 2.81Å; I469-A472 WeakPolarHBondContact O-CB 3.19Å; I469-A472 PolarHBondContact O-N 2.96Å; I469-A472 VanDerWaalsContact O-N 3.11Å; A472-K476 PolarHBondContact O-N 3.37Å; A472-L484 HydrophobicContact CB-CD2 3.75Å; A472-V486 HydrophobicContact CB-CG2 4.42Å; A472-V497 HydrophobicContact CB-CG1 3.83Å; A472-F499 HydrophobicContact CB-CZ 3.89Å
473	W	95.9	Very high	94.5	Very high	119 Å²	119	45.3 Å²	45.3	45%	0.451	24%	0.24	S	C	.	.	H	α-helix	trans	-63.9	-46.2	171.7	-65.1	-22.3	0	0	0	112.1	I469 L470 R471 V475 K476 D477 F499	I469-W473 HydrophobicContact CG2-CD2 4.02Å; I469-W473 HydrophobicContact CG2-CE3 4.21Å; I469-W473 HydrophobicContact CG2-CH2 3.75Å; I469-W473 HydrophobicContact CG2-CZ2 3.52Å; I469-W473 HydrophobicContact CG2-CZ3 4.09Å; I469-W473 PolarHBondContact O-N 3.15Å; L470-W473 HydrophobicContact CD2-CE3 3.91Å; L470-W473 HydrophobicContact CD2-CZ3 4Å; R471-W473 PolarHBondContact O-N 2.63Å; W473-V475 VanDerWaalsContact C-N 3.29Å; W473-V475 PolarHBondContact O-N 3.2Å; W473-K476 PolarHBondContact O-N 3.01Å; W473-K476 VanDerWaalsContact O-N 3.11Å; W473-D477 WeakPolarHBondContact O-CB 3.42Å; W473-D477 PolarHBondContact O-N 3.07Å; W473-F499 AromaticContact CD1-CE1 3.43Å; W473-F499 VanDerWaalsContact CD1-CE1 3.43Å; W473-F499 AromaticContact CD1-CZ 3.52Å; W473-F499 AromaticContact NE1-CE1 3.43Å
474	A	96.1	Very high	94.7	Very high	20 Å²	20	42.9 Å²	42.9	17%	0.165	22%	0.22	C	C	.	.	H	α-helix	trans	-58.9	-38.2	178.1	0	0	0	0	0	112.9	L434 L470 R471 F478	L434-A474 HydrophobicContact CD2-CB 4.14Å; L470-A474 WeakPolarHBondContact O-CB 3.08Å; L470-A474 PolarHBondContact O-N 3.48Å; R471-A474 PolarHBondContact O-N 3.38Å; A474-F478 WeakPolarHBondContact O-CB 3.21Å; A474-F478 PolarHBondContact O-N 3.09Å
475	V	95.7	Very high	95	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-67.3	-44.6	173.3	175.9	0	0	0	0	111.7	V433 M444 C450 I452 R471 W473 F478 A479 L484	V433-V475 HydrophobicContact CG1-CG2 3.41Å; V433-V475 VanDerWaalsContact CG1-CG2 3.41Å; M444-V475 HydrophobicContact CE-CB 4.05Å; M444-V475 HydrophobicContact CE-CG1 3.5Å; M444-V475 VanDerWaalsContact CE-CG1 3.5Å; M444-V475 HydrophobicContact CE-CG2 3.41Å; M444-V475 VanDerWaalsContact CE-CG2 3.41Å; C450-V475 HydrophobicContact CB-CG1 4.31Å; I452-V475 HydrophobicContact CD1-CG2 4.24Å; R471-V475 WeakPolarHBondContact O-CG2 3.24Å; R471-V475 PolarHBondContact O-N 3.21Å; W473-V475 VanDerWaalsContact C-N 3.29Å; W473-V475 PolarHBondContact O-N 3.2Å; V475-F478 PolarHBondContact O-N 3.35Å; V475-A479 PolarHBondContact O-N 3.2Å; V475-L484 HydrophobicContact CB-CD1 4.09Å; V475-L484 HydrophobicContact CG1-CD1 3.71Å
476	K	94.9	Very high	95.1	Very high	55 Å²	55	43.5 Å²	43.5	24%	0.239	22%	0.222	C	C	.	.	H	α-helix	trans	-72.4	-31.8	-177.1	-148.4	70.1	171.3	173.4	0	112.9	A472 W473 F478 P480 C482 F499 D501	A472-K476 PolarHBondContact O-N 3.37Å; W473-K476 PolarHBondContact O-N 3.01Å; W473-K476 VanDerWaalsContact O-N 3.11Å; K476-F478 VanDerWaalsContact C-N 3.32Å; K476-P480 VanDerWaalsContact CE-O 3.28Å; K476-P480 WeakPolarHBondContact CE-O 3.26Å; K476-P480 PolarHBondContact NZ-O 3.31Å; K476-P480 WeakPolarHBondContact O-CA 3.5Å; K476-C482 PolarHBondContact NZ-O 3.4Å; K476-F499 HydrophobicContact CB-CE2 3.87Å; K476-F499 HydrophobicContact CD-CD2 4.37Å; K476-F499 HydrophobicContact CD-CE2 4.24Å; K476-F499 HydrophobicContact CG-CD2 4.08Å; K476-F499 HydrophobicContact CG-CE2 3.89Å; K476-D501 IonicContact NZ-OD2 2.68Å
477	D	95.1	Very high	95.1	Very high	107 Å²	107	39.1 Å²	39.1	57%	0.572	20%	0.202	S	C	*	.	H	α-helix	trans	-60.3	-40.4	169.3	-104.2	24	0	0	0	111.3	R64 W473	R64-D477 IonicContact CZ-OD2 3.5Å; R64-D477 IonicContact NH1-OD2 2.87Å; R64-D477 PolarHBondContact NH1-OD2 3.35Å; R64-D477 IonicContact NH2-OD2 2.62Å; R64-D477 PolarHBondContact NH2-OD2 3.07Å; R64-D477 VanDerWaalsContact NH2-OD2 3.16Å; W473-D477 WeakPolarHBondContact O-CB 3.42Å; W473-D477 PolarHBondContact O-N 3.07Å
478	F	95.1	Very high	95.2	Very high	56 Å²	56	36.1 Å²	36.1	25%	0.246	19%	0.188	C	C	.	.	H	α-helix	trans	-88.1	-46	-173.1	-177	-89.4	0	0	0	113.7	D436 L439 L440 M444 D445 A474 V475 K476	D436-F478 HydrophobicContact CB-CD2 4.42Å; D436-F478 HydrophobicContact CB-CE2 4.43Å; L439-F478 HydrophobicContact CB-CD1 3.91Å; L439-F478 HydrophobicContact CB-CD2 4.21Å; L439-F478 HydrophobicContact CB-CE1 3.86Å; L439-F478 HydrophobicContact CB-CE2 4.14Å; L439-F478 HydrophobicContact CB-CG 4.11Å; L439-F478 HydrophobicContact CB-CZ 3.97Å; L439-F478 HydrophobicContact CD1-CB 3.62Å; L439-F478 HydrophobicContact CD1-CD1 4.01Å; L439-F478 HydrophobicContact CD1-CD2 3.91Å; L439-F478 HydrophobicContact CD1-CG 3.56Å; L439-F478 HydrophobicContact CG-CG 4.49Å; L440-F478 HydrophobicContact CD2-CE2 4.22Å; L440-F478 HydrophobicContact CD2-CZ 3.82Å; L440-F478 HydrophobicContact CG-CE2 3.9Å; L440-F478 HydrophobicContact CG-CZ 3.77Å; M444-F478 HydrophobicContact CB-CD1 3.99Å; M444-F478 HydrophobicContact CB-CE1 3.87Å; D445-F478 HydrophobicContact CB-CE1 4.32Å; A474-F478 WeakPolarHBondContact O-CB 3.21Å; A474-F478 PolarHBondContact O-N 3.09Å; V475-F478 PolarHBondContact O-N 3.35Å; K476-F478 VanDerWaalsContact C-N 3.32Å
479	A	94.7	Very high	95.1	Very high	10 Å²	10	36.1 Å²	36.1	8%	0.083	19%	0.188	C	C	.	.			trans	-134.3	71.7	-174.8	0	0	0	0	0	110.7	M444 V475 N481 C482	M444-A479 WeakPolarHBondContact O-CB 3.25Å; V475-A479 PolarHBondContact O-N 3.2Å; A479-N481 PolarHBondContact O-N 3.17Å; A479-N481 VanDerWaalsContact O-N 3.11Å; A479-C482 HydrophobicContact CB-CB 4.11Å; A479-C482 WeakPolarHBondContact O-CB 3.28Å; A479-C482 PolarHBondContact O-N 3.44Å
480	P	93.6	Very high	94.9	Very high	75 Å²	75	37.2 Å²	37.2	49%	0.487	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-26.3	-173.6	23	-34.6	0	0	0	114.1	K476	K476-P480 VanDerWaalsContact CE-O 3.28Å; K476-P480 WeakPolarHBondContact CE-O 3.26Å; K476-P480 PolarHBondContact NZ-O 3.31Å; K476-P480 WeakPolarHBondContact O-CA 3.5Å
481	N	92.9	Very high	94.7	Very high	160 Å²	160	33 Å²	33	86%	0.856	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-14.9	179.5	-63.3	-5.5	0	0	0	113.9	A479	A479-N481 PolarHBondContact O-N 3.17Å; A479-N481 VanDerWaalsContact O-N 3.11Å
482	C	93.8	Very high	94.5	Very high	6 Å²	6	36 Å²	36	4%	0.041	18%	0.184	C	C	.	.	S	Bend	trans	-74.9	127.6	179.4	-171.4	0	0	0	0	109.3	A449 K476 A479	A449-C482 VanDerWaalsContact C-SG 3.55Å; K476-C482 PolarHBondContact NZ-O 3.4Å; A479-C482 HydrophobicContact CB-CB 4.11Å; A479-C482 WeakPolarHBondContact O-CB 3.28Å; A479-C482 PolarHBondContact O-N 3.44Å
483	P	95.1	Very high	94.4	Very high	36 Å²	36	36.1 Å²	36.1	23%	0.234	19%	0.185	C	C	.	.			trans	-71.4	135.3	176.4	29.5	-33.4	0	0	0	110	E448 A449 C450 Y485 D501	E448-P483 VanDerWaalsContact O-CD 3.28Å; E448-P483 WeakPolarHBondContact O-CD 3.4Å; E448-P483 WeakPolarHBondContact O-CG 3.4Å; A449-P483 HydrophobicContact CB-CG 4.21Å; C450-P483 PolarHBondContact N-O 3.22Å; C450-P483 VanDerWaalsContact N-O 3.15Å; P483-Y485 HydrophobicContact CB-CE2 4Å; P483-Y485 HydrophobicContact CG-CE2 4.16Å; P483-D501 WeakPolarHBondContact CA-OD2 3.35Å
484	L	96.1	Very high	94.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.2	-168	-162	68.2	0	0	0	111.7	C450 I452 A472 V475 V486 F499 A500 D501 Q502	C450-L484 HydrophobicContact CB-CD1 3.87Å; I452-L484 HydrophobicContact CD1-CD1 3.82Å; I452-L484 HydrophobicContact CD1-CD2 4.39Å; I452-L484 HydrophobicContact CD1-CG 4.39Å; I452-L484 HydrophobicContact CG1-CD1 4.32Å; A472-L484 HydrophobicContact CB-CD2 3.75Å; V475-L484 HydrophobicContact CB-CD1 4.09Å; V475-L484 HydrophobicContact CG1-CD1 3.71Å; L484-V486 HydrophobicContact CD2-CG2 3.89Å; L484-V486 HydrophobicContact CG-CG2 3.7Å; L484-F499 HydrophobicContact CD2-CE2 4.18Å; L484-A500 HydrophobicContact CB-CB 4.07Å; L484-A500 HydrophobicContact CD2-CB 4.07Å; L484-A500 HydrophobicContact CG-CB 4.32Å; L484-D501 PolarHBondContact N-OD2 3.24Å; L484-D501 PolarHBondContact O-N 3.27Å; L484-Q502 PolarHBondContact O-N 2.94Å
485	Y	96.4	Very high	94.1	Very high	13 Å²	13	35.5 Å²	35.5	5%	0.051	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	107.2	-177	-64.1	-96.9	0	0	0	108.5	A449 C450 F451 I452 P483 Q502 S982 F983	A449-Y485 HydrophobicContact CB-CD2 3.96Å; A449-Y485 HydrophobicContact CB-CE2 3.64Å; C450-Y485 PolarHBondContact O-N 2.86Å; F451-Y485 CarbonylContact C-O 3.49Å; F451-Y485 WeakPolarHBondContact CA-O 3.47Å; F451-Y485 VanDerWaalsContact CD1-CB 3.44Å; F451-Y485 HydrophobicContact CD1-CG 4.04Å; F451-Y485 HydrophobicContact CE1-CD1 4.16Å; F451-Y485 HydrophobicContact CE1-CD2 4.49Å; F451-Y485 AromaticContact CE1-CG 3.9Å; F451-Y485 HydrophobicContact CE1-CG 3.9Å; I452-Y485 PolarHBondContact N-O 3.26Å; P483-Y485 HydrophobicContact CB-CE2 4Å; P483-Y485 HydrophobicContact CG-CE2 4.16Å; Y485-Q502 HydrophobicContact CD1-CB 3.75Å; Y485-Q502 HydrophobicContact CD1-CG 3.92Å; Y485-Q502 HydrophobicContact CE1-CB 4.12Å; Y485-Q502 HydrophobicContact CE1-CG 3.75Å; Y485-S982 WeakPolarHBondContact CD1-OG 3.47Å; Y485-F983 HydrophobicContact CE1-CB 4.16Å; Y485-F983 HydrophobicContact CE2-CD2 4Å; Y485-F983 AromaticContact CZ-CD2 3.96Å
486	V	96.1	Very high	94	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.5	-169.8	-167.6	0	0	0	0	112.6	I452 A472 L484 I488 V497 A500 Q502 V503 V504	I452-V486 HydrophobicContact CB-CG1 4.25Å; I452-V486 HydrophobicContact CB-CG2 4.37Å; I452-V486 HydrophobicContact CD1-CG2 4.43Å; I452-V486 HydrophobicContact CG2-CG1 4.32Å; A472-V486 HydrophobicContact CB-CG2 4.42Å; L484-V486 HydrophobicContact CD2-CG2 3.89Å; L484-V486 HydrophobicContact CG-CG2 3.7Å; V486-I488 HydrophobicContact CG1-CD1 4.43Å; V486-I488 HydrophobicContact CG1-CG1 4Å; V486-V497 HydrophobicContact CB-CG1 4.06Å; V486-V497 HydrophobicContact CG1-CG1 4.12Å; V486-V497 HydrophobicContact CG2-CG1 3.82Å; V486-A500 HydrophobicContact CG2-CB 4.07Å; V486-Q502 PolarHBondContact N-O 3.24Å; V486-V503 WeakPolarHBondContact O-CA 3.2Å; V486-V504 PolarHBondContact O-N 3.31Å
487	Q	94.8	Very high	94	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.019	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	133.6	168.8	-170.6	170.2	18.1	0	0	110.4	I452 L453 E506 D976 L979	I452-Q487 PolarHBondContact O-N 3.49Å; L453-Q487 HydrophobicContact CD2-CB 4.42Å; Q487-E506 HydrophobicContact CG-CG 4.35Å; Q487-E506 PolarHBondContact NE2-OE1 3.44Å; Q487-D976 PolarHBondContact NE2-OD1 3.1Å; Q487-L979 HydrophobicContact CB-CD2 4.01Å
488	I	94.6	Very high	93.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	139.5	-179.2	-57.8	179.3	0	0	0	107.9	D465 V486 K490 N493 V497 V503 V504 C505 E506	D465-I488 HydrophobicContact CB-CG2 4.4Å; D465-I488 WeakPolarHBondContact OD2-CG2 3.48Å; V486-I488 HydrophobicContact CG1-CD1 4.43Å; V486-I488 HydrophobicContact CG1-CG1 4Å; I488-K490 WeakPolarHBondContact CG2-O 3.35Å; I488-N493 HydrophobicContact CG2-CB 3.56Å; I488-V497 HydrophobicContact CD1-CB 3.76Å; I488-V497 HydrophobicContact CD1-CG2 3.57Å; I488-V503 HydrophobicContact CD1-CG1 3.75Å; I488-V503 HydrophobicContact CG1-CG1 4.33Å; I488-V504 PolarHBondContact N-O 3.35Å; I488-C505 CarbonylContact O-C 3.53Å; I488-C505 VanDerWaalsContact O-CA 3.28Å; I488-C505 WeakPolarHBondContact O-CA 3.48Å; I488-E506 PolarHBondContact O-N 3.21Å
489	L	92.6	Very high	93.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.199	C	C	.	.	S	Bend	trans	-76.9	-59.1	-178.7	-51.1	177.9	0	0	0	110.1	R456 R461 A464 D465 E506 E507	R456-L489 HydrophobicContact CG-CD2 4.28Å; R461-L489 HydrophobicContact CB-CD1 3.86Å; R461-L489 HydrophobicContact CG-CD1 4.32Å; A464-L489 HydrophobicContact CB-CD1 4.05Å; D465-L489 WeakPolarHBondContact OD1-CG 3.16Å; D465-L489 PolarHBondContact OD1-N 2.85Å; D465-L489 PolarHBondContact OD2-N 2.97Å; D465-L489 VanDerWaalsContact OD2-N 3.17Å; L489-E506 HydrophobicContact CD2-CG 4.22Å; L489-E506 WeakPolarHBondContact CD2-OE2 3.44Å; L489-E507 WeakPolarHBondContact O-CG 3.42Å; L489-E507 PolarHBondContact O-N 3.27Å
490	K	91.8	Very high	93.4	Very high	28 Å²	28	40.4 Å²	40.4	12%	0.122	20%	0.2	C	C	.	.	S	Bend	trans	-97.8	146.8	-170.4	-82.4	-179.3	173.9	-171.8	0	114.1	M462 D465 I488 E492 N493 E507 E886	M462-K490 HydrophobicContact CG-CD 4.48Å; M462-K490 HydrophobicContact SD-CB 4.27Å; M462-K490 HydrophobicContact SD-CD 3.66Å; M462-K490 HydrophobicContact SD-CG 4.49Å; D465-K490 PolarHBondContact OD2-N 3.19Å; I488-K490 WeakPolarHBondContact CG2-O 3.35Å; K490-E492 PolarHBondContact O-N 2.83Å; K490-N493 PolarHBondContact O-N 3.16Å; K490-E507 VanDerWaalsContact CE-OE1 3.25Å; K490-E507 WeakPolarHBondContact CE-OE1 3.47Å; K490-E507 WeakPolarHBondContact CG-OE1 3.43Å; K490-E886 IonicContact NZ-OE1 3.09Å; K490-E886 PolarHBondContact NZ-OE1 3.29Å; K490-E886 IonicContact NZ-OE2 3.55Å; K490-E886 PolarHBondContact NZ-OE2 3.18Å
491	P	92	Very high	93.3	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-26.8	-170.4	28.5	-35.4	0	0	0	114.2	K494 C505 E507 E508 Y759 N812	P491-K494 WeakPolarHBondContact O-CB 3.26Å; P491-K494 PolarHBondContact O-N 3.45Å; P491-C505 VanDerWaalsContact CA-SG 3.56Å; P491-E507 WeakPolarHBondContact CD-OE2 3.22Å; P491-E508 HydrophobicContact CB-CG 4.32Å; P491-Y759 HydrophobicContact CB-CD1 4.1Å; P491-Y759 HydrophobicContact CB-CD2 3.94Å; P491-Y759 HydrophobicContact CB-CE1 3.84Å; P491-Y759 HydrophobicContact CB-CE2 3.65Å; P491-Y759 HydrophobicContact CB-CG 4.15Å; P491-Y759 HydrophobicContact CG-CD1 4.17Å; P491-Y759 HydrophobicContact CG-CE1 4.18Å; P491-Y759 HydrophobicContact CG-CG 4.42Å; P491-Y759 WeakPolarHBondContact O-CD2 3.34Å; P491-N812 HydrophobicContact CG-CB 4.13Å
492	E	90.9	Very high	93.4	Very high	66 Å²	66	34.8 Å²	34.8	31%	0.308	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-45.3	175	-67.6	147.4	-118.1	0	0	111.8	K490 K494 F495 N812	K490-E492 PolarHBondContact O-N 2.83Å; E492-K494 PolarHBondContact O-N 3.35Å; E492-K494 VanDerWaalsContact O-N 3.16Å; E492-F495 PolarHBondContact O-N 3.49Å; E492-N812 VanDerWaalsContact CD-ND2 3.32Å; E492-N812 PolarHBondContact OE1-ND2 3.01Å
493	N	93.6	Very high	93.3	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.021	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-20.8	-175.4	-63.5	-37.4	0	0	0	112.7	M462 D465 I469 I488 K490 F495 H496	M462-N493 PolarHBondContact SD-ND2 3.46Å; D465-N493 HydrophobicContact CB-CB 3.98Å; D465-N493 WeakPolarHBondContact CB-ND2 3.41Å; D465-N493 PolarHBondContact OD2-ND2 3.11Å; I469-N493 HydrophobicContact CD1-CB 4.1Å; I488-N493 HydrophobicContact CG2-CB 3.56Å; K490-N493 PolarHBondContact O-N 3.16Å; N493-F495 PolarHBondContact O-N 3.12Å; N493-H496 PolarHBondContact O-N 2.78Å
494	K	92.9	Very high	93.3	Very high	30 Å²	30	33.7 Å²	33.7	13%	0.13	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-34.9	174.7	-174.2	-173.8	171.8	-170.5	0	112.9	P491 E492 V497 K498 V503 C505 E508	P491-K494 WeakPolarHBondContact O-CB 3.26Å; P491-K494 PolarHBondContact O-N 3.45Å; E492-K494 PolarHBondContact O-N 3.35Å; E492-K494 VanDerWaalsContact O-N 3.16Å; K494-V497 PolarHBondContact O-N 3.35Å; K494-K498 PolarHBondContact O-N 3.03Å; K494-V503 HydrophobicContact CG-CG1 4.25Å; K494-C505 HydrophobicContact CD-CB 4.44Å; K494-E508 VanDerWaalsContact CD-OE1 3.3Å; K494-E508 WeakPolarHBondContact CD-OE1 3.4Å; K494-E508 WeakPolarHBondContact CE-OE2 3.35Å; K494-E508 IonicContact NZ-OE1 3.43Å; K494-E508 PolarHBondContact NZ-OE1 3.06Å; K494-E508 IonicContact NZ-OE2 3.48Å; K494-E508 PolarHBondContact NZ-OE2 3.04Å
495	F	93.1	Very high	93.2	Very high	96 Å²	96	33.7 Å²	33.7	42%	0.421	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-63.3	-43.8	-179.4	177.4	-109.2	0	0	0	112.2	E492 N493 V497 K498 I760	E492-F495 PolarHBondContact O-N 3.49Å; N493-F495 PolarHBondContact O-N 3.12Å; F495-V497 PolarHBondContact O-N 3.01Å; F495-K498 VanDerWaalsContact O-CB 3.28Å; F495-K498 WeakPolarHBondContact O-CB 3.46Å; F495-K498 PolarHBondContact O-N 2.79Å; F495-K498 VanDerWaalsContact O-N 3.15Å; F495-I760 HydrophobicContact CB-CB 4.42Å; F495-I760 HydrophobicContact CB-CG2 4.32Å; F495-I760 HydrophobicContact CD1-CG2 4.17Å; F495-I760 HydrophobicContact CD2-CG2 3.56Å; F495-I760 HydrophobicContact CE1-CG2 4.41Å; F495-I760 HydrophobicContact CE2-CG2 3.83Å; F495-I760 HydrophobicContact CG-CB 4.29Å; F495-I760 HydrophobicContact CG-CG2 3.74Å; F495-I760 HydrophobicContact CZ-CG2 4.25Å
496	H	94.1	Very high	93	Very high	88 Å²	88	33.2 Å²	33.2	41%	0.407	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-65.1	-21.4	-176.9	-62	-58.1	0	0	0	113.8	I469 N493 F499	I469-H496 HydrophobicContact CD1-CB 3.87Å; I469-H496 HydrophobicContact CG1-CB 4.09Å; I469-H496 HydrophobicContact CG2-CB 4.06Å; N493-H496 PolarHBondContact O-N 2.78Å; H496-F499 WeakPolarHBondContact O-CD1 3.3Å; H496-F499 VanDerWaalsContact O-CE1 3.27Å; H496-F499 WeakPolarHBondContact O-CE1 3.28Å
497	V	93.9	Very high	92.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-110.6	11.5	179.7	-157.8	0	0	0	0	112.4	I469 A472 V486 I488 K494 F495 F499 A500	I469-V497 HydrophobicContact CB-CG2 4.3Å; I469-V497 HydrophobicContact CG1-CG2 3.56Å; A472-V497 HydrophobicContact CB-CG1 3.83Å; V486-V497 HydrophobicContact CB-CG1 4.06Å; V486-V497 HydrophobicContact CG1-CG1 4.12Å; V486-V497 HydrophobicContact CG2-CG1 3.82Å; I488-V497 HydrophobicContact CD1-CB 3.76Å; I488-V497 HydrophobicContact CD1-CG2 3.57Å; K494-V497 PolarHBondContact O-N 3.35Å; F495-V497 PolarHBondContact O-N 3.01Å; V497-F499 HydrophobicContact CB-CE1 4.49Å; V497-F499 HydrophobicContact CG1-CE1 4.21Å; V497-F499 HydrophobicContact CG1-CZ 4.3Å; V497-F499 PolarHBondContact O-N 3.37Å; V497-A500 HydrophobicContact CG1-CB 3.81Å; V497-A500 VanDerWaalsContact O-CB 3.32Å; V497-A500 WeakPolarHBondContact O-CB 3.26Å; V497-A500 PolarHBondContact O-N 2.7Å
498	K	89.9	Confident	92.7	Very high	152 Å²	152	33.6 Å²	33.6	66%	0.661	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-6.5	178.6	-166.9	172.2	179.1	178.6	0	114.3	K494 F495	K494-K498 PolarHBondContact O-N 3.03Å; F495-K498 VanDerWaalsContact O-CB 3.28Å; F495-K498 WeakPolarHBondContact O-CB 3.46Å; F495-K498 PolarHBondContact O-N 2.79Å; F495-K498 VanDerWaalsContact O-N 3.15Å
499	F	92.8	Very high	92.6	Very high	79 Å²	79	33.6 Å²	33.6	35%	0.346	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-12.2	170.7	72.2	-91.9	0	0	0	113.8	A472 W473 K476 L484 H496 V497	A472-F499 HydrophobicContact CB-CZ 3.89Å; W473-F499 AromaticContact CD1-CE1 3.43Å; W473-F499 VanDerWaalsContact CD1-CE1 3.43Å; W473-F499 AromaticContact CD1-CZ 3.52Å; W473-F499 AromaticContact NE1-CE1 3.43Å; K476-F499 HydrophobicContact CB-CE2 3.87Å; K476-F499 HydrophobicContact CD-CD2 4.37Å; K476-F499 HydrophobicContact CD-CE2 4.24Å; K476-F499 HydrophobicContact CG-CD2 4.08Å; K476-F499 HydrophobicContact CG-CE2 3.89Å; L484-F499 HydrophobicContact CD2-CE2 4.18Å; H496-F499 WeakPolarHBondContact O-CD1 3.3Å; H496-F499 VanDerWaalsContact O-CE1 3.27Å; H496-F499 WeakPolarHBondContact O-CE1 3.28Å; V497-F499 HydrophobicContact CB-CE1 4.49Å; V497-F499 HydrophobicContact CG1-CE1 4.21Å; V497-F499 HydrophobicContact CG1-CZ 4.3Å; V497-F499 PolarHBondContact O-N 3.37Å
500	A	91.6	Very high	92.6	Very high	12 Å²	12	34.1 Å²	34.1	10%	0.099	16%	0.16	C	C	.	.	S	Bend	trans	-79	150.7	175.8	0	0	0	0	0	111	L484 V486 V497 Q502 V503	L484-A500 HydrophobicContact CB-CB 4.07Å; L484-A500 HydrophobicContact CD2-CB 4.07Å; L484-A500 HydrophobicContact CG-CB 4.32Å; V486-A500 HydrophobicContact CG2-CB 4.07Å; V497-A500 HydrophobicContact CG1-CB 3.81Å; V497-A500 VanDerWaalsContact O-CB 3.32Å; V497-A500 WeakPolarHBondContact O-CB 3.26Å; V497-A500 PolarHBondContact O-N 2.7Å; A500-Q502 PolarHBondContact O-N 3.48Å; A500-V503 HydrophobicContact CB-CG2 3.97Å
501	D	91.5	Very high	92.7	Very high	88 Å²	88	33.3 Å²	33.3	47%	0.471	16%	0.156	S	C	.	.	S	Bend	trans	-69.6	-33.8	-170.7	-50.8	-96.5	0	0	0	112.3	K476 P483 L484	K476-D501 IonicContact NZ-OD2 2.68Å; P483-D501 WeakPolarHBondContact CA-OD2 3.35Å; L484-D501 PolarHBondContact N-OD2 3.24Å; L484-D501 PolarHBondContact O-N 3.27Å
502	Q	93	Very high	92.8	Very high	29 Å²	29	33.3 Å²	33.3	14%	0.136	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	128.3	175.8	-64.9	-68	-0.9	0	0	111.3	L484 Y485 V486 A500 D986 I989	L484-Q502 PolarHBondContact O-N 2.94Å; Y485-Q502 HydrophobicContact CD1-CB 3.75Å; Y485-Q502 HydrophobicContact CD1-CG 3.92Å; Y485-Q502 HydrophobicContact CE1-CB 4.12Å; Y485-Q502 HydrophobicContact CE1-CG 3.75Å; V486-Q502 PolarHBondContact N-O 3.24Å; A500-Q502 PolarHBondContact O-N 3.48Å; Q502-D986 PolarHBondContact NE2-O 2.95Å; Q502-I989 HydrophobicContact CB-CD1 3.94Å; Q502-I989 HydrophobicContact CG-CD1 4.38Å
503	V	93.4	Very high	92.9	Very high	16 Å²	16	30.2 Å²	30.2	10%	0.097	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	118.2	-178.9	-175.7	0	0	0	0	112.1	V486 I488 K494 A500 R993	V486-V503 WeakPolarHBondContact O-CA 3.2Å; I488-V503 HydrophobicContact CD1-CG1 3.75Å; I488-V503 HydrophobicContact CG1-CG1 4.33Å; K494-V503 HydrophobicContact CG-CG1 4.25Å; A500-V503 HydrophobicContact CB-CG2 3.97Å; V503-R993 PolarHBondContact O-NH1 3.43Å; V503-R993 VanDerWaalsContact O-NH1 3.17Å; V503-R993 PolarHBondContact O-NH2 3.03Å
504	V	94.3	Very high	92.9	Very high	2 Å²	2	30 Å²	30	1%	0.012	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	121.2	171.5	178.5	0	0	0	0	108.8	V486 I488 F509 L978 L979 I989	V486-V504 PolarHBondContact O-N 3.31Å; I488-V504 PolarHBondContact N-O 3.35Å; V504-F509 HydrophobicContact CG1-CD2 4.03Å; V504-F509 HydrophobicContact CG1-CE2 4.16Å; V504-L978 HydrophobicContact CG1-CD2 4.45Å; V504-L978 HydrophobicContact CG2-CD2 3.49Å; V504-L978 VanDerWaalsContact CG2-CD2 3.49Å; V504-L979 HydrophobicContact CB-CD1 4.43Å; V504-L979 HydrophobicContact CG2-CB 3.98Å; V504-L979 HydrophobicContact CG2-CD1 3.8Å; V504-L979 HydrophobicContact CG2-CG 4.48Å; V504-I989 HydrophobicContact CG2-CD1 3.74Å
505	C	93.7	Very high	92.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	118.7	169.6	175.9	0	0	0	0	108.7	I488 P491 K494 E507 E508 F509	I488-C505 CarbonylContact O-C 3.53Å; I488-C505 VanDerWaalsContact O-CA 3.28Å; I488-C505 WeakPolarHBondContact O-CA 3.48Å; P491-C505 VanDerWaalsContact CA-SG 3.56Å; K494-C505 HydrophobicContact CD-CB 4.44Å; C505-E507 PolarHBondContact O-N 2.95Å; C505-E508 HydrophobicContact CB-CB 4.17Å; C505-E508 HydrophobicContact CB-CG 3.91Å; C505-E508 PolarHBondContact O-N 3.31Å; C505-F509 WeakPolarHBondContact O-CD2 3.37Å; C505-F509 PolarHBondContact O-N 2.73Å
506	E	92.3	Very high	92.8	Very high	3 Å²	3	24.1 Å²	24.1	1%	0.014	12%	0.115	C	C	.	.	H	α-helix	trans	-59.8	-47	-174.2	-59.1	-158	139.2	0	0	112	R456 R461 Q487 I488 L489 E508 F509 K510 I972	R456-E506 IonicContact CZ-OE1 3.38Å; R456-E506 IonicContact NE-OE1 2.67Å; R456-E506 PolarHBondContact NE-OE1 2.87Å; R456-E506 IonicContact NE-OE2 3.54Å; R456-E506 PolarHBondContact NE-OE2 3.17Å; R456-E506 IonicContact NH2-OE1 3.9Å; R456-E506 PolarHBondContact NH2-OE1 2.86Å; R461-E506 IonicContact NH2-OE2 2.71Å; Q487-E506 HydrophobicContact CG-CG 4.35Å; Q487-E506 PolarHBondContact NE2-OE1 3.44Å; I488-E506 PolarHBondContact O-N 3.21Å; L489-E506 HydrophobicContact CD2-CG 4.22Å; L489-E506 WeakPolarHBondContact CD2-OE2 3.44Å; E506-E508 PolarHBondContact O-N 3.15Å; E506-F509 PolarHBondContact O-N 3.35Å; E506-K510 WeakPolarHBondContact O-CB 3.36Å; E506-K510 PolarHBondContact O-N 2.7Å; E506-I972 HydrophobicContact CB-CG2 3.98Å; E506-I972 VanDerWaalsContact CD-CG2 3.45Å; E506-I972 HydrophobicContact CG-CG2 4.14Å; E506-I972 WeakPolarHBondContact OE2-CG2 3.34Å
507	E	91.8	Very high	92.8	Very high	10 Å²	10	20.2 Å²	20.2	5%	0.047	10%	0.097	C	C	.	.	H	α-helix	trans	-65.2	-37.6	-177.4	-76.4	-179.5	-157.1	0	0	113.1	L489 K490 P491 C505 F509 Y511	L489-E507 WeakPolarHBondContact O-CG 3.42Å; L489-E507 PolarHBondContact O-N 3.27Å; K490-E507 VanDerWaalsContact CE-OE1 3.25Å; K490-E507 WeakPolarHBondContact CE-OE1 3.47Å; K490-E507 WeakPolarHBondContact CG-OE1 3.43Å; P491-E507 WeakPolarHBondContact CD-OE2 3.22Å; C505-E507 PolarHBondContact O-N 2.95Å; E507-F509 PolarHBondContact O-N 3.09Å; E507-Y511 HydrophobicContact CB-CD2 4.02Å; E507-Y511 HydrophobicContact CB-CE2 4.09Å; E507-Y511 HydrophobicContact CG-CD2 4.42Å; E507-Y511 HydrophobicContact CG-CE2 4.01Å; E507-Y511 WeakPolarHBondContact O-CB 3.39Å; E507-Y511 WeakPolarHBondContact O-CD2 3.34Å; E507-Y511 PolarHBondContact O-N 2.7Å
508	E	92.1	Very high	92.6	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.009	10%	0.099	C	C	.	.	H	α-helix	trans	-56.5	-51.6	174.5	-71.7	-173.1	154.6	0	0	111.5	P491 K494 C505 E506 A512 Y759 R993 L998	P491-E508 HydrophobicContact CB-CG 4.32Å; K494-E508 VanDerWaalsContact CD-OE1 3.3Å; K494-E508 WeakPolarHBondContact CD-OE1 3.4Å; K494-E508 WeakPolarHBondContact CE-OE2 3.35Å; K494-E508 IonicContact NZ-OE1 3.43Å; K494-E508 PolarHBondContact NZ-OE1 3.06Å; K494-E508 IonicContact NZ-OE2 3.48Å; K494-E508 PolarHBondContact NZ-OE2 3.04Å; C505-E508 HydrophobicContact CB-CB 4.17Å; C505-E508 HydrophobicContact CB-CG 3.91Å; C505-E508 PolarHBondContact O-N 3.31Å; E506-E508 PolarHBondContact O-N 3.15Å; E508-A512 VanDerWaalsContact O-CB 3.3Å; E508-A512 WeakPolarHBondContact O-CB 3.37Å; E508-A512 PolarHBondContact O-N 3.31Å; E508-Y759 PolarHBondContact OE1-OH 2.54Å; E508-R993 IonicContact OE2-CZ 4Å; E508-R993 IonicContact OE2-NE 3.5Å; E508-R993 PolarHBondContact OE2-NE 3.34Å; E508-R993 IonicContact OE2-NH2 2.65Å; E508-R993 PolarHBondContact OE2-NH2 3.38Å; E508-L998 HydrophobicContact CB-CD1 4.24Å
509	F	93.4	Very high	92.6	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-70.8	-43.4	-178.3	-79.3	-80.5	0	0	0	112.2	V504 C505 E506 E507 M513 L975 L978 I989 A992 R993 L996	V504-F509 HydrophobicContact CG1-CD2 4.03Å; V504-F509 HydrophobicContact CG1-CE2 4.16Å; C505-F509 WeakPolarHBondContact O-CD2 3.37Å; C505-F509 PolarHBondContact O-N 2.73Å; E506-F509 PolarHBondContact O-N 3.35Å; E507-F509 PolarHBondContact O-N 3.09Å; F509-M513 WeakPolarHBondContact O-CB 3.22Å; F509-M513 WeakPolarHBondContact O-CG 3.49Å; F509-M513 PolarHBondContact O-N 3.07Å; F509-L975 HydrophobicContact CB-CD1 3.68Å; F509-L975 HydrophobicContact CB-CD2 4.09Å; F509-L978 HydrophobicContact CD1-CD1 4.16Å; F509-L978 HydrophobicContact CE1-CD1 3.77Å; F509-L978 HydrophobicContact CE2-CD2 4.48Å; F509-L978 HydrophobicContact CZ-CD1 4.09Å; F509-L978 HydrophobicContact CZ-CD2 4.21Å; F509-I989 HydrophobicContact CE2-CG2 4.31Å; F509-I989 HydrophobicContact CZ-CG2 3.91Å; F509-A992 HydrophobicContact CE1-CB 3.77Å; F509-A992 HydrophobicContact CZ-CB 4.47Å; F509-R993 HydrophobicContact CE1-CG 3.99Å; F509-R993 HydrophobicContact CE2-CG 4.3Å; F509-R993 HydrophobicContact CZ-CG 3.57Å; F509-L996 HydrophobicContact CD1-CD1 3.46Å; F509-L996 VanDerWaalsContact CD1-CD1 3.46Å; F509-L996 HydrophobicContact CE1-CD1 3.95Å
510	K	93.1	Very high	92.4	Very high	11 Å²	11	11.3 Å²	11.3	5%	0.048	6%	0.062	C	C	.	.	H	α-helix	trans	-53.6	-57.8	175.4	163	-176.2	160.4	164.8	0	111.4	E506 A512 M513 L514 E920 F970	E506-K510 WeakPolarHBondContact O-CB 3.36Å; E506-K510 PolarHBondContact O-N 2.7Å; K510-A512 PolarHBondContact O-N 2.74Å; K510-M513 PolarHBondContact O-N 3.29Å; K510-L514 HydrophobicContact CG-CD1 4.11Å; K510-L514 WeakPolarHBondContact O-CG 3.18Å; K510-L514 PolarHBondContact O-N 3.17Å; K510-E920 VanDerWaalsContact CD-OE1 3.31Å; K510-E920 WeakPolarHBondContact CD-OE1 3.45Å; K510-E920 VanDerWaalsContact CE-CD 3.41Å; K510-E920 WeakPolarHBondContact CE-OE1 3.1Å; K510-E920 WeakPolarHBondContact CE-OE2 3.49Å; K510-E920 IonicContact NZ-OE1 2.74Å; K510-E920 PolarHBondContact NZ-OE1 3.47Å; K510-E920 IonicContact NZ-OE2 3.76Å; K510-E920 PolarHBondContact NZ-OE2 3.16Å; K510-F970 HydrophobicContact CB-CE1 4.26Å; K510-F970 HydrophobicContact CG-CE1 4.44Å
511	Y	94.2	Very high	92.2	Very high	12 Å²	12	12.2 Å²	12.2	5%	0.047	7%	0.067	C	C	.	.	H	α-helix	trans	-71	-33.1	-173	-75	-65.4	0	0	0	112.2	E507 L514 A515 G813 L814 F817 V883	E507-Y511 HydrophobicContact CB-CD2 4.02Å; E507-Y511 HydrophobicContact CB-CE2 4.09Å; E507-Y511 HydrophobicContact CG-CD2 4.42Å; E507-Y511 HydrophobicContact CG-CE2 4.01Å; E507-Y511 WeakPolarHBondContact O-CB 3.39Å; E507-Y511 WeakPolarHBondContact O-CD2 3.34Å; E507-Y511 PolarHBondContact O-N 2.7Å; Y511-L514 HydrophobicContact CD1-CD1 4.42Å; Y511-A515 WeakPolarHBondContact O-CB 3.31Å; Y511-A515 PolarHBondContact O-N 3.4Å; Y511-G813 WeakPolarHBondContact CB-O 3.41Å; Y511-G813 VanDerWaalsContact CD2-CA 3.44Å; Y511-G813 WeakPolarHBondContact CD2-O 3.42Å; Y511-G813 VanDerWaalsContact CG-O 3.28Å; Y511-L814 HydrophobicContact CD1-CD2 3.98Å; Y511-L814 HydrophobicContact CE1-CD2 3.53Å; Y511-L814 HydrophobicContact CE1-CG 3.99Å; Y511-F817 HydrophobicContact CD1-CB 4.29Å; Y511-F817 WeakPolarHBondContact O-CD2 3.48Å; Y511-V883 HydrophobicContact CE1-CG1 4Å; Y511-V883 HydrophobicContact CE1-CG2 4.01Å
512	A	93.7	Very high	92.1	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-67.8	-37	173.2	0	0	0	0	0	113.3	E508 K510 L516 L996 L998	E508-A512 VanDerWaalsContact O-CB 3.3Å; E508-A512 WeakPolarHBondContact O-CB 3.37Å; E508-A512 PolarHBondContact O-N 3.31Å; K510-A512 PolarHBondContact O-N 2.74Å; A512-L516 WeakPolarHBondContact O-CB 3.31Å; A512-L516 PolarHBondContact O-N 2.54Å; A512-L996 HydrophobicContact CB-CB 4.09Å; A512-L996 HydrophobicContact CB-CD1 4.42Å; A512-L998 HydrophobicContact CB-CD1 3.89Å; A512-L998 HydrophobicContact CB-CD2 3.98Å; A512-L998 HydrophobicContact CB-CG 3.84Å
513	M	93.3	Very high	92.1	Very high	1 Å²	1	6.8 Å²	6.8	1%	0.005	4%	0.039	C	C	.	.	H	α-helix	trans	-67.4	-44.5	173.9	-75.1	-171.1	-168.8	0	0	112.4	F509 K510 A515 L516 N517 V527 F970 L975 L996	F509-M513 WeakPolarHBondContact O-CB 3.22Å; F509-M513 WeakPolarHBondContact O-CG 3.49Å; F509-M513 PolarHBondContact O-N 3.07Å; K510-M513 PolarHBondContact O-N 3.29Å; M513-A515 VanDerWaalsContact C-N 3.3Å; M513-A515 PolarHBondContact O-N 3.25Å; M513-L516 PolarHBondContact O-N 3.33Å; M513-N517 WeakPolarHBondContact O-CB 3.5Å; M513-N517 PolarHBondContact O-N 2.92Å; M513-V527 HydrophobicContact CE-CB 3.77Å; M513-V527 HydrophobicContact CE-CG1 3.5Å; M513-V527 VanDerWaalsContact CE-CG1 3.5Å; M513-V527 HydrophobicContact CE-CG2 4.49Å; M513-F970 HydrophobicContact SD-CD2 4.32Å; M513-F970 HydrophobicContact SD-CE2 3.55Å; M513-F970 VanDerWaalsContact SD-CE2 3.55Å; M513-F970 HydrophobicContact SD-CZ 3.8Å; M513-L975 HydrophobicContact CE-CD2 3.47Å; M513-L975 VanDerWaalsContact CE-CD2 3.47Å; M513-L975 HydrophobicContact SD-CD2 4Å; M513-L996 HydrophobicContact CE-CD1 4.14Å; M513-L996 HydrophobicContact CG-CD1 4.23Å; M513-L996 HydrophobicContact CG-CD2 3.76Å
514	L	93.6	Very high	92	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-61.5	-40.1	175.7	-67.8	173.9	0	0	0	111.3	K510 Y511 F817 V881 I918	K510-L514 HydrophobicContact CG-CD1 4.11Å; K510-L514 WeakPolarHBondContact O-CG 3.18Å; K510-L514 PolarHBondContact O-N 3.17Å; Y511-L514 HydrophobicContact CD1-CD1 4.42Å; L514-F817 HydrophobicContact CB-CD2 4.09Å; L514-F817 HydrophobicContact CB-CE2 3.98Å; L514-V881 HydrophobicContact CB-CG1 4.13Å; L514-V881 HydrophobicContact CD1-CG1 4.16Å; L514-V881 HydrophobicContact CD2-CG1 4.27Å; L514-V881 HydrophobicContact CG-CG1 4.43Å; L514-I918 HydrophobicContact CD2-CG2 3.62Å
515	A	92.8	Very high	92	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-64.1	-49.6	176.3	0	0	0	0	0	112.5	Y511 M513 N517 C518 F817 P820 L821	Y511-A515 WeakPolarHBondContact O-CB 3.31Å; Y511-A515 PolarHBondContact O-N 3.4Å; M513-A515 VanDerWaalsContact C-N 3.3Å; M513-A515 PolarHBondContact O-N 3.25Å; A515-N517 VanDerWaalsContact C-N 3.3Å; A515-N517 PolarHBondContact O-N 2.94Å; A515-C518 WeakPolarHBondContact O-CB 3.23Å; A515-C518 PolarHBondContact O-N 3.39Å; A515-F817 VanDerWaalsContact CA-CE2 3.45Å; A515-F817 HydrophobicContact CB-CB 4.47Å; A515-F817 HydrophobicContact CB-CD1 4.47Å; A515-F817 HydrophobicContact CB-CD2 3.68Å; A515-F817 HydrophobicContact CB-CE2 3.95Å; A515-F817 HydrophobicContact CB-CG 3.95Å; A515-F817 HydrophobicContact CB-CZ 4.44Å; A515-F817 WeakPolarHBondContact CB-O 3.39Å; A515-P820 HydrophobicContact CB-CG 3.85Å; A515-L821 HydrophobicContact CB-CD1 4.16Å; A515-L821 HydrophobicContact CB-CG 4.05Å; A515-L821 WeakPolarHBondContact O-CD2 3.36Å
516	L	91.1	Very high	91.9	Very high	2 Å²	2	6.1 Å²	6.1	1%	0.01	3%	0.034	C	C	.	.	H	α-helix	trans	-68.1	-28.6	179.8	-77.3	170.9	0	0	0	112.9	A512 M513 C518 V519 C520 T523 L996	A512-L516 WeakPolarHBondContact O-CB 3.31Å; A512-L516 PolarHBondContact O-N 2.54Å; M513-L516 PolarHBondContact O-N 3.33Å; L516-C518 PolarHBondContact O-N 3.19Å; L516-V519 PolarHBondContact O-N 3.15Å; L516-C520 CarbonylContact O-C 3.49Å; L516-C520 PolarHBondContact O-N 3.37Å; L516-C520 VanDerWaalsContact O-O 3.05Å; L516-T523 HydrophobicContact CB-CG2 3.97Å; L516-T523 HydrophobicContact CD1-CG2 4.39Å; L516-L996 HydrophobicContact CD1-CB 4.28Å; L516-L996 HydrophobicContact CD1-CD2 3.78Å; L516-L996 WeakPolarHBondContact CD1-O 3.35Å
517	N	92.8	Very high	91.9	Very high	6 Å²	6	6.3 Å²	6.3	3%	0.032	4%	0.036	C	C	.	.	H	α-helix	trans	-58.1	-25.4	170.1	-81.2	1.7	0	0	0	113.4	M513 A515 V519 C520 T523 S524 I918 G967	M513-N517 WeakPolarHBondContact O-CB 3.5Å; M513-N517 PolarHBondContact O-N 2.92Å; A515-N517 VanDerWaalsContact C-N 3.3Å; A515-N517 PolarHBondContact O-N 2.94Å; N517-V519 VanDerWaalsContact C-N 3.28Å; N517-V519 PolarHBondContact O-N 2.96Å; N517-C520 WeakPolarHBondContact CA-O 3.41Å; N517-T523 WeakPolarHBondContact OD1-CA 3.38Å; N517-T523 WeakPolarHBondContact OD1-CB 3.46Å; N517-T523 PolarHBondContact OD1-N 3.33Å; N517-S524 WeakPolarHBondContact ND2-CB 3.35Å; N517-S524 PolarHBondContact ND2-OG 2.7Å; N517-S524 PolarHBondContact OD1-N 3.38Å; N517-I918 HydrophobicContact CB-CD1 3.65Å; N517-I918 HydrophobicContact CB-CG1 4.3Å; N517-I918 HydrophobicContact CB-CG2 4.4Å; N517-G967 PolarHBondContact ND2-O 3.48Å
518	C	90.6	Very high	91.9	Very high	6 Å²	6	5.9 Å²	5.9	4%	0.041	3%	0.034	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-2.1	174.9	-58.2	0	0	0	0	114.7	A515 L516 I803 N879 V881	A515-C518 WeakPolarHBondContact O-CB 3.23Å; A515-C518 PolarHBondContact O-N 3.39Å; L516-C518 PolarHBondContact O-N 3.19Å; C518-I803 HydrophobicContact CB-CD1 3.75Å; C518-I803 HydrophobicContact CB-CG1 4.24Å; C518-I803 HydrophobicContact CB-CG2 4.49Å; C518-N879 HydrophobicContact CB-CB 4.37Å; C518-V881 WeakPolarHBondContact SG-CG2 3.48Å
519	V	88.6	Confident	91.9	Very high	38 Å²	38	5.9 Å²	5.9	23%	0.23	3%	0.034	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.6	-46.2	179.1	-177.5	0	0	0	0	110.9	L516 N517 L821	L516-V519 PolarHBondContact O-N 3.15Å; N517-V519 VanDerWaalsContact C-N 3.28Å; N517-V519 PolarHBondContact O-N 2.96Å; V519-L821 HydrophobicContact CG2-CD2 3.46Å; V519-L821 VanDerWaalsContact CG2-CD2 3.46Å
520	C	89.1	Confident	91.7	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	4%	0.036	C	C	.	.	S	Bend	trans	-118.1	103.1	177.2	-58.2	0	0	0	0	107.4	L516 N517 T523 A1009 Y1211	L516-C520 CarbonylContact O-C 3.49Å; L516-C520 PolarHBondContact O-N 3.37Å; L516-C520 VanDerWaalsContact O-O 3.05Å; N517-C520 WeakPolarHBondContact CA-O 3.41Å; C520-T523 VanDerWaalsContact CB-OG1 3.25Å; C520-T523 WeakPolarHBondContact CB-OG1 3.42Å; C520-T523 PolarHBondContact O-N 3.28Å; C520-T523 PolarHBondContact O-OG1 3.05Å; C520-A1009 HydrophobicContact CB-CB 4.22Å; C520-A1009 PolarHBondContact SG-N 3.22Å; C520-Y1211 HydrophobicContact CB-CD1 4.46Å
521	P	87.4	Confident	91.5	Very high	31 Å²	31	5.8 Å²	5.8	20%	0.201	3%	0.034	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	146.2	-173.4	26.4	-35.6	0	0	0	110.8	T523 Y1041 I1209 Y1211	P521-T523 PolarHBondContact O-N 2.81Å; P521-T523 VanDerWaalsContact O-N 3.13Å; P521-Y1041 HydrophobicContact CB-CD1 4.27Å; P521-Y1041 HydrophobicContact CB-CE1 4.15Å; P521-Y1041 HydrophobicContact CG-CD1 3.83Å; P521-Y1041 HydrophobicContact CG-CE1 4.14Å; P521-Y1041 HydrophobicContact CG-CG 4.16Å; P521-I1209 HydrophobicContact CG-CB 4.43Å; P521-I1209 HydrophobicContact CG-CD1 3.86Å; P521-I1209 HydrophobicContact CG-CG2 4.07Å; P521-Y1211 VanDerWaalsContact O-CE1 3.25Å; P521-Y1211 WeakPolarHBondContact O-CE1 3.21Å; P521-Y1211 PolarHBondContact O-OH 3.39Å
522	A	90.2	Very high	91.2	Very high	2 Å²	2	5.5 Å²	5.5	2%	0.017	3%	0.033	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	24.7	177.6	0	0	0	0	0	116.6	S524 T525 L526 Y1041 Y1211	A522-S524 PolarHBondContact O-N 3.22Å; A522-T525 WeakPolarHBondContact O-CB 3.37Å; A522-T525 PolarHBondContact O-N 2.77Å; A522-L526 PolarHBondContact O-N 3.1Å; A522-Y1041 HydrophobicContact CB-CD2 3.69Å; A522-Y1041 HydrophobicContact CB-CE2 3.68Å; A522-Y1211 PolarHBondContact O-OH 3.09Å
523	T	91.9	Very high	90.7	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-56.8	-36.7	170.3	-62.1	0	0	0	0	112.2	L516 N517 C520 P521 T525 L526 V527 L1007	L516-T523 HydrophobicContact CB-CG2 3.97Å; L516-T523 HydrophobicContact CD1-CG2 4.39Å; N517-T523 WeakPolarHBondContact OD1-CA 3.38Å; N517-T523 WeakPolarHBondContact OD1-CB 3.46Å; N517-T523 PolarHBondContact OD1-N 3.33Å; C520-T523 VanDerWaalsContact CB-OG1 3.25Å; C520-T523 WeakPolarHBondContact CB-OG1 3.42Å; C520-T523 PolarHBondContact O-N 3.28Å; C520-T523 PolarHBondContact O-OG1 3.05Å; P521-T523 PolarHBondContact O-N 2.81Å; P521-T523 VanDerWaalsContact O-N 3.13Å; T523-T525 VanDerWaalsContact C-N 3.29Å; T523-T525 PolarHBondContact O-N 2.74Å; T523-L526 WeakPolarHBondContact O-CB 3.43Å; T523-L526 PolarHBondContact O-N 2.88Å; T523-V527 HydrophobicContact CG2-CG2 4.39Å; T523-V527 WeakPolarHBondContact O-CG2 3.47Å; T523-V527 PolarHBondContact O-N 2.73Å; T523-L1007 HydrophobicContact CG2-CD2 3.6Å
524	S	92.4	Very high	89.7	Confident	1 Å²	1	6.2 Å²	6.2	1%	0.007	4%	0.038	C	C	.	.	H	α-helix	trans	-56.7	-42.8	172.6	60.3	0	0	0	0	112.3	N517 A522 T528	N517-S524 WeakPolarHBondContact ND2-CB 3.35Å; N517-S524 PolarHBondContact ND2-OG 2.7Å; N517-S524 PolarHBondContact OD1-N 3.38Å; A522-S524 PolarHBondContact O-N 3.22Å; S524-T528 VanDerWaalsContact O-CB 3.3Å; S524-T528 WeakPolarHBondContact O-CB 3.48Å; S524-T528 PolarHBondContact O-N 2.63Å; S524-T528 PolarHBondContact O-OG1 3.47Å
525	T	93.1	Very high	88	Confident	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-70.1	-44.3	178	-46.4	0	0	0	0	110.6	A522 T523 V527 T528 L529 F964 G967 V1194	A522-T525 WeakPolarHBondContact O-CB 3.37Å; A522-T525 PolarHBondContact O-N 2.77Å; T523-T525 VanDerWaalsContact C-N 3.29Å; T523-T525 PolarHBondContact O-N 2.74Å; T525-V527 PolarHBondContact O-N 3.46Å; T525-T528 PolarHBondContact O-N 3.35Å; T525-L529 HydrophobicContact CG2-CD1 4.24Å; T525-L529 VanDerWaalsContact O-CG 3.31Å; T525-L529 WeakPolarHBondContact O-CG 3.33Å; T525-L529 PolarHBondContact O-N 3.41Å; T525-F964 HydrophobicContact CG2-CD1 4.25Å; T525-F964 HydrophobicContact CG2-CD2 4.48Å; T525-F964 HydrophobicContact CG2-CE1 3.85Å; T525-F964 HydrophobicContact CG2-CE2 4.1Å; T525-F964 HydrophobicContact CG2-CZ 3.77Å; T525-F964 WeakPolarHBondContact CG2-O 3.49Å; T525-F964 PolarHBondContact OG1-O 3.27Å; T525-G967 WeakPolarHBondContact OG1-CA 3.23Å; T525-V1194 HydrophobicContact CG2-CG1 3.63Å
526	L	92.7	Very high	85.8	Confident	3 Å²	3	12.1 Å²	12.1	2%	0.016	7%	0.069	C	C	.	.	H	α-helix	trans	-53.7	-49.8	174.6	171.6	62.3	0	0	0	112	A522 T523 L530 I1038 I1196 Y1211	A522-L526 PolarHBondContact O-N 3.1Å; T523-L526 WeakPolarHBondContact O-CB 3.43Å; T523-L526 PolarHBondContact O-N 2.88Å; L526-L530 HydrophobicContact CD1-CD1 4.1Å; L526-L530 HydrophobicContact CG-CD1 4.38Å; L526-L530 WeakPolarHBondContact O-CG 3.4Å; L526-L530 PolarHBondContact O-N 3.4Å; L526-I1038 HydrophobicContact CD1-CG2 4.14Å; L526-I1196 HydrophobicContact CD1-CB 4.49Å; L526-I1196 HydrophobicContact CD1-CD1 3.79Å; L526-I1196 HydrophobicContact CD1-CG1 3.69Å; L526-I1196 HydrophobicContact CD1-CG2 4.23Å; L526-Y1211 HydrophobicContact CB-CE1 4.43Å; L526-Y1211 HydrophobicContact CD2-CD1 3.58Å; L526-Y1211 HydrophobicContact CD2-CD2 4.42Å; L526-Y1211 HydrophobicContact CD2-CE1 3.79Å; L526-Y1211 HydrophobicContact CD2-CG 3.89Å
527	V	92.4	Very high	83.3	Confident	8 Å²	8	18.2 Å²	18.2	5%	0.048	9%	0.092	C	C	.	.	H	α-helix	trans	-72.6	-40	-179.4	-177.2	0	0	0	0	111.5	M513 T523 T525 L529 L530 V531 L996	M513-V527 HydrophobicContact CE-CB 3.77Å; M513-V527 HydrophobicContact CE-CG1 3.5Å; M513-V527 VanDerWaalsContact CE-CG1 3.5Å; M513-V527 HydrophobicContact CE-CG2 4.49Å; T523-V527 HydrophobicContact CG2-CG2 4.39Å; T523-V527 WeakPolarHBondContact O-CG2 3.47Å; T523-V527 PolarHBondContact O-N 2.73Å; T525-V527 PolarHBondContact O-N 3.46Å; V527-L529 VanDerWaalsContact C-N 3.31Å; V527-L529 PolarHBondContact O-N 3.18Å; V527-L530 PolarHBondContact O-N 3.25Å; V527-L530 VanDerWaalsContact O-N 3.11Å; V527-V531 HydrophobicContact CG1-CG1 4.34Å; V527-V531 PolarHBondContact O-N 3Å; V527-V531 VanDerWaalsContact O-N 3.16Å; V527-L996 HydrophobicContact CG2-CD2 4.4Å
528	T	91.8	Very high	80.5	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.006	13%	0.131	C	C	.	.	H	α-helix	trans	-55.5	-45.8	176.9	-61.1	0	0	0	0	111.7	S524 T525 L530 V531 H532 F964 M974	S524-T528 VanDerWaalsContact O-CB 3.3Å; S524-T528 WeakPolarHBondContact O-CB 3.48Å; S524-T528 PolarHBondContact O-N 2.63Å; S524-T528 PolarHBondContact O-OG1 3.47Å; T525-T528 PolarHBondContact O-N 3.35Å; T528-L530 VanDerWaalsContact C-N 3.33Å; T528-L530 PolarHBondContact O-N 3.41Å; T528-V531 WeakPolarHBondContact O-CG2 3.42Å; T528-V531 PolarHBondContact O-N 3.42Å; T528-H532 PolarHBondContact O-CD2 3.28Å; T528-H532 VanDerWaalsContact O-CD2 3.31Å; T528-H532 PolarHBondContact O-N 3.25Å; T528-F964 HydrophobicContact CG2-CE2 3.95Å; T528-F964 HydrophobicContact CG2-CZ 3.73Å; T528-M974 HydrophobicContact CG2-CB 3.77Å; T528-M974 HydrophobicContact CG2-CG 3.84Å; T528-M974 HydrophobicContact CG2-SD 4.16Å
529	L	91.5	Very high	77.5	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-69.9	-26.8	179.8	-64.8	179.7	0	0	0	113.2	T525 V527 Y562 L956 M959 F964 V1194 I1196	T525-L529 HydrophobicContact CG2-CD1 4.24Å; T525-L529 VanDerWaalsContact O-CG 3.31Å; T525-L529 WeakPolarHBondContact O-CG 3.33Å; T525-L529 PolarHBondContact O-N 3.41Å; V527-L529 VanDerWaalsContact C-N 3.31Å; V527-L529 PolarHBondContact O-N 3.18Å; L529-Y562 HydrophobicContact CD1-CE2 3.83Å; L529-L956 HydrophobicContact CD2-CD1 3.6Å; L529-M959 HydrophobicContact CD2-CG 4.02Å; L529-M959 HydrophobicContact CD2-SD 3.61Å; L529-F964 HydrophobicContact CD2-CE1 4.26Å; L529-F964 HydrophobicContact CD2-CZ 4.36Å; L529-V1194 HydrophobicContact CD1-CG1 4.31Å; L529-I1196 HydrophobicContact CB-CD1 3.53Å; L529-I1196 HydrophobicContact CD1-CD1 4Å; L529-I1196 HydrophobicContact CG-CD1 4.39Å
530	L	90.4	Very high	74.7	Confident	7 Å²	7	40.7 Å²	40.7	4%	0.037	19%	0.191	C	C	.	.	H	α-helix	trans	-77.6	-27.3	177.2	-74.9	168.7	0	0	0	113.7	L526 V527 T528 V570 I634 I1196	L526-L530 HydrophobicContact CD1-CD1 4.1Å; L526-L530 HydrophobicContact CG-CD1 4.38Å; L526-L530 WeakPolarHBondContact O-CG 3.4Å; L526-L530 PolarHBondContact O-N 3.4Å; V527-L530 PolarHBondContact O-N 3.25Å; V527-L530 VanDerWaalsContact O-N 3.11Å; T528-L530 VanDerWaalsContact C-N 3.33Å; T528-L530 PolarHBondContact O-N 3.41Å; L530-V570 HydrophobicContact CD2-CG2 4.12Å; L530-I634 HydrophobicContact CD2-CD1 4.3Å; L530-I634 HydrophobicContact CD2-CG2 4.23Å; L530-I1196 HydrophobicContact CD2-CG2 3.97Å; L530-I1196 HydrophobicContact CG-CD1 4.28Å
531	V	89.1	Confident	71.8	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.018	23%	0.232	C	C	.	.	H	α-helix	trans	-90.2	-34	-179.8	-59.9	0	0	0	0	113.1	V527 T528 T533 L978 Q981 M988	V527-V531 HydrophobicContact CG1-CG1 4.34Å; V527-V531 PolarHBondContact O-N 3Å; V527-V531 VanDerWaalsContact O-N 3.16Å; T528-V531 WeakPolarHBondContact O-CG2 3.42Å; T528-V531 PolarHBondContact O-N 3.42Å; V531-T533 PolarHBondContact O-N 3.32Å; V531-L978 HydrophobicContact CB-CB 4.38Å; V531-L978 HydrophobicContact CG1-CB 4.25Å; V531-L978 HydrophobicContact CG1-CD1 4.21Å; V531-L978 HydrophobicContact CG1-CG 4.36Å; V531-Q981 VanDerWaalsContact O-CD 3.27Å; V531-Q981 PolarHBondContact O-NE2 3.32Å; V531-M988 HydrophobicContact CG1-CG 4.42Å; V531-M988 HydrophobicContact CG1-SD 4.21Å
532	H	87.5	Confident	69	Low	6 Å²	6	58.8 Å²	58.8	3%	0.028	26%	0.263	C	S	.	.	S	Bend	trans	-74.5	122.2	173.9	-83.5	-105.3	0	0	0	111.1	T528 S534 L956 T977	T528-H532 PolarHBondContact O-CD2 3.28Å; T528-H532 VanDerWaalsContact O-CD2 3.31Å; T528-H532 PolarHBondContact O-N 3.25Å; H532-S534 PolarHBondContact O-N 2.71Å; H532-L956 HydrophobicContact CB-CD1 3.64Å; H532-L956 HydrophobicContact CB-CD2 4.11Å; H532-L956 HydrophobicContact CB-CG 3.88Å; H532-L956 WeakPolarHBondContact ND1-CD2 3.49Å; H532-T977 PolarHBondContact CD2-OG1 3.37Å; H532-T977 VanDerWaalsContact CE1-CG2 3.4Å; H532-T977 WeakPolarHBondContact CE1-CG2 3.28Å; H532-T977 PolarHBondContact NE2-OG1 2.94Å; H532-T977 VanDerWaalsContact NE2-OG1 3.16Å
533	T	83.2	Confident	66	Low	2 Å²	2	67 Å²	67	1%	0.012	30%	0.301	C	S	.	.			trans	-78.7	117.5	174.4	60.5	0	0	0	0	110.5	E389 A392 V531 E569 N955	E389-T533 VanDerWaalsContact CD-OG1 3.24Å; E389-T533 WeakPolarHBondContact OE1-CG2 3.16Å; E389-T533 PolarHBondContact OE1-OG1 3.02Å; E389-T533 WeakPolarHBondContact OE2-CB 3.13Å; E389-T533 WeakPolarHBondContact OE2-CG2 3.44Å; E389-T533 PolarHBondContact OE2-N 3.39Å; E389-T533 PolarHBondContact OE2-OG1 3.31Å; A392-T533 WeakPolarHBondContact CB-OG1 3.4Å; V531-T533 PolarHBondContact O-N 3.32Å; T533-E569 WeakPolarHBondContact CB-OE1 3.28Å; T533-E569 HydrophobicContact CG2-CG 4.44Å; T533-E569 WeakPolarHBondContact CG2-OE1 3.22Å; T533-N955 PolarHBondContact O-ND2 3.31Å
534	S	70.8	Confident	62.9	Low	14 Å²	14	75.7 Å²	75.7	10%	0.098	34%	0.341	C	S	.	.			trans	-94.9	114.1	175.7	96.1	0	0	0	0	110.3	H532 G536 G567	H532-S534 PolarHBondContact O-N 2.71Å; S534-G536 PolarHBondContact O-N 2.74Å; S534-G536 VanDerWaalsContact O-N 3.16Å; S534-G567 VanDerWaalsContact OG-CA 3.23Å; S534-G567 WeakPolarHBondContact OG-CA 3.46Å
535	R	58.5	Low	60.2	Low	96 Å²	96	84.9 Å²	84.9	36%	0.362	38%	0.384	S	S	.	.			trans	-84.3	91.5	-179.8	-109.2	-166.6	177	158.8	9.2	111.5	Y391 A392 H393 Q397 R537	Y391-R535 PolarHBondContact O-NH1 2.97Å; Y391-R535 PolarHBondContact O-NH2 2.68Å; A392-R535 VanDerWaalsContact C-CZ 3.47Å; A392-R535 VanDerWaalsContact CA-CZ 3.45Å; A392-R535 HydrophobicContact CB-CG 4.3Å; A392-R535 PolarHBondContact O-NE 2.94Å; A392-R535 PolarHBondContact O-NH2 3.39Å; H393-R535 PolarHBondContact O-NH2 3.03Å; Q397-R535 VanDerWaalsContact NE2-NH2 3.12Å; R535-R537 VanDerWaalsContact C-N 3.34Å; R535-R537 PolarHBondContact O-N 2.69Å
536	G	47.2	Very low	57.2	Low	28 Å²	28	88.6 Å²	88.6	29%	0.289	41%	0.414	S	S	.	.			trans	-59.5	93.9	161.1	0	0	0	0	0	110.5	S534 Q538 L548	S534-G536 PolarHBondContact O-N 2.74Å; S534-G536 VanDerWaalsContact O-N 3.16Å; G536-Q538 PolarHBondContact O-N 3.14Å; G536-L548 VanDerWaalsContact CA-O 3.26Å; G536-L548 WeakPolarHBondContact CA-O 3.39Å
537	R	38.2	Very low	54.7	Low	129 Å²	129	93.9 Å²	93.9	49%	0.487	44%	0.442	S	S	.	.			trans	-67.7	95.5	-162.7	-125.4	-178.5	-178.8	132.2	0.6	111.3	R535 H539 K952	R535-R537 VanDerWaalsContact C-N 3.34Å; R535-R537 PolarHBondContact O-N 2.69Å; R537-H539 PolarHBondContact O-N 3.17Å; R537-K952 PolarHBondContact NH1-O 2.92Å
538	Q	33.2	Very low	52.4	Low	183 Å²	183	98.3 Å²	98.3	86%	0.855	46%	0.464	S	S	*	.			trans	-73.7	53.2	177.8	-160.6	-173.9	33.8	0	0	112.2	G536 K540	G536-Q538 PolarHBondContact O-N 3.14Å; Q538-K540 PolarHBondContact O-N 2.85Å; Q538-K540 VanDerWaalsContact O-N 3.11Å
539	H	28.4	Very low	50.9	Low	150 Å²	150	99.6 Å²	99.6	69%	0.694	47%	0.471	S	S	*	.			trans	-69.9	110.4	175.3	-158.5	-50.7	0	0	0	108.7	R537 R541	R537-H539 PolarHBondContact O-N 3.17Å; H539-R541 PolarHBondContact O-N 3.46Å
540	K	29.2	Very low	49.8	Very low	190 Å²	190	100 Å²	100	83%	0.826	47%	0.473	S	S	*	.			trans	-54.9	111.4	168.8	-80.9	-176.5	173.7	-178.5	0	109.1	Q538	Q538-K540 PolarHBondContact O-N 2.85Å; Q538-K540 VanDerWaalsContact O-N 3.11Å
541	R	28.6	Very low	48.7	Very low	228 Å²	228	99.7 Å²	99.7	86%	0.86	47%	0.472	S	S	*	.			trans	-117.3	139.8	137.3	-79.9	-174.7	169.5	178	-3.1	105.7	H539	H539-R541 PolarHBondContact O-N 3.46Å
542	E	29.1	Very low	48	Very low	183 Å²	183	103.2 Å²	103.2	86%	0.855	49%	0.488	S	S	*	.	S	Bend	trans	-77	146.1	178.8	-69.7	171.8	112.2	0	0	109.9
543	Q	26.4	Very low	47.3	Very low	174 Å²	174	108.1 Å²	108.1	81%	0.813	51%	0.511	S	S	*	.	S	Bend	trans	72.2	146	-179.1	-53	175.9	-0.1	0	0	114.9
544	Q	27.4	Very low	47.1	Very low	182 Å²	182	108.3 Å²	108.3	85%	0.85	51%	0.512	S	S	*	.	S	Bend	trans	54.4	101.1	-164	-113.4	61.2	6.2	0	0	115.9
545	H	35.5	Very low	47.5	Very low	194 Å²	194	112.8 Å²	112.8	90%	0.898	54%	0.541	S	S	*	.			trans	-79.9	125.1	178.7	-67.1	11.4	0	0	0	112.4
546	A	30.8	Very low	48.7	Very low	78 Å²	78	110.1 Å²	110.1	65%	0.645	53%	0.533	S	S	*	.			trans	-144.7	126.8	157.2	0	0	0	0	0	108.7	L548	A546-L548 PolarHBondContact O-N 3.16Å
547	I	39.9	Very low	50.5	Low	115 Å²	115	116.2 Å²	116.2	59%	0.59	55%	0.554	S	S	*	*			trans	-74.3	114.3	168.6	-54.2	177.9	0	0	0	105.9	L549	I547-L549 HydrophobicContact CG2-CD1 4.47Å; I547-L549 HydrophobicContact CG2-CD2 4.5Å; I547-L549 HydrophobicContact CG2-CG 4.05Å; I547-L549 PolarHBondContact O-N 3.41Å
548	L	44.7	Very low	52.8	Low	100 Å²	100	110.4 Å²	110.4	52%	0.524	53%	0.532	S	S	.	.			trans	-76.7	66.7	-174.5	-71.8	175.9	0	0	0	111.7	G536 A546	G536-L548 VanDerWaalsContact CA-O 3.26Å; G536-L548 WeakPolarHBondContact CA-O 3.39Å; A546-L548 PolarHBondContact O-N 3.16Å
549	L	58.4	Low	55.4	Low	29 Å²	29	101.9 Å²	101.9	15%	0.152	49%	0.492	C	S	.	.			trans	-72.2	156.8	169	-65.9	164.3	0	0	0	110.6	I547 Q552 C564 I636	I547-L549 HydrophobicContact CG2-CD1 4.47Å; I547-L549 HydrophobicContact CG2-CD2 4.5Å; I547-L549 HydrophobicContact CG2-CG 4.05Å; I547-L549 PolarHBondContact O-N 3.41Å; L549-Q552 HydrophobicContact CB-CG 3.84Å; L549-Q552 WeakPolarHBondContact O-CG 3.07Å; L549-C564 HydrophobicContact CD1-CB 4.16Å; L549-I636 HydrophobicContact CD2-CG2 4.15Å
550	E	69	Low	58.2	Low	10 Å²	10	99.2 Å²	99.2	5%	0.047	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	149.8	-178.8	-58.6	-169.6	168.6	0	0	110.7	Q552 G563 S954 M959 F960	E550-Q552 PolarHBondContact O-N 3Å; E550-G563 CarbonylContact O-C 3.58Å; E550-G563 WeakPolarHBondContact O-CA 3.43Å; E550-S954 VanDerWaalsContact OE1-CB 3.25Å; E550-S954 WeakPolarHBondContact OE1-CB 3.41Å; E550-M959 HydrophobicContact CB-CE 4.17Å; E550-M959 WeakPolarHBondContact OE2-CE 3.47Å; E550-F960 HydrophobicContact CB-CE2 4.37Å; E550-F960 HydrophobicContact CB-CZ 4.16Å
551	G	68.4	Low	60.9	Low	0 Å²	0	93.1 Å²	93.1	0%	0	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	-10	177.3	0	0	0	0	0	117	Q553 S554	G551-Q553 PolarHBondContact O-N 3.24Å; G551-S554 WeakPolarHBondContact O-CB 3.41Å; G551-S554 PolarHBondContact O-N 2.91Å; G551-S554 PolarHBondContact O-OG 3Å
552	Q	73.3	Confident	63.8	Low	76 Å²	76	82.3 Å²	82.3	36%	0.355	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-17.6	-175	-67.3	-58.1	-35.4	0	0	115.6	L549 E550 R560	L549-Q552 HydrophobicContact CB-CG 3.84Å; L549-Q552 WeakPolarHBondContact O-CG 3.07Å; E550-Q552 PolarHBondContact O-N 3Å; Q552-R560 PolarHBondContact NE2-O 3.29Å
553	Q	72.8	Confident	66.5	Low	110 Å²	110	73.6 Å²	73.6	51%	0.514	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	2	176.8	-66.3	-178.4	-13.2	0	0	114	G551 K948	G551-Q553 PolarHBondContact O-N 3.24Å; Q553-K948 VanDerWaalsContact OE1-CE 3.27Å
554	S	78.6	Confident	69.2	Low	6 Å²	6	66.8 Å²	66.8	4%	0.042	34%	0.341	C	S	.	.	S	Bend	trans	-72.8	159.9	173.6	71.7	0	0	0	0	112	G551 E556 R560	G551-S554 WeakPolarHBondContact O-CB 3.41Å; G551-S554 PolarHBondContact O-N 2.91Å; G551-S554 PolarHBondContact O-OG 3Å; S554-E556 PolarHBondContact OG-O 2.93Å; S554-R560 VanDerWaalsContact O-CZ 3.27Å; S554-R560 PolarHBondContact O-NE 2.9Å; S554-R560 PolarHBondContact O-NH2 3.47Å; S554-R560 WeakPolarHBondContact OG-CG 3.32Å
555	P	79.2	Confident	72.1	Confident	108 Å²	108	58.5 Å²	58.5	70%	0.701	30%	0.302	S	S	*	.	S	Bend	trans	-75.7	-27.8	168.9	29.1	-31.8	0	0	0	112.9	R560	P555-R560 VanDerWaalsContact C-NH2 3.32Å; P555-R560 PolarHBondContact O-NH2 3.12Å
556	E	83.9	Confident	74.5	Confident	40 Å²	40	49.3 Å²	49.3	19%	0.187	26%	0.26	C	S	.	.			trans	-88.1	134.4	-165.9	-72	161.4	-112.6	0	0	114.1	S554 W558 Q559 R560 Y938	S554-E556 PolarHBondContact OG-O 2.93Å; E556-W558 PolarHBondContact O-N 2.88Å; E556-W558 PolarHBondContact OE2-NE1 2.93Å; E556-Q559 HydrophobicContact CB-CB 4.38Å; E556-Q559 HydrophobicContact CB-CG 4.06Å; E556-Q559 PolarHBondContact O-N 3.19Å; E556-Q559 PolarHBondContact OE1-NE2 3Å; E556-Q559 PolarHBondContact OE2-NE2 2.75Å; E556-R560 PolarHBondContact O-N 3.4Å; E556-Y938 WeakPolarHBondContact OE1-CE2 3.31Å; E556-Y938 VanDerWaalsContact OE2-CE2 3.25Å; E556-Y938 WeakPolarHBondContact OE2-CE2 3.48Å; E556-Y938 PolarHBondContact OE2-OH 3.42Å
557	Q	85.4	Confident	77.1	Confident	156 Å²	156	45.7 Å²	45.7	73%	0.729	23%	0.23	S	C	*	.	H	α-helix	trans	-63.5	-42.7	-177.7	-178.8	170.1	-26	0	0	112.9	Q559 R560 M561	Q557-Q559 PolarHBondContact O-N 3.19Å; Q557-R560 PolarHBondContact O-N 3.34Å; Q557-M561 HydrophobicContact CG-CG 4.47Å; Q557-M561 WeakPolarHBondContact O-CG 3.42Å; Q557-M561 PolarHBondContact O-N 3.2Å
558	W	86.9	Confident	79.4	Confident	7 Å²	7	40.3 Å²	40.3	3%	0.027	20%	0.203	C	C	.	.	H	α-helix	trans	-61	-43.6	-180	82.5	-96.6	0	0	0	111.7	E556 R560 M561 Y562 Y938 L942 L962 L1191 Y1193	E556-W558 PolarHBondContact O-N 2.88Å; E556-W558 PolarHBondContact OE2-NE1 2.93Å; W558-R560 VanDerWaalsContact C-N 3.34Å; W558-R560 PolarHBondContact O-N 3.41Å; W558-M561 PolarHBondContact O-N 3.41Å; W558-Y562 HydrophobicContact CE3-CD1 4.23Å; W558-Y562 HydrophobicContact CE3-CG 4.4Å; W558-Y562 HydrophobicContact CH2-CD1 4.47Å; W558-Y562 AromaticContact CZ3-CD1 3.57Å; W558-Y562 HydrophobicContact CZ3-CD1 3.57Å; W558-Y562 HydrophobicContact CZ3-CE1 4.11Å; W558-Y562 HydrophobicContact CZ3-CG 4.15Å; W558-Y562 WeakPolarHBondContact O-CB 3.5Å; W558-Y562 PolarHBondContact O-N 2.88Å; W558-Y938 VanDerWaalsContact CZ2-OH 3.25Å; W558-Y938 WeakPolarHBondContact CZ2-OH 3.35Å; W558-Y938 PolarHBondContact NE1-OH 3.07Å; W558-L942 HydrophobicContact CZ2-CD2 4.47Å; W558-L962 HydrophobicContact CH2-CD2 3.9Å; W558-L962 HydrophobicContact CZ2-CD2 3.93Å; W558-L1191 VanDerWaalsContact CD1-CD2 3.49Å; W558-L1191 HydrophobicContact CD2-CD2 3.84Å; W558-L1191 HydrophobicContact CG-CD2 3.76Å; W558-L1191 HydrophobicContact CZ2-CD1 4.05Å; W558-L1191 HydrophobicContact CZ2-CD2 4.42Å; W558-Y1193 HydrophobicContact CB-CD1 4.3Å; W558-Y1193 HydrophobicContact CB-CE1 3.52Å; W558-Y1193 HydrophobicContact CB-CE2 4.33Å; W558-Y1193 WeakPolarHBondContact CB-OH 3.25Å; W558-Y1193 HydrophobicContact CD2-CD1 4.08Å; W558-Y1193 HydrophobicContact CD2-CE1 4.18Å; W558-Y1193 AromaticContact CE3-CD1 3.64Å; W558-Y1193 HydrophobicContact CE3-CD1 3.64Å; W558-Y1193 HydrophobicContact CE3-CD2 4.31Å; W558-Y1193 HydrophobicContact CE3-CE1 4.08Å; W558-Y1193 AromaticContact CE3-CG 3.77Å; W558-Y1193 HydrophobicContact CE3-CG 3.77Å; W558-Y1193 HydrophobicContact CG-CD1 4.39Å; W558-Y1193 AromaticContact CG-CE1 4Å; W558-Y1193 HydrophobicContact CG-CE1 4Å; W558-Y1193 HydrophobicContact CZ3-CD1 4.31Å; W558-Y1193 HydrophobicContact CZ3-CG 4.23Å
559	Q	86.8	Confident	81.5	Confident	4 Å²	4	36.2 Å²	36.2	2%	0.019	18%	0.181	C	C	.	.	H	α-helix	trans	-61.9	-39.7	179.6	-64.7	178.4	11.8	0	0	112.1	E556 Q557 G563 Y938 F960	E556-Q559 HydrophobicContact CB-CB 4.38Å; E556-Q559 HydrophobicContact CB-CG 4.06Å; E556-Q559 PolarHBondContact O-N 3.19Å; E556-Q559 PolarHBondContact OE1-NE2 3Å; E556-Q559 PolarHBondContact OE2-NE2 2.75Å; Q557-Q559 PolarHBondContact O-N 3.19Å; Q559-G563 PolarHBondContact O-N 3.27Å; Q559-Y938 PolarHBondContact NE2-OH 2.9Å; Q559-F960 HydrophobicContact CB-CD1 4.45Å; Q559-F960 HydrophobicContact CB-CE1 4.42Å
560	R	87.3	Confident	83.1	Confident	94 Å²	94	35 Å²	35	36%	0.355	18%	0.175	S	C	.	.	H	α-helix	trans	-70.7	-36.5	176.9	-59.9	-169.2	-159.5	125.3	7.2	112.8	Q552 S554 P555 E556 Q557 W558 C564	Q552-R560 PolarHBondContact NE2-O 3.29Å; S554-R560 VanDerWaalsContact O-CZ 3.27Å; S554-R560 PolarHBondContact O-NE 2.9Å; S554-R560 PolarHBondContact O-NH2 3.47Å; S554-R560 WeakPolarHBondContact OG-CG 3.32Å; P555-R560 VanDerWaalsContact C-NH2 3.32Å; P555-R560 PolarHBondContact O-NH2 3.12Å; E556-R560 PolarHBondContact O-N 3.4Å; Q557-R560 PolarHBondContact O-N 3.34Å; W558-R560 VanDerWaalsContact C-N 3.34Å; W558-R560 PolarHBondContact O-N 3.41Å; R560-C564 VanDerWaalsContact O-CB 3.24Å; R560-C564 WeakPolarHBondContact O-CB 3.47Å; R560-C564 PolarHBondContact O-N 2.81Å
561	M	86.8	Confident	84.2	Confident	61 Å²	61	35.4 Å²	35.4	30%	0.3	18%	0.176	S	C	.	.	H	α-helix	trans	-70.5	-43.8	175.4	-71.1	-58.6	-58.8	0	0	110.9	Q557 W558 C564 C565 L1195 T1202	Q557-M561 HydrophobicContact CG-CG 4.47Å; Q557-M561 WeakPolarHBondContact O-CG 3.42Å; Q557-M561 PolarHBondContact O-N 3.2Å; W558-M561 PolarHBondContact O-N 3.41Å; M561-C564 WeakPolarHBondContact O-CB 3.46Å; M561-C564 PolarHBondContact O-N 2.99Å; M561-C565 WeakPolarHBondContact O-CB 3.46Å; M561-C565 PolarHBondContact O-N 2.9Å; M561-C565 PolarHBondContact O-SG 2.61Å; M561-C565 VanDerWaalsContact O-SG 3.42Å; M561-L1195 HydrophobicContact CB-CD2 4.11Å; M561-T1202 HydrophobicContact CE-CG2 4.17Å
562	Y	89.6	Confident	85.4	Confident	1 Å²	1	38.7 Å²	38.7	0%	0.004	19%	0.191	C	C	.	.	H	α-helix	trans	-62.6	-51.3	178.1	179.8	-131.5	0	0	0	112	L529 W558 C564 C565 S566 M959 F960 A965 V1194	L529-Y562 HydrophobicContact CD1-CE2 3.83Å; W558-Y562 HydrophobicContact CE3-CD1 4.23Å; W558-Y562 HydrophobicContact CE3-CG 4.4Å; W558-Y562 HydrophobicContact CH2-CD1 4.47Å; W558-Y562 AromaticContact CZ3-CD1 3.57Å; W558-Y562 HydrophobicContact CZ3-CD1 3.57Å; W558-Y562 HydrophobicContact CZ3-CE1 4.11Å; W558-Y562 HydrophobicContact CZ3-CG 4.15Å; W558-Y562 WeakPolarHBondContact O-CB 3.5Å; W558-Y562 PolarHBondContact O-N 2.88Å; Y562-C564 PolarHBondContact O-N 3.48Å; Y562-C565 PolarHBondContact O-N 3.48Å; Y562-S566 WeakPolarHBondContact O-CB 3.46Å; Y562-S566 PolarHBondContact O-N 2.87Å; Y562-S566 PolarHBondContact O-OG 3.4Å; Y562-M959 HydrophobicContact CD1-CG 4.39Å; Y562-M959 HydrophobicContact CE1-CG 3.54Å; Y562-M959 VanDerWaalsContact CE1-O 3.28Å; Y562-M959 WeakPolarHBondContact CE1-O 3.17Å; Y562-M959 HydrophobicContact CE1-SD 4.45Å; Y562-M959 WeakPolarHBondContact OH-CG 3.34Å; Y562-M959 PolarHBondContact OH-O 3.45Å; Y562-M959 VanDerWaalsContact OH-O 3.06Å; Y562-F960 HydrophobicContact CD1-CD1 4.23Å; Y562-F960 HydrophobicContact CD1-CE1 4.35Å; Y562-A965 HydrophobicContact CE1-CB 4.09Å; Y562-V1194 WeakPolarHBondContact CD2-O 3.35Å; Y562-V1194 HydrophobicContact CE2-CG1 4.31Å; Y562-V1194 WeakPolarHBondContact CE2-O 3.24Å
563	G	85	Confident	86.2	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-68.9	-8.7	175.2	0	0	0	0	0	115.4	E550 Q559 S566	E550-G563 CarbonylContact O-C 3.58Å; E550-G563 WeakPolarHBondContact O-CA 3.43Å; Q559-G563 PolarHBondContact O-N 3.27Å; G563-S566 WeakPolarHBondContact CA-OG 3.43Å; G563-S566 PolarHBondContact O-OG 3.18Å
564	C	83.4	Confident	87.1	Confident	32 Å²	32	36 Å²	36	22%	0.216	18%	0.175	C	C	.	.	H	α-helix	trans	-87.9	-49.1	167.4	-178.8	0	0	0	0	110.6	L549 R560 M561 Y562 S566 G567	L549-C564 HydrophobicContact CD1-CB 4.16Å; R560-C564 VanDerWaalsContact O-CB 3.24Å; R560-C564 WeakPolarHBondContact O-CB 3.47Å; R560-C564 PolarHBondContact O-N 2.81Å; M561-C564 WeakPolarHBondContact O-CB 3.46Å; M561-C564 PolarHBondContact O-N 2.99Å; Y562-C564 PolarHBondContact O-N 3.48Å; C564-S566 VanDerWaalsContact C-N 3.32Å; C564-S566 PolarHBondContact O-N 3.36Å; C564-G567 PolarHBondContact O-N 3.38Å
565	C	87.4	Confident	87.6	Confident	7 Å²	7	35.9 Å²	35.9	5%	0.047	17%	0.173	C	C	.	.	H	α-helix	trans	-68.2	-27.2	-179.9	-74.7	0	0	0	0	113.6	M561 Y562 G567 N568 L1195 I1196	M561-C565 WeakPolarHBondContact O-CB 3.46Å; M561-C565 PolarHBondContact O-N 2.9Å; M561-C565 PolarHBondContact O-SG 2.61Å; M561-C565 VanDerWaalsContact O-SG 3.42Å; Y562-C565 PolarHBondContact O-N 3.48Å; C565-G567 PolarHBondContact O-N 3.4Å; C565-N568 WeakPolarHBondContact O-CB 3.44Å; C565-N568 PolarHBondContact O-N 3.36Å; C565-N568 PolarHBondContact O-ND2 2.83Å; C565-L1195 HydrophobicContact CB-CB 4.46Å; C565-L1195 HydrophobicContact CB-CD2 4.08Å; C565-I1196 WeakPolarHBondContact CB-O 3.27Å; C565-I1196 PolarHBondContact SG-O 2.91Å; C565-I1196 VanDerWaalsContact SG-O 3.4Å
566	S	86.9	Confident	88	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.007	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-21.6	175.4	62.5	0	0	0	0	113.8	Y562 G563 C564 N568 M959	Y562-S566 WeakPolarHBondContact O-CB 3.46Å; Y562-S566 PolarHBondContact O-N 2.87Å; Y562-S566 PolarHBondContact O-OG 3.4Å; G563-S566 WeakPolarHBondContact CA-OG 3.43Å; G563-S566 PolarHBondContact O-OG 3.18Å; C564-S566 VanDerWaalsContact C-N 3.32Å; C564-S566 PolarHBondContact O-N 3.36Å; S566-N568 PolarHBondContact O-N 3.31Å; S566-M959 WeakPolarHBondContact CB-SD 3.46Å; S566-M959 WeakPolarHBondContact OG-CE 3.34Å; S566-M959 PolarHBondContact OG-SD 3.3Å; S566-M959 VanDerWaalsContact OG-SD 3.4Å
567	G	84.4	Confident	88.1	Confident	2 Å²	2	36.1 Å²	36.1	2%	0.021	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	1.2	175.8	0	0	0	0	0	114.4	S534 C564 C565 E569 I636	S534-G567 VanDerWaalsContact OG-CA 3.23Å; S534-G567 WeakPolarHBondContact OG-CA 3.46Å; C564-G567 PolarHBondContact O-N 3.38Å; C565-G567 PolarHBondContact O-N 3.4Å; G567-E569 PolarHBondContact O-N 3.44Å; G567-I636 WeakPolarHBondContact O-CA 3.31Å
568	N	89.1	Confident	88.2	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.011	14%	0.143	C	C	.	.			trans	-70.1	119.6	173.5	-83.5	-71.6	0	0	0	111	C565 S566 I634 N635 I636 I1196 N1197	C565-N568 WeakPolarHBondContact O-CB 3.44Å; C565-N568 PolarHBondContact O-N 3.36Å; C565-N568 PolarHBondContact O-ND2 2.83Å; S566-N568 PolarHBondContact O-N 3.31Å; N568-I634 HydrophobicContact CB-CG2 3.6Å; N568-N635 WeakPolarHBondContact OD1-CA 3.48Å; N568-I636 PolarHBondContact OD1-N 2.86Å; N568-I1196 HydrophobicContact CB-CB 4.47Å; N568-I1196 HydrophobicContact CB-CG2 4.02Å; N568-I1196 PolarHBondContact ND2-O 3.22Å; N568-N1197 PolarHBondContact OD1-ND2 3.05Å
569	E	89.7	Confident	88.1	Confident	15 Å²	15	35.7 Å²	35.7	7%	0.07	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	157.6	172.5	-70.6	-179.9	-150.9	0	0	111.2	T533 G567 Y571 I634 N635 K985	T533-E569 WeakPolarHBondContact CB-OE1 3.28Å; T533-E569 HydrophobicContact CG2-CG 4.44Å; T533-E569 WeakPolarHBondContact CG2-OE1 3.22Å; G567-E569 PolarHBondContact O-N 3.44Å; E569-Y571 HydrophobicContact CB-CD2 4.46Å; E569-Y571 HydrophobicContact CB-CE1 4.17Å; E569-Y571 HydrophobicContact CB-CE2 3.83Å; E569-Y571 PolarHBondContact OE1-OH 3.19Å; E569-Y571 WeakPolarHBondContact OE2-CE1 3.24Å; E569-Y571 VanDerWaalsContact OE2-CZ 3.26Å; E569-Y571 PolarHBondContact OE2-OH 3.24Å; E569-I634 WeakPolarHBondContact O-CA 3.22Å; E569-N635 PolarHBondContact N-O 3.39Å; E569-N635 PolarHBondContact O-N 3.42Å; E569-N635 VanDerWaalsContact O-N 3.13Å; E569-K985 IonicContact OE2-NZ 3.77Å; E569-K985 PolarHBondContact OE2-NZ 3.07Å
570	V	92.3	Very high	88	Confident	3 Å²	3	35.5 Å²	35.5	2%	0.018	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	132.8	163.7	-172.2	0	0	0	0	110.3	L530 I605 Y633 K985 Y987 M988 I991	L530-V570 HydrophobicContact CD2-CG2 4.12Å; V570-I605 HydrophobicContact CB-CD1 4.31Å; V570-I605 HydrophobicContact CG1-CD1 3.61Å; V570-I605 HydrophobicContact CG2-CD1 3.81Å; V570-Y633 WeakPolarHBondContact CA-O 3.21Å; V570-K985 PolarHBondContact O-NZ 3.18Å; V570-Y987 HydrophobicContact CG1-CE2 4.26Å; V570-M988 HydrophobicContact CB-CE 3.75Å; V570-M988 HydrophobicContact CG1-CE 4.45Å; V570-M988 HydrophobicContact CG2-CE 4.36Å; V570-I991 HydrophobicContact CG1-CD1 4.23Å
571	Y	91.8	Very high	88	Confident	18 Å²	18	31 Å²	31	7%	0.071	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	169.9	174.2	-63.7	-61.2	0	0	0	111.6	E569 Y632 Y633 N635 T637 K638	E569-Y571 HydrophobicContact CB-CD2 4.46Å; E569-Y571 HydrophobicContact CB-CE1 4.17Å; E569-Y571 HydrophobicContact CB-CE2 3.83Å; E569-Y571 PolarHBondContact OE1-OH 3.19Å; E569-Y571 WeakPolarHBondContact OE2-CE1 3.24Å; E569-Y571 VanDerWaalsContact OE2-CZ 3.26Å; E569-Y571 PolarHBondContact OE2-OH 3.24Å; Y571-Y632 WeakPolarHBondContact O-CA 3.36Å; Y571-Y633 AromaticContact CD2-CE2 3.86Å; Y571-Y633 HydrophobicContact CD2-CE2 3.86Å; Y571-Y633 HydrophobicContact CG-CE2 4.24Å; Y571-Y633 PolarHBondContact N-O 2.87Å; Y571-Y633 PolarHBondContact O-N 3.35Å; Y571-N635 WeakPolarHBondContact CE2-O 3.47Å; Y571-T637 VanDerWaalsContact CE2-C 3.42Å; Y571-K638 HydrophobicContact CD1-CB 3.98Å; Y571-K638 HydrophobicContact CD1-CD 4.45Å; Y571-K638 HydrophobicContact CD1-CG 4.04Å; Y571-K638 HydrophobicContact CD2-CB 4.33Å; Y571-K638 HydrophobicContact CE1-CB 3.83Å; Y571-K638 HydrophobicContact CE1-CG 4.37Å; Y571-K638 HydrophobicContact CE2-CB 4.15Å; Y571-K638 VanDerWaalsContact CE2-N 3.25Å; Y571-K638 HydrophobicContact CG-CB 4.24Å; Y571-K638 HydrophobicContact CG-CG 4.23Å
572	H	92.1	Very high	87.9	Confident	70 Å²	70	29.8 Å²	29.8	32%	0.324	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	153	171.3	74.7	-76.6	0	0	0	111	T630 C631 Y632 Y987	H572-T630 HydrophobicContact CB-CG2 3.93Å; H572-C631 WeakPolarHBondContact CA-O 3.4Å; H572-Y632 HydrophobicContact CB-CD1 3.6Å; H572-Y632 HydrophobicContact CB-CE1 3.57Å; H572-Y987 HydrophobicContact CB-CE1 4.36Å; H572-Y987 AromaticContact CE1-CE1 3.64Å; H572-Y987 AromaticContact CG-CE1 3.87Å; H572-Y987 AromaticContact ND1-CE1 3.09Å; H572-Y987 WeakPolarHBondContact ND1-CE1 3.26Å; H572-Y987 AromaticContact ND1-CZ 3.31Å; H572-Y987 VanDerWaalsContact ND1-CZ 3.31Å; H572-Y987 PolarHBondContact ND1-OH 2.88Å; H572-Y987 VanDerWaalsContact ND1-OH 3.14Å
573	I	91.6	Very high	87.8	Confident	22 Å²	22	35.6 Å²	35.6	11%	0.113	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	154.7	166.1	-163.6	166.1	0	0	0	109.8	D577 F581 T630 C631 Y633 E639	I573-D577 HydrophobicContact CD1-CB 4.44Å; I573-D577 HydrophobicContact CG1-CB 4.27Å; I573-F581 HydrophobicContact CG2-CD2 4.22Å; I573-F581 HydrophobicContact CG2-CE2 4.25Å; I573-T630 CarbonylContact O-C 3.54Å; I573-T630 WeakPolarHBondContact O-CA 3.27Å; I573-C631 PolarHBondContact N-O 3.18Å; I573-C631 VanDerWaalsContact N-O 3.13Å; I573-C631 PolarHBondContact O-N 2.7Å; I573-Y633 HydrophobicContact CB-CE1 4.21Å; I573-Y633 HydrophobicContact CG2-CD1 4.33Å; I573-Y633 HydrophobicContact CG2-CE1 3.77Å; I573-E639 VanDerWaalsContact CD1-OE2 3.3Å; I573-E639 WeakPolarHBondContact CD1-OE2 3.18Å
574	R	91.4	Very high	88	Confident	108 Å²	108	36.1 Å²	36.1	41%	0.408	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	143.3	168.9	-61.1	-174.7	-57.9	169.3	9.3	110.3	C576 D577 S578 D629	R574-C576 VanDerWaalsContact C-N 3.35Å; R574-C576 PolarHBondContact O-N 3.16Å; R574-D577 IonicContact CZ-OD1 2.91Å; R574-D577 IonicContact CZ-OD2 2.66Å; R574-D577 IonicContact NE-OD2 2.73Å; R574-D577 PolarHBondContact NE-OD2 3.38Å; R574-D577 VanDerWaalsContact NH2-CG 3.33Å; R574-D577 IonicContact NH2-OD1 2.68Å; R574-D577 PolarHBondContact NH2-OD1 2.79Å; R574-D577 VanDerWaalsContact NH2-OD1 3.07Å; R574-D577 IonicContact NH2-OD2 3.81Å; R574-D577 PolarHBondContact NH2-OD2 3Å; R574-D577 PolarHBondContact O-N 3.11Å; R574-D577 VanDerWaalsContact O-N 3.12Å; R574-S578 PolarHBondContact O-N 3.43Å; R574-D629 CarbonylContact C-O 3.57Å; R574-D629 WeakPolarHBondContact CA-O 3.22Å
575	L	88.9	Confident	88.3	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.01	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-56.9	-46.3	-174.9	-168.1	152.6	0	0	0	112.4	D577 S578 F581 N585 M625 D629	L575-D577 VanDerWaalsContact C-N 3.27Å; L575-D577 PolarHBondContact O-N 3.06Å; L575-S578 PolarHBondContact O-N 3.17Å; L575-S578 PolarHBondContact O-OG 2.83Å; L575-F581 HydrophobicContact CG-CB 4.17Å; L575-N585 HydrophobicContact CD2-CB 3.79Å; L575-M625 HydrophobicContact CD1-CB 3.63Å; L575-M625 HydrophobicContact CD1-CE 3.99Å; L575-M625 HydrophobicContact CD1-CG 4.41Å; L575-D629 PolarHBondContact N-O 2.94Å
576	C	86.8	Confident	88.4	Confident	67 Å²	67	40.8 Å²	40.8	45%	0.453	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-61.3	-29.5	178.8	61.7	0	0	0	0	114.9	R574 A627	R574-C576 VanDerWaalsContact C-N 3.35Å; R574-C576 PolarHBondContact O-N 3.16Å; C576-A627 HydrophobicContact CB-CB 4.45Å; C576-A627 VanDerWaalsContact CB-O 3.23Å; C576-A627 WeakPolarHBondContact CB-O 3.49Å; C576-A627 PolarHBondContact N-O 3.22Å; C576-A627 PolarHBondContact SG-O 3.2Å; C576-A627 VanDerWaalsContact SG-O 3.39Å
577	D	86.8	Confident	88.7	Confident	87 Å²	87	45.6 Å²	45.6	47%	0.465	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-85.9	-16.8	-178.8	-57.6	-21.9	0	0	0	111.6	I573 R574 L575	I573-D577 HydrophobicContact CD1-CB 4.44Å; I573-D577 HydrophobicContact CG1-CB 4.27Å; R574-D577 IonicContact CZ-OD1 2.91Å; R574-D577 IonicContact CZ-OD2 2.66Å; R574-D577 IonicContact NE-OD2 2.73Å; R574-D577 PolarHBondContact NE-OD2 3.38Å; R574-D577 VanDerWaalsContact NH2-CG 3.33Å; R574-D577 IonicContact NH2-OD1 2.68Å; R574-D577 PolarHBondContact NH2-OD1 2.79Å; R574-D577 VanDerWaalsContact NH2-OD1 3.07Å; R574-D577 IonicContact NH2-OD2 3.81Å; R574-D577 PolarHBondContact NH2-OD2 3Å; R574-D577 PolarHBondContact O-N 3.11Å; R574-D577 VanDerWaalsContact O-N 3.12Å; L575-D577 VanDerWaalsContact C-N 3.27Å; L575-D577 PolarHBondContact O-N 3.06Å
578	S	86.9	Confident	89.1	Confident	8 Å²	8	47 Å²	47	6%	0.056	25%	0.249	C	C	.	.			trans	-86.1	135.6	-174.3	76.3	0	0	0	0	113.2	R574 L575 F581 G582	R574-S578 PolarHBondContact O-N 3.43Å; L575-S578 PolarHBondContact O-N 3.17Å; L575-S578 PolarHBondContact O-OG 2.83Å; S578-F581 WeakPolarHBondContact OG-CA 3.28Å; S578-F581 VanDerWaalsContact OG-CB 3.31Å; S578-F581 WeakPolarHBondContact OG-CB 3.36Å; S578-F581 PolarHBondContact OG-N 2.99Å; S578-G582 PolarHBondContact O-N 3.39Å; S578-G582 VanDerWaalsContact O-N 3.16Å; S578-G582 PolarHBondContact OG-N 2.92Å
579	K	85	Confident	89.2	Confident	145 Å²	145	46.9 Å²	46.9	63%	0.63	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-26.6	166.1	-58.1	178.5	-176.3	179.1	0	110.8	E639 F646	K579-E639 WeakPolarHBondContact CA-OE1 3.25Å; K579-E639 WeakPolarHBondContact CB-OE1 3.07Å; K579-E639 PolarHBondContact N-OE1 3.2Å; K579-F646 HydrophobicContact CB-CE1 3.65Å; K579-F646 HydrophobicContact CB-CZ 3.61Å; K579-F646 HydrophobicContact CD-CE1 4.35Å; K579-F646 HydrophobicContact CD-CE2 4.3Å; K579-F646 HydrophobicContact CD-CZ 4.12Å; K579-F646 HydrophobicContact CG-CZ 4.49Å
580	F	84.2	Confident	89.3	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-40.8	174.5	-67.1	-33.8	0	0	0	113.7	Y584 Y600 V602 Y633 E639 I645 F646	F580-Y584 WeakPolarHBondContact O-CE2 3.34Å; F580-Y600 HydrophobicContact CB-CD2 4.26Å; F580-Y600 HydrophobicContact CB-CE2 4.34Å; F580-Y600 AromaticContact CD1-CD1 3.84Å; F580-Y600 HydrophobicContact CD1-CD1 3.84Å; F580-Y600 AromaticContact CD1-CD2 3.56Å; F580-Y600 HydrophobicContact CD1-CD2 3.56Å; F580-Y600 HydrophobicContact CD1-CE1 4.15Å; F580-Y600 AromaticContact CD1-CE2 3.88Å; F580-Y600 HydrophobicContact CD1-CE2 3.88Å; F580-Y600 AromaticContact CD1-CG 3.53Å; F580-Y600 HydrophobicContact CD1-CG 3.53Å; F580-Y600 AromaticContact CE1-CD1 3.91Å; F580-Y600 HydrophobicContact CE1-CD1 3.91Å; F580-Y600 HydrophobicContact CE1-CD2 4.32Å; F580-Y600 HydrophobicContact CE1-CE1 4.46Å; F580-Y600 AromaticContact CE1-CG 3.83Å; F580-Y600 HydrophobicContact CE1-CG 3.83Å; F580-Y600 HydrophobicContact CG-CD2 4.25Å; F580-V602 HydrophobicContact CD2-CG2 4.31Å; F580-V602 HydrophobicContact CE1-CG2 4.4Å; F580-V602 HydrophobicContact CE2-CG2 3.97Å; F580-V602 HydrophobicContact CZ-CG2 4.03Å; F580-Y633 HydrophobicContact CE2-CE2 4.44Å; F580-E639 HydrophobicContact CD2-CB 4Å; F580-E639 HydrophobicContact CD2-CG 3.74Å; F580-E639 VanDerWaalsContact CD2-OE2 3.28Å; F580-E639 WeakPolarHBondContact CD2-OE2 3.4Å; F580-E639 HydrophobicContact CE2-CB 3.59Å; F580-E639 HydrophobicContact CE2-CG 3.57Å; F580-E639 HydrophobicContact CG-CG 4.33Å; F580-E639 HydrophobicContact CZ-CB 4.31Å; F580-E639 HydrophobicContact CZ-CG 4.03Å; F580-E639 PolarHBondContact N-OE1 3.23Å; F580-I645 HydrophobicContact CZ-CD1 4.4Å; F580-F646 HydrophobicContact CD1-CE1 4.12Å; F580-F646 AromaticContact CD1-CZ 3.68Å; F580-F646 HydrophobicContact CD1-CZ 3.68Å; F580-F646 HydrophobicContact CE1-CE1 4.13Å; F580-F646 HydrophobicContact CE1-CE2 4.09Å; F580-F646 AromaticContact CE1-CZ 3.46Å; F580-F646 HydrophobicContact CE1-CZ 3.46Å; F580-F646 VanDerWaalsContact CE1-CZ 3.46Å; F580-F646 HydrophobicContact CZ-CZ 4.25Å
581	F	88.7	Confident	89.3	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-6.5	-169.9	-44.4	-73.9	0	0	0	115.2	I573 L575 S578 E583 Y584 A596 V602 L604 C631 Y633	I573-F581 HydrophobicContact CG2-CD2 4.22Å; I573-F581 HydrophobicContact CG2-CE2 4.25Å; L575-F581 HydrophobicContact CG-CB 4.17Å; S578-F581 WeakPolarHBondContact OG-CA 3.28Å; S578-F581 VanDerWaalsContact OG-CB 3.31Å; S578-F581 WeakPolarHBondContact OG-CB 3.36Å; S578-F581 PolarHBondContact OG-N 2.99Å; F581-E583 PolarHBondContact O-N 3.18Å; F581-E583 VanDerWaalsContact O-N 3.16Å; F581-Y584 HydrophobicContact CB-CD2 4.38Å; F581-Y584 HydrophobicContact CD1-CD2 4.33Å; F581-Y584 PolarHBondContact O-N 3.12Å; F581-A596 HydrophobicContact CD1-CB 4.13Å; F581-A596 HydrophobicContact CE1-CB 3.57Å; F581-V602 HydrophobicContact CZ-CG1 3.99Å; F581-L604 HydrophobicContact CD1-CD1 3.95Å; F581-L604 HydrophobicContact CD1-CD2 4.37Å; F581-L604 HydrophobicContact CD1-CG 4.33Å; F581-L604 HydrophobicContact CE1-CD1 3.68Å; F581-L604 HydrophobicContact CE1-CD2 3.7Å; F581-L604 HydrophobicContact CE1-CG 3.59Å; F581-L604 HydrophobicContact CE2-CD2 4.19Å; F581-L604 HydrophobicContact CZ-CD1 4.44Å; F581-L604 HydrophobicContact CZ-CD2 3.6Å; F581-L604 HydrophobicContact CZ-CG 3.94Å; F581-C631 HydrophobicContact CD2-CB 4.27Å; F581-C631 HydrophobicContact CE2-CB 4.37Å; F581-Y633 AromaticContact CE2-CD1 3.93Å; F581-Y633 HydrophobicContact CE2-CD1 3.93Å; F581-Y633 HydrophobicContact CE2-CE1 4.43Å; F581-Y633 HydrophobicContact CE2-CG 4.37Å; F581-Y633 HydrophobicContact CZ-CD1 4.32Å; F581-Y633 HydrophobicContact CZ-CG 4.31Å
582	G	84.8	Confident	89.4	Confident	35 Å²	35	50.5 Å²	50.5	36%	0.361	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-57	-29.5	179.1	0	0	0	0	0	114.7	S578 Y584	S578-G582 PolarHBondContact O-N 3.39Å; S578-G582 VanDerWaalsContact O-N 3.16Å; S578-G582 PolarHBondContact OG-N 2.92Å; G582-Y584 PolarHBondContact O-N 3.44Å
583	E	87.1	Confident	89.4	Confident	123 Å²	123	47.2 Å²	47.2	58%	0.575	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-67.4	-14.6	173.2	-70.5	177.3	-173.1	0	0	113.9	F581 K599	F581-E583 PolarHBondContact O-N 3.18Å; F581-E583 VanDerWaalsContact O-N 3.16Å; E583-K599 IonicContact OE1-NZ 3.38Å; E583-K599 PolarHBondContact OE1-NZ 2.85Å; E583-K599 IonicContact OE2-NZ 2.7Å; E583-K599 PolarHBondContact OE2-NZ 2.99Å
584	Y	88.9	Confident	89.4	Confident	12 Å²	12	47.4 Å²	47.4	5%	0.047	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-110.5	10.9	-170.3	-48.3	-42.7	0	0	0	114.3	F580 F581 G582 G586 K587 Y591 A592 H595	F580-Y584 WeakPolarHBondContact O-CE2 3.34Å; F581-Y584 HydrophobicContact CB-CD2 4.38Å; F581-Y584 HydrophobicContact CD1-CD2 4.33Å; F581-Y584 PolarHBondContact O-N 3.12Å; G582-Y584 PolarHBondContact O-N 3.44Å; Y584-G586 PolarHBondContact O-N 2.77Å; Y584-K587 WeakPolarHBondContact O-CB 3.02Å; Y584-K587 PolarHBondContact O-N 2.71Å; Y584-Y591 HydrophobicContact CD1-CE1 4.35Å; Y584-A592 HydrophobicContact CD2-CB 3.85Å; Y584-A592 HydrophobicContact CG-CB 4.01Å; Y584-H595 HydrophobicContact CE1-CB 4.04Å; Y584-H595 HydrophobicContact CE2-CB 4.34Å
585	N	90.4	Very high	89.5	Confident	88 Å²	88	45 Å²	45	47%	0.471	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	130.1	169.2	-172.3	15.8	0	0	0	110.3	L575 K587 M625 A627	L575-N585 HydrophobicContact CD2-CB 3.79Å; N585-K587 VanDerWaalsContact C-N 3.31Å; N585-K587 PolarHBondContact O-N 3.06Å; N585-M625 PolarHBondContact OD1-O 3.28Å; N585-A627 PolarHBondContact OD1-N 3.26Å
586	G	88.8	Confident	89.6	Confident	48 Å²	48	44.9 Å²	44.9	50%	0.495	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	14.3	-175	0	0	0	0	0	115.3	Y584 M625	Y584-G586 PolarHBondContact O-N 2.77Å; G586-M625 PolarHBondContact N-O 3.14Å
587	K	92.6	Very high	89.8	Confident	103 Å²	103	41.8 Å²	41.8	45%	0.448	22%	0.22	S	C	.	.	S	Bend	trans	-104.2	165.9	167.5	-58.9	-58.7	-177.5	-173.4	0	111	Y584 N585 Y591 I624 M625	Y584-K587 WeakPolarHBondContact O-CB 3.02Å; Y584-K587 PolarHBondContact O-N 2.71Å; N585-K587 VanDerWaalsContact C-N 3.31Å; N585-K587 PolarHBondContact O-N 3.06Å; K587-Y591 HydrophobicContact CB-CD1 3.77Å; K587-Y591 HydrophobicContact CB-CE1 4.46Å; K587-Y591 HydrophobicContact CB-CG 4.47Å; K587-Y591 HydrophobicContact CD-CD1 4.31Å; K587-Y591 HydrophobicContact CD-CE1 4.32Å; K587-Y591 HydrophobicContact CG-CD1 3.87Å; K587-Y591 HydrophobicContact CG-CE1 4.05Å; K587-I624 WeakPolarHBondContact O-CA 3.21Å; K587-M625 WeakPolarHBondContact O-CB 3.35Å; K587-M625 VanDerWaalsContact O-CG 3.3Å; K587-M625 WeakPolarHBondContact O-CG 3.29Å; K587-M625 PolarHBondContact O-N 2.95Å
588	S	92.4	Very high	90	Very high	30 Å²	30	43.1 Å²	43.1	21%	0.21	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-70	151.6	171.9	69.2	0	0	0	0	111.3	T590 Y591 A592 P621 H623	S588-T590 VanDerWaalsContact C-N 3.28Å; S588-T590 PolarHBondContact O-N 2.92Å; S588-T590 PolarHBondContact OG-OG1 3.03Å; S588-Y591 PolarHBondContact O-N 3.25Å; S588-Y591 WeakPolarHBondContact OG-CB 3.26Å; S588-Y591 PolarHBondContact OG-N 3.45Å; S588-A592 PolarHBondContact O-N 3.38Å; S588-A592 VanDerWaalsContact O-N 3.08Å; S588-P621 WeakPolarHBondContact CB-O 3.47Å; S588-H623 WeakPolarHBondContact CA-O 3.41Å
589	F	92.4	Very high	90.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-54.2	-43.6	173.6	174.9	-109.4	0	0	0	112.9	Y591 A592 S593 L604 I607 N618 P619 H623 M625 I1036	F589-Y591 PolarHBondContact O-N 3.14Å; F589-A592 PolarHBondContact O-N 2.81Å; F589-S593 WeakPolarHBondContact O-CB 3.19Å; F589-S593 PolarHBondContact O-N 2.95Å; F589-L604 HydrophobicContact CD2-CD1 4.22Å; F589-L604 HydrophobicContact CE2-CB 3.68Å; F589-L604 HydrophobicContact CE2-CD1 3.96Å; F589-L604 HydrophobicContact CE2-CD2 4.47Å; F589-L604 HydrophobicContact CE2-CG 4.26Å; F589-L604 HydrophobicContact CZ-CB 3.85Å; F589-I607 HydrophobicContact CB-CD1 4.02Å; F589-I607 HydrophobicContact CD2-CD1 3.53Å; F589-I607 HydrophobicContact CD2-CG1 3.63Å; F589-I607 HydrophobicContact CE2-CD1 4.23Å; F589-I607 HydrophobicContact CE2-CG1 3.82Å; F589-I607 HydrophobicContact CG-CD1 3.95Å; F589-I607 HydrophobicContact CG-CG1 4.43Å; F589-N618 HydrophobicContact CE1-CB 4.24Å; F589-N618 WeakPolarHBondContact CE1-OD1 3.26Å; F589-P619 HydrophobicContact CD1-CG 4.31Å; F589-P619 HydrophobicContact CG-CG 4.44Å; F589-H623 HydrophobicContact CB-CB 4.45Å; F589-H623 PolarHBondContact N-O 2.84Å; F589-M625 HydrophobicContact CB-SD 3.97Å; F589-M625 HydrophobicContact CD2-CE 4.16Å; F589-M625 HydrophobicContact CD2-SD 3.8Å; F589-M625 HydrophobicContact CG-SD 4.39Å; F589-I1036 HydrophobicContact CD1-CD1 4.08Å; F589-I1036 HydrophobicContact CE1-CD1 3.27Å; F589-I1036 HydrophobicContact CZ-CD1 3.84Å
590	T	91.6	Very high	90.1	Very high	11 Å²	11	40.5 Å²	40.5	7%	0.067	21%	0.209	C	C	.	.	H	α-helix	trans	-57.7	-46.9	176.8	49.3	0	0	0	0	112.3	S588 S593 F594 P621 C1030 A1034	S588-T590 VanDerWaalsContact C-N 3.28Å; S588-T590 PolarHBondContact O-N 2.92Å; S588-T590 PolarHBondContact OG-OG1 3.03Å; T590-S593 PolarHBondContact O-N 3.42Å; T590-F594 PolarHBondContact O-N 2.9Å; T590-F594 VanDerWaalsContact O-N 3.16Å; T590-P621 HydrophobicContact CG2-CB 4.44Å; T590-C1030 VanDerWaalsContact C-SG 3.6Å; T590-C1030 PolarHBondContact O-SG 3.45Å; T590-A1034 HydrophobicContact CG2-CB 3.83Å
591	Y	92.6	Very high	90.3	Very high	102 Å²	102	41.5 Å²	41.5	40%	0.4	22%	0.218	S	C	.	.	H	α-helix	trans	-62.3	-46.3	177.9	-178.4	-91.3	0	0	0	111.7	Y584 K587 S588 F589 S593 H595	Y584-Y591 HydrophobicContact CD1-CE1 4.35Å; K587-Y591 HydrophobicContact CB-CD1 3.77Å; K587-Y591 HydrophobicContact CB-CE1 4.46Å; K587-Y591 HydrophobicContact CB-CG 4.47Å; K587-Y591 HydrophobicContact CD-CD1 4.31Å; K587-Y591 HydrophobicContact CD-CE1 4.32Å; K587-Y591 HydrophobicContact CG-CD1 3.87Å; K587-Y591 HydrophobicContact CG-CE1 4.05Å; S588-Y591 PolarHBondContact O-N 3.25Å; S588-Y591 WeakPolarHBondContact OG-CB 3.26Å; S588-Y591 PolarHBondContact OG-N 3.45Å; F589-Y591 PolarHBondContact O-N 3.14Å; Y591-S593 VanDerWaalsContact C-N 3.35Å; Y591-S593 PolarHBondContact O-N 2.88Å; Y591-H595 AromaticContact CD2-CD2 3.95Å; Y591-H595 AromaticContact CE1-CD2 3.84Å; Y591-H595 AromaticContact CE2-CD2 3.61Å; Y591-H595 AromaticContact CE2-NE2 3.41Å; Y591-H595 WeakPolarHBondContact CE2-NE2 3.39Å; Y591-H595 AromaticContact CZ-CD2 3.54Å; Y591-H595 AromaticContact CZ-NE2 3.46Å; Y591-H595 PolarHBondContact O-CD2 2.67Å; Y591-H595 PolarHBondContact O-N 3.35Å; Y591-H595 VanDerWaalsContact O-N 3.13Å
592	A	92.6	Very high	90.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60	-42.9	177	0	0	0	0	0	112	Y584 S588 F589 H595 A596 L604 M625	Y584-A592 HydrophobicContact CD2-CB 3.85Å; Y584-A592 HydrophobicContact CG-CB 4.01Å; S588-A592 PolarHBondContact O-N 3.38Å; S588-A592 VanDerWaalsContact O-N 3.08Å; F589-A592 PolarHBondContact O-N 2.81Å; A592-H595 PolarHBondContact O-N 3.35Å; A592-A596 VanDerWaalsContact O-CB 3.26Å; A592-A596 WeakPolarHBondContact O-CB 3.49Å; A592-A596 PolarHBondContact O-N 3.09Å; A592-L604 HydrophobicContact CB-CD1 4.15Å; A592-M625 HydrophobicContact CB-CE 3.94Å; A592-M625 HydrophobicContact CB-CG 4.43Å
593	S	92.6	Very high	90.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.3	-47.5	-179.1	-168.5	0	0	0	0	112.7	F589 T590 Y591 H595 A596 H597 F1026	F589-S593 WeakPolarHBondContact O-CB 3.19Å; F589-S593 PolarHBondContact O-N 2.95Å; T590-S593 PolarHBondContact O-N 3.42Å; Y591-S593 VanDerWaalsContact C-N 3.35Å; Y591-S593 PolarHBondContact O-N 2.88Å; S593-H595 PolarHBondContact O-N 2.92Å; S593-A596 PolarHBondContact O-N 2.66Å; S593-H597 PolarHBondContact O-N 3.13Å; S593-F1026 WeakPolarHBondContact OG-CZ 3.27Å
594	F	92.9	Very high	90.9	Very high	26 Å²	26	34 Å²	34	11%	0.114	17%	0.174	C	C	.	.	H	α-helix	trans	-63.5	-43.6	176.9	171.8	-116.2	0	0	0	112.5	T590 H597 K598 F1026 Q1027	T590-F594 PolarHBondContact O-N 2.9Å; T590-F594 VanDerWaalsContact O-N 3.16Å; F594-H597 PolarHBondContact O-N 3Å; F594-K598 HydrophobicContact CE1-CD 4.21Å; F594-K598 HydrophobicContact CE2-CD 4.29Å; F594-K598 HydrophobicContact CZ-CD 3.78Å; F594-K598 VanDerWaalsContact O-CB 3.26Å; F594-K598 WeakPolarHBondContact O-CB 3.27Å; F594-K598 PolarHBondContact O-N 3.01Å; F594-F1026 HydrophobicContact CB-CD1 4.14Å; F594-F1026 HydrophobicContact CB-CE1 4.16Å; F594-F1026 HydrophobicContact CD2-CB 4.47Å; F594-F1026 AromaticContact CD2-CD1 3.93Å; F594-F1026 HydrophobicContact CD2-CD1 3.93Å; F594-F1026 HydrophobicContact CD2-CG 4.46Å; F594-Q1027 HydrophobicContact CD2-CB 4.28Å; F594-Q1027 HydrophobicContact CE1-CG 4.22Å; F594-Q1027 HydrophobicContact CE2-CB 3.57Å; F594-Q1027 HydrophobicContact CE2-CG 4Å; F594-Q1027 HydrophobicContact CZ-CB 3.78Å; F594-Q1027 HydrophobicContact CZ-CG 3.69Å
595	H	91.7	Very high	91	Very high	58 Å²	58	33.7 Å²	33.7	27%	0.269	17%	0.173	S	C	.	.	H	α-helix	trans	-69.4	-35.9	-180	-84.4	-90.4	0	0	0	112.6	Y584 Y591 A592 S593 K599	Y584-H595 HydrophobicContact CE1-CB 4.04Å; Y584-H595 HydrophobicContact CE2-CB 4.34Å; Y591-H595 AromaticContact CD2-CD2 3.95Å; Y591-H595 AromaticContact CE1-CD2 3.84Å; Y591-H595 AromaticContact CE2-CD2 3.61Å; Y591-H595 AromaticContact CE2-NE2 3.41Å; Y591-H595 WeakPolarHBondContact CE2-NE2 3.39Å; Y591-H595 AromaticContact CZ-CD2 3.54Å; Y591-H595 AromaticContact CZ-NE2 3.46Å; Y591-H595 PolarHBondContact O-CD2 2.67Å; Y591-H595 PolarHBondContact O-N 3.35Å; Y591-H595 VanDerWaalsContact O-N 3.13Å; A592-H595 PolarHBondContact O-N 3.35Å; S593-H595 PolarHBondContact O-N 2.92Å; H595-K599 WeakPolarHBondContact O-CB 3.47Å; H595-K599 PolarHBondContact O-N 3.14Å
596	A	91.1	Very high	91.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.4	-42.9	173.7	0	0	0	0	0	112.8	F581 A592 S593 Y600 G601 V602	F581-A596 HydrophobicContact CD1-CB 4.13Å; F581-A596 HydrophobicContact CE1-CB 3.57Å; A592-A596 VanDerWaalsContact O-CB 3.26Å; A592-A596 WeakPolarHBondContact O-CB 3.49Å; A592-A596 PolarHBondContact O-N 3.09Å; S593-A596 PolarHBondContact O-N 2.66Å; A596-Y600 WeakPolarHBondContact O-CA 3.43Å; A596-Y600 PolarHBondContact O-N 3.28Å; A596-G601 PolarHBondContact O-N 2.73Å; A596-V602 CarbonylContact C-O 3.52Å; A596-V602 VanDerWaalsContact C-O 3.31Å; A596-V602 PolarHBondContact O-N 2.93Å
597	H	91.7	Very high	91.3	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.009	13%	0.128	C	C	.	.	H	α-helix	trans	-66.8	-40.8	176.8	-171.9	-90.3	0	0	0	111.7	S593 F594 G601 V602 Y1022 F1026 N1197 P1198	S593-H597 PolarHBondContact O-N 3.13Å; F594-H597 PolarHBondContact O-N 3Å; H597-G601 VanDerWaalsContact O-CA 3.22Å; H597-G601 WeakPolarHBondContact O-CA 3.29Å; H597-G601 PolarHBondContact O-N 2.86Å; H597-V602 VanDerWaalsContact CA-O 3.29Å; H597-V602 WeakPolarHBondContact CA-O 3.3Å; H597-V602 PolarHBondContact N-O 2.76Å; H597-Y1022 AromaticContact CE1-CD1 3.68Å; H597-Y1022 AromaticContact CE1-CE1 3.72Å; H597-Y1022 AromaticContact NE2-CE1 3.7Å; H597-F1026 HydrophobicContact CB-CD2 4.14Å; H597-F1026 HydrophobicContact CB-CE2 3.79Å; H597-F1026 HydrophobicContact CB-CZ 4.11Å; H597-F1026 AromaticContact CG-CD2 3.84Å; H597-F1026 AromaticContact CG-CE2 3.76Å; H597-F1026 AromaticContact ND1-CD2 3.93Å; H597-N1197 PolarHBondContact CD2-OD1 3.18Å; H597-N1197 PolarHBondContact NE2-OD1 2.87Å; H597-P1198 PolarHBondContact CE1-O 3.18Å; H597-P1198 PolarHBondContact NE2-O 3.1Å
598	K	90.7	Very high	91.2	Very high	114 Å²	114	25.2 Å²	25.2	50%	0.496	12%	0.119	S	C	.	.	H	α-helix	trans	-70.1	-36.3	179.2	-173.8	172.3	-180	176.2	0	113.8	F594 H1200	F594-K598 HydrophobicContact CE1-CD 4.21Å; F594-K598 HydrophobicContact CE2-CD 4.29Å; F594-K598 HydrophobicContact CZ-CD 3.78Å; F594-K598 VanDerWaalsContact O-CB 3.26Å; F594-K598 WeakPolarHBondContact O-CB 3.27Å; F594-K598 PolarHBondContact O-N 3.01Å; K598-H1200 PolarHBondContact O-CE1 3.03Å
599	K	89	Confident	91	Very high	73 Å²	73	28 Å²	28	32%	0.317	12%	0.124	S	C	.	.	H	α-helix	trans	-82.6	-58.1	-179.7	-166	175.3	179.1	-160	0	110.7	E583 H595	E583-K599 IonicContact OE1-NZ 3.38Å; E583-K599 PolarHBondContact OE1-NZ 2.85Å; E583-K599 IonicContact OE2-NZ 2.7Å; E583-K599 PolarHBondContact OE2-NZ 2.99Å; H595-K599 WeakPolarHBondContact O-CB 3.47Å; H595-K599 PolarHBondContact O-N 3.14Å
600	Y	86.3	Confident	90.4	Very high	26 Å²	26	34.1 Å²	34.1	10%	0.102	15%	0.153	C	C	.	.	H	α-helix	trans	-106.3	-12.5	-168.4	-57	-63.7	0	0	0	115.2	F580 A596 V602 I645 F646 E649	F580-Y600 HydrophobicContact CB-CD2 4.26Å; F580-Y600 HydrophobicContact CB-CE2 4.34Å; F580-Y600 AromaticContact CD1-CD1 3.84Å; F580-Y600 HydrophobicContact CD1-CD1 3.84Å; F580-Y600 AromaticContact CD1-CD2 3.56Å; F580-Y600 HydrophobicContact CD1-CD2 3.56Å; F580-Y600 HydrophobicContact CD1-CE1 4.15Å; F580-Y600 AromaticContact CD1-CE2 3.88Å; F580-Y600 HydrophobicContact CD1-CE2 3.88Å; F580-Y600 AromaticContact CD1-CG 3.53Å; F580-Y600 HydrophobicContact CD1-CG 3.53Å; F580-Y600 AromaticContact CE1-CD1 3.91Å; F580-Y600 HydrophobicContact CE1-CD1 3.91Å; F580-Y600 HydrophobicContact CE1-CD2 4.32Å; F580-Y600 HydrophobicContact CE1-CE1 4.46Å; F580-Y600 AromaticContact CE1-CG 3.83Å; F580-Y600 HydrophobicContact CE1-CG 3.83Å; F580-Y600 HydrophobicContact CG-CD2 4.25Å; A596-Y600 WeakPolarHBondContact O-CA 3.43Å; A596-Y600 PolarHBondContact O-N 3.28Å; Y600-V602 VanDerWaalsContact C-N 3.33Å; Y600-I645 HydrophobicContact CD1-CG2 4.31Å; Y600-F646 HydrophobicContact CE1-CD1 4.2Å; Y600-F646 AromaticContact CE1-CE1 3.81Å; Y600-F646 HydrophobicContact CE1-CE1 3.81Å; Y600-E649 WeakPolarHBondContact CD1-OE1 3.44Å; Y600-E649 VanDerWaalsContact CE1-OE2 3.26Å; Y600-E649 WeakPolarHBondContact CE1-OE2 3.13Å
601	G	87.1	Confident	89.8	Confident	20 Å²	20	41.6 Å²	41.6	21%	0.206	19%	0.188	C	C	.	.	S	Bend	trans	77.7	14.6	-171.1	0	0	0	0	0	114.6	A596 H597 N1197	A596-G601 PolarHBondContact O-N 2.73Å; H597-G601 VanDerWaalsContact O-CA 3.22Å; H597-G601 WeakPolarHBondContact O-CA 3.29Å; H597-G601 PolarHBondContact O-N 2.86Å; G601-N1197 PolarHBondContact O-ND2 2.94Å
602	V	90.4	Very high	89	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-99.1	127.7	-176.5	177.8	0	0	0	0	110.2	F580 F581 A596 H597 Y600 Y633 N635	F580-V602 HydrophobicContact CD2-CG2 4.31Å; F580-V602 HydrophobicContact CE1-CG2 4.4Å; F580-V602 HydrophobicContact CE2-CG2 3.97Å; F580-V602 HydrophobicContact CZ-CG2 4.03Å; F581-V602 HydrophobicContact CZ-CG1 3.99Å; A596-V602 CarbonylContact C-O 3.52Å; A596-V602 VanDerWaalsContact C-O 3.31Å; A596-V602 PolarHBondContact O-N 2.93Å; H597-V602 VanDerWaalsContact CA-O 3.29Å; H597-V602 WeakPolarHBondContact CA-O 3.3Å; H597-V602 PolarHBondContact N-O 2.76Å; Y600-V602 VanDerWaalsContact C-N 3.33Å; V602-Y633 HydrophobicContact CG1-CD2 3.59Å; V602-Y633 HydrophobicContact CG1-CE2 4.43Å; V602-Y633 HydrophobicContact CG1-CG 3.91Å; V602-N635 HydrophobicContact CG2-CB 4.27Å
603	C	90.3	Very high	88.2	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.014	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	134.3	177.6	-172.6	0	0	0	0	111.3	Y633 I634 I1036 P1037 N1197	C603-Y633 CarbonylContact O-C 3.05Å; C603-Y633 VanDerWaalsContact O-CA 3.23Å; C603-Y633 WeakPolarHBondContact O-CA 3.37Å; C603-Y633 WeakPolarHBondContact O-CB 3.25Å; C603-I634 PolarHBondContact N-O 2.84Å; C603-I634 PolarHBondContact O-N 2.93Å; C603-I1036 VanDerWaalsContact SG-CG2 3.55Å; C603-P1037 PolarHBondContact SG-O 2.91Å; C603-P1037 VanDerWaalsContact SG-O 3.41Å; C603-N1197 WeakPolarHBondContact CB-OD1 3.37Å
604	L	92.4	Very high	87.9	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	133.3	174.4	-80	170.1	0	0	0	111.4	F581 F589 A592 M625 C631	F581-L604 HydrophobicContact CD1-CD1 3.95Å; F581-L604 HydrophobicContact CD1-CD2 4.37Å; F581-L604 HydrophobicContact CD1-CG 4.33Å; F581-L604 HydrophobicContact CE1-CD1 3.68Å; F581-L604 HydrophobicContact CE1-CD2 3.7Å; F581-L604 HydrophobicContact CE1-CG 3.59Å; F581-L604 HydrophobicContact CE2-CD2 4.19Å; F581-L604 HydrophobicContact CZ-CD1 4.44Å; F581-L604 HydrophobicContact CZ-CD2 3.6Å; F581-L604 HydrophobicContact CZ-CG 3.94Å; F589-L604 HydrophobicContact CD2-CD1 4.22Å; F589-L604 HydrophobicContact CE2-CB 3.68Å; F589-L604 HydrophobicContact CE2-CD1 3.96Å; F589-L604 HydrophobicContact CE2-CD2 4.47Å; F589-L604 HydrophobicContact CE2-CG 4.26Å; F589-L604 HydrophobicContact CZ-CB 3.85Å; A592-L604 HydrophobicContact CB-CD1 4.15Å; L604-M625 HydrophobicContact CD1-CE 4.05Å; L604-C631 HydrophobicContact CD2-CB 3.81Å
605	I	92.3	Very high	87.8	Confident	5 Å²	5	50.5 Å²	50.5	3%	0.026	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	-42	179.1	-39.5	179.6	0	0	0	111.3	V570 L617 N618 Y632 I634 I1213	V570-I605 HydrophobicContact CB-CD1 4.31Å; V570-I605 HydrophobicContact CG1-CD1 3.61Å; V570-I605 HydrophobicContact CG2-CD1 3.81Å; I605-L617 HydrophobicContact CG2-CD2 4Å; I605-N618 PolarHBondContact O-N 3.02Å; I605-Y632 PolarHBondContact N-O 3.16Å; I605-I634 HydrophobicContact CD1-CD1 4.02Å; I605-I634 HydrophobicContact CD1-CG1 3.54Å; I605-I634 HydrophobicContact CG1-CD1 4.08Å; I605-I634 HydrophobicContact CG1-CG1 3.7Å; I605-I1213 HydrophobicContact CB-CD1 4.41Å; I605-I1213 HydrophobicContact CG2-CD1 3.47Å; I605-I1213 VanDerWaalsContact CG2-CD1 3.47Å
606	G	91.8	Very high	87.7	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.4	-177	-171.1	0	0	0	0	0	113.5	L616 Y632	G606-L616 CarbonylContact C-O 3.59Å; G606-L616 WeakPolarHBondContact CA-O 3.25Å; G606-Y632 PolarHBondContact O-N 3.3Å
607	I	92.3	Very high	87.7	Confident	1 Å²	1	49 Å²	49	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	149.6	-174	-53.2	168.3	0	0	0	110.1	F589 L616 P619 H623 M625 D629 T630	F589-I607 HydrophobicContact CB-CD1 4.02Å; F589-I607 HydrophobicContact CD2-CD1 3.53Å; F589-I607 HydrophobicContact CD2-CG1 3.63Å; F589-I607 HydrophobicContact CE2-CD1 4.23Å; F589-I607 HydrophobicContact CE2-CG1 3.82Å; F589-I607 HydrophobicContact CG-CD1 3.95Å; F589-I607 HydrophobicContact CG-CG1 4.43Å; I607-L616 PolarHBondContact N-O 2.86Å; I607-L616 PolarHBondContact O-N 3.18Å; I607-P619 HydrophobicContact CD1-CG 4.05Å; I607-H623 WeakPolarHBondContact CD1-CD2 3.27Å; I607-M625 HydrophobicContact CD1-SD 3.47Å; I607-M625 WeakPolarHBondContact CD1-SD 3.39Å; I607-M625 HydrophobicContact CG1-SD 4.19Å; I607-D629 HydrophobicContact CG2-CB 3.78Å; I607-T630 CarbonylContact C-O 3.24Å; I607-T630 WeakPolarHBondContact CA-O 3.24Å
608	K	91.4	Very high	87.7	Confident	59 Å²	59	48.9 Å²	48.9	26%	0.257	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	128.3	158.1	167.6	167	176.5	163.9	0	110.3	K613 I615 T630 Y632	K608-K613 VanDerWaalsContact CE-O 3.32Å; K608-K613 WeakPolarHBondContact CE-O 3.04Å; K608-K613 PolarHBondContact NZ-O 2.68Å; K608-I615 HydrophobicContact CB-CG1 4.36Å; K608-I615 HydrophobicContact CD-CG1 4.29Å; K608-T630 PolarHBondContact N-O 3.08Å; K608-T630 PolarHBondContact O-N 3.24Å; K608-Y632 HydrophobicContact CB-CE2 3.67Å
609	R	87.2	Confident	87.5	Confident	88 Å²	88	44.3 Å²	44.3	33%	0.332	21%	0.213	S	C	.	.			trans	-80.3	165.2	172.2	-62.3	-157.6	162.6	174.3	-3.1	110.8	N612 H623 D629	R609-N612 VanDerWaalsContact O-O 3.04Å; R609-H623 PolarHBondContact NE-CE1 3.22Å; R609-H623 VanDerWaalsContact NE-CE1 3.27Å; R609-H623 PolarHBondContact NE-NE2 3.03Å; R609-H623 PolarHBondContact NH2-CE1 3.23Å; R609-H623 PolarHBondContact NH2-NE2 3.42Å; R609-H623 VanDerWaalsContact NH2-NE2 3.16Å; R609-D629 WeakPolarHBondContact CG-OD1 3.5Å
610	E	81.6	Confident	87.4	Confident	130 Å²	130	40.9 Å²	40.9	61%	0.607	20%	0.198	S	C	*	.	S	Bend	trans	-71.3	-37.2	172.8	-67.9	-177.8	128.6	0	0	112.6	T628	E610-T628 WeakPolarHBondContact OE2-CB 3.5Å; E610-T628 WeakPolarHBondContact OE2-CG2 3.25Å; E610-T628 PolarHBondContact OE2-OG1 3.25Å
611	E	78.7	Confident	87.3	Confident	168 Å²	168	42.4 Å²	42.4	79%	0.785	21%	0.212	S	C	*	.	S	Bend	trans	-69.4	-41.8	180	-60.5	175.9	149.9	0	0	112.4
612	N	76.1	Confident	87.2	Confident	82 Å²	82	48.1 Å²	48.1	44%	0.439	23%	0.233	S	C	.	.			trans	-97.3	119.2	-176.1	-76.9	-14.6	0	0	0	111.2	R609 S614	R609-N612 VanDerWaalsContact O-O 3.04Å; N612-S614 PolarHBondContact O-N 2.96Å
613	K	74.1	Confident	87.1	Confident	183 Å²	183	48.9 Å²	48.9	80%	0.796	24%	0.236	S	C	*	.			trans	-67.7	-21.9	176.5	-69.4	-172.9	178.3	-177.8	0	113.7	K608	K608-K613 VanDerWaalsContact CE-O 3.32Å; K608-K613 WeakPolarHBondContact CE-O 3.04Å; K608-K613 PolarHBondContact NZ-O 2.68Å
614	S	86	Confident	87.1	Confident	45 Å²	45	53.7 Å²	53.7	32%	0.315	26%	0.261	S	S	.	.	S	Bend	trans	-70.6	158.8	178.1	45.6	0	0	0	0	112.9	N612	N612-S614 PolarHBondContact O-N 2.96Å
615	I	91	Very high	87	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.026	26%	0.261	C	S	.	.			trans	-106.1	130.7	173.9	-57.7	172.2	0	0	0	107.4	K608 L617 Y632 L990 I991 L994	K608-I615 HydrophobicContact CB-CG1 4.36Å; K608-I615 HydrophobicContact CD-CG1 4.29Å; I615-L617 HydrophobicContact CG2-CD2 4.29Å; I615-Y632 HydrophobicContact CB-CE2 4.25Å; I615-Y632 HydrophobicContact CD1-CE2 3.94Å; I615-Y632 HydrophobicContact CG1-CE2 3.8Å; I615-Y632 HydrophobicContact CG2-CD2 3.7Å; I615-Y632 HydrophobicContact CG2-CE2 3.55Å; I615-L990 HydrophobicContact CD1-CB 4.05Å; I615-L990 HydrophobicContact CD1-CD1 4.44Å; I615-I991 HydrophobicContact CD1-CD1 4.27Å; I615-I991 HydrophobicContact CD1-CG1 3.71Å; I615-I991 HydrophobicContact CG2-CD1 4.47Å; I615-I991 HydrophobicContact CG2-CG1 4.19Å; I615-L994 HydrophobicContact CB-CD1 3.85Å; I615-L994 HydrophobicContact CG2-CD1 4.3Å; I615-L994 WeakPolarHBondContact O-CD1 3.42Å
616	L	90.1	Very high	86.9	Confident	25 Å²	25	55.5 Å²	55.5	13%	0.131	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	105.9	176.9	-57.8	178.7	0	0	0	108.7	G606 I607 P619	G606-L616 CarbonylContact C-O 3.59Å; G606-L616 WeakPolarHBondContact CA-O 3.25Å; I607-L616 PolarHBondContact N-O 2.86Å; I607-L616 PolarHBondContact O-N 3.18Å; L616-P619 HydrophobicContact CB-CB 4.26Å; L616-P619 HydrophobicContact CB-CG 4.44Å; L616-P619 HydrophobicContact CD1-CB 4.5Å
617	L	90.6	Very high	86.7	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	136.8	167	-56.7	-167.2	0	0	0	109	I605 I615 I991 L994 L995 G1005 I1213	I605-L617 HydrophobicContact CG2-CD2 4Å; I615-L617 HydrophobicContact CG2-CD2 4.29Å; L617-I991 HydrophobicContact CD2-CG2 4.49Å; L617-L994 HydrophobicContact CD1-CB 3.58Å; L617-L994 HydrophobicContact CG-CB 3.89Å; L617-L994 HydrophobicContact CG-CD1 4.41Å; L617-L995 HydrophobicContact CD1-CD2 3.76Å; L617-L995 HydrophobicContact CD1-CG 3.86Å; L617-G1005 PolarHBondContact O-N 3.02Å; L617-I1213 HydrophobicContact CB-CG2 4.28Å
618	N	92.2	Very high	86.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.306	C	S	.	.			trans	22.4	76	-176.6	-169.1	12.8	0	0	0	116.9	F589 I605 G620 A1034 I1036 I1213 S1215	F589-N618 HydrophobicContact CE1-CB 4.24Å; F589-N618 WeakPolarHBondContact CE1-OD1 3.26Å; I605-N618 PolarHBondContact O-N 3.02Å; N618-G620 PolarHBondContact O-N 2.94Å; N618-G620 PolarHBondContact OD1-N 3.31Å; N618-A1034 PolarHBondContact ND2-O 3.38Å; N618-I1036 HydrophobicContact CB-CD1 4.49Å; N618-I1213 HydrophobicContact CB-CB 4.13Å; N618-I1213 HydrophobicContact CB-CG2 3.55Å; N618-I1213 PolarHBondContact ND2-O 3.29Å; N618-S1215 WeakPolarHBondContact O-CA 3.31Å
619	P	85.9	Confident	86.6	Confident	19 Å²	19	57.2 Å²	57.2	12%	0.123	30%	0.295	C	S	.	.			trans	-75.3	18.3	178.3	33.3	-38	0	0	0	114.4	F589 I607 L616 H623	F589-P619 HydrophobicContact CD1-CG 4.31Å; F589-P619 HydrophobicContact CG-CG 4.44Å; I607-P619 HydrophobicContact CD1-CG 4.05Å; L616-P619 HydrophobicContact CB-CB 4.26Å; L616-P619 HydrophobicContact CB-CG 4.44Å; L616-P619 HydrophobicContact CD1-CB 4.5Å; P619-H623 HydrophobicContact CB-CB 3.87Å; P619-H623 HydrophobicContact CG-CB 3.67Å
620	G	86.7	Confident	86.9	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	-162.9	173.6	0	0	0	0	0	115.3	N618	N618-G620 PolarHBondContact O-N 2.94Å; N618-G620 PolarHBondContact OD1-N 3.31Å
621	P	86.2	Confident	87.4	Confident	59 Å²	59	48.1 Å²	48.1	38%	0.383	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-20.7	-172.6	33.2	-34.4	0	0	0	113.3	S588 T590 H623 A1034	S588-P621 WeakPolarHBondContact CB-O 3.47Å; T590-P621 HydrophobicContact CG2-CB 4.44Å; P621-H623 PolarHBondContact O-N 2.72Å; P621-A1034 HydrophobicContact CG-CB 4.42Å
622	H	84.7	Confident	88.2	Confident	140 Å²	140	40.6 Å²	40.6	65%	0.648	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-22.5	178.4	-56.8	-68.4	0	0	0	112.5	I624 H1220	H622-I624 PolarHBondContact O-N 3.16Å; H622-H1220 AromaticContact CD2-CE1 3.98Å; H622-H1220 AromaticContact CD2-ND1 3.93Å; H622-H1220 AromaticContact NE2-CE1 3.69Å; H622-H1220 AromaticContact NE2-ND1 3.54Å
623	H	87.9	Confident	89	Confident	16 Å²	16	36.7 Å²	36.7	7%	0.074	20%	0.202	C	C	.	.			trans	-78.4	103.2	176.7	-155	113.2	0	0	0	110.8	S588 F589 I607 R609 P619 P621 D629	S588-H623 WeakPolarHBondContact CA-O 3.41Å; F589-H623 HydrophobicContact CB-CB 4.45Å; F589-H623 PolarHBondContact N-O 2.84Å; I607-H623 WeakPolarHBondContact CD1-CD2 3.27Å; R609-H623 PolarHBondContact NE-CE1 3.22Å; R609-H623 VanDerWaalsContact NE-CE1 3.27Å; R609-H623 PolarHBondContact NE-NE2 3.03Å; R609-H623 PolarHBondContact NH2-CE1 3.23Å; R609-H623 PolarHBondContact NH2-NE2 3.42Å; R609-H623 VanDerWaalsContact NH2-NE2 3.16Å; P619-H623 HydrophobicContact CB-CB 3.87Å; P619-H623 HydrophobicContact CG-CB 3.67Å; P621-H623 PolarHBondContact O-N 2.72Å; H623-D629 IonicContact NE2-OD2 3.14Å
624	I	91	Very high	89.9	Confident	103 Å²	103	28.1 Å²	28.1	53%	0.528	17%	0.165	S	C	.	.	B	Isolated β-bridge	trans	-79.7	130.6	168.4	-57.7	174	0	0	0	108.6	K587 H622	K587-I624 WeakPolarHBondContact O-CA 3.21Å; H622-I624 PolarHBondContact O-N 3.16Å
625	M	89.8	Confident	90.1	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.01	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-73.3	123.8	-179.2	-59.8	-75.1	-93.8	0	0	110.9	L575 N585 G586 K587 F589 A592 L604 I607	L575-M625 HydrophobicContact CD1-CB 3.63Å; L575-M625 HydrophobicContact CD1-CE 3.99Å; L575-M625 HydrophobicContact CD1-CG 4.41Å; N585-M625 PolarHBondContact OD1-O 3.28Å; G586-M625 PolarHBondContact N-O 3.14Å; K587-M625 WeakPolarHBondContact O-CB 3.35Å; K587-M625 VanDerWaalsContact O-CG 3.3Å; K587-M625 WeakPolarHBondContact O-CG 3.29Å; K587-M625 PolarHBondContact O-N 2.95Å; F589-M625 HydrophobicContact CB-SD 3.97Å; F589-M625 HydrophobicContact CD2-CE 4.16Å; F589-M625 HydrophobicContact CD2-SD 3.8Å; F589-M625 HydrophobicContact CG-SD 4.39Å; A592-M625 HydrophobicContact CB-CE 3.94Å; A592-M625 HydrophobicContact CB-CG 4.43Å; L604-M625 HydrophobicContact CD1-CE 4.05Å; I607-M625 HydrophobicContact CD1-SD 3.47Å; I607-M625 WeakPolarHBondContact CD1-SD 3.39Å; I607-M625 HydrophobicContact CG1-SD 4.19Å
626	A	90.1	Very high	89.9	Confident	40 Å²	40	29 Å²	29	33%	0.331	17%	0.166	S	C	.	.	P	Polyproline II helix	trans	-100.5	159.1	175.5	0	0	0	0	0	112.5	T628 D629	A626-T628 VanDerWaalsContact C-N 3.3Å; A626-T628 PolarHBondContact O-N 3.3Å; A626-D629 WeakPolarHBondContact CB-OD2 3.41Å; A626-D629 PolarHBondContact N-OD2 3.2Å; A626-D629 WeakPolarHBondContact O-CB 3.12Å; A626-D629 PolarHBondContact O-N 2.94Å
627	A	87.6	Confident	89.5	Confident	38 Å²	38	29.9 Å²	29.9	31%	0.314	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-33.8	-175.7	0	0	0	0	0	114.3	C576 N585	C576-A627 HydrophobicContact CB-CB 4.45Å; C576-A627 VanDerWaalsContact CB-O 3.23Å; C576-A627 WeakPolarHBondContact CB-O 3.49Å; C576-A627 PolarHBondContact N-O 3.22Å; C576-A627 PolarHBondContact SG-O 3.2Å; C576-A627 VanDerWaalsContact SG-O 3.39Å; N585-A627 PolarHBondContact OD1-N 3.26Å
628	T	89.8	Confident	89.1	Confident	55 Å²	55	31.5 Å²	31.5	34%	0.337	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-4	-177.3	58.6	0	0	0	0	114.3	E610 A626	E610-T628 WeakPolarHBondContact OE2-CB 3.5Å; E610-T628 WeakPolarHBondContact OE2-CG2 3.25Å; E610-T628 PolarHBondContact OE2-OG1 3.25Å; A626-T628 VanDerWaalsContact C-N 3.3Å; A626-T628 PolarHBondContact O-N 3.3Å
629	D	91.6	Very high	88.4	Confident	4 Å²	4	32.2 Å²	32.2	2%	0.021	18%	0.182	C	C	.	.			trans	-60.7	138.7	179.1	-76.1	-26.1	0	0	0	111.6	R574 L575 I607 R609 H623 A626	R574-D629 CarbonylContact C-O 3.57Å; R574-D629 WeakPolarHBondContact CA-O 3.22Å; L575-D629 PolarHBondContact N-O 2.94Å; I607-D629 HydrophobicContact CG2-CB 3.78Å; R609-D629 WeakPolarHBondContact CG-OD1 3.5Å; H623-D629 IonicContact NE2-OD2 3.14Å; A626-D629 WeakPolarHBondContact CB-OD2 3.41Å; A626-D629 PolarHBondContact N-OD2 3.2Å; A626-D629 WeakPolarHBondContact O-CB 3.12Å; A626-D629 PolarHBondContact O-N 2.94Å
630	T	92.7	Very high	87.5	Confident	27 Å²	27	36.4 Å²	36.4	17%	0.166	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	110	173.9	-61.1	0	0	0	0	109.7	H572 I573 I607 K608 Y632	H572-T630 HydrophobicContact CB-CG2 3.93Å; I573-T630 CarbonylContact O-C 3.54Å; I573-T630 WeakPolarHBondContact O-CA 3.27Å; I607-T630 CarbonylContact C-O 3.24Å; I607-T630 WeakPolarHBondContact CA-O 3.24Å; K608-T630 PolarHBondContact N-O 3.08Å; K608-T630 PolarHBondContact O-N 3.24Å; T630-Y632 HydrophobicContact CG2-CE1 4.36Å
631	C	93.1	Very high	86.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	126.7	179	-62.5	0	0	0	0	110.6	H572 I573 F581 L604	H572-C631 WeakPolarHBondContact CA-O 3.4Å; I573-C631 PolarHBondContact N-O 3.18Å; I573-C631 VanDerWaalsContact N-O 3.13Å; I573-C631 PolarHBondContact O-N 2.7Å; F581-C631 HydrophobicContact CD2-CB 4.27Å; F581-C631 HydrophobicContact CE2-CB 4.37Å; L604-C631 HydrophobicContact CD2-CB 3.81Å
632	Y	94.5	Very high	85.6	Confident	10 Å²	10	38.4 Å²	38.4	4%	0.039	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	127	171.9	-62.6	-74.3	0	0	0	110.6	Y571 H572 I605 G606 K608 I615 T630 Y987 I991	Y571-Y632 WeakPolarHBondContact O-CA 3.36Å; H572-Y632 HydrophobicContact CB-CD1 3.6Å; H572-Y632 HydrophobicContact CB-CE1 3.57Å; I605-Y632 PolarHBondContact N-O 3.16Å; G606-Y632 PolarHBondContact O-N 3.3Å; K608-Y632 HydrophobicContact CB-CE2 3.67Å; I615-Y632 HydrophobicContact CB-CE2 4.25Å; I615-Y632 HydrophobicContact CD1-CE2 3.94Å; I615-Y632 HydrophobicContact CG1-CE2 3.8Å; I615-Y632 HydrophobicContact CG2-CD2 3.7Å; I615-Y632 HydrophobicContact CG2-CE2 3.55Å; T630-Y632 HydrophobicContact CG2-CE1 4.36Å; Y632-Y987 AromaticContact CD1-CD2 3.73Å; Y632-Y987 HydrophobicContact CD1-CD2 3.73Å; Y632-Y987 AromaticContact CD1-CE2 3.93Å; Y632-Y987 HydrophobicContact CD1-CE2 3.93Å; Y632-Y987 HydrophobicContact CD1-CG 4.32Å; Y632-Y987 HydrophobicContact CE1-CD1 4.13Å; Y632-Y987 AromaticContact CE1-CD2 3.4Å; Y632-Y987 HydrophobicContact CE1-CD2 3.4Å; Y632-Y987 VanDerWaalsContact CE1-CD2 3.4Å; Y632-Y987 AromaticContact CE1-CE2 3.91Å; Y632-Y987 HydrophobicContact CE1-CE2 3.91Å; Y632-Y987 AromaticContact CE1-CG 3.52Å; Y632-Y987 HydrophobicContact CE1-CG 3.52Å; Y632-I991 HydrophobicContact CD1-CD1 3.59Å; Y632-I991 HydrophobicContact CD2-CD1 4.13Å; Y632-I991 HydrophobicContact CE1-CD1 4.07Å; Y632-I991 HydrophobicContact CG-CD1 3.62Å
633	Y	93.7	Very high	84.2	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	158	-173.8	67.4	-93.5	0	0	0	113.1	V570 Y571 I573 F580 F581 V602 C603 N635 E639	V570-Y633 WeakPolarHBondContact CA-O 3.21Å; Y571-Y633 AromaticContact CD2-CE2 3.86Å; Y571-Y633 HydrophobicContact CD2-CE2 3.86Å; Y571-Y633 HydrophobicContact CG-CE2 4.24Å; Y571-Y633 PolarHBondContact N-O 2.87Å; Y571-Y633 PolarHBondContact O-N 3.35Å; I573-Y633 HydrophobicContact CB-CE1 4.21Å; I573-Y633 HydrophobicContact CG2-CD1 4.33Å; I573-Y633 HydrophobicContact CG2-CE1 3.77Å; F580-Y633 HydrophobicContact CE2-CE2 4.44Å; F581-Y633 AromaticContact CE2-CD1 3.93Å; F581-Y633 HydrophobicContact CE2-CD1 3.93Å; F581-Y633 HydrophobicContact CE2-CE1 4.43Å; F581-Y633 HydrophobicContact CE2-CG 4.37Å; F581-Y633 HydrophobicContact CZ-CD1 4.32Å; F581-Y633 HydrophobicContact CZ-CG 4.31Å; V602-Y633 HydrophobicContact CG1-CD2 3.59Å; V602-Y633 HydrophobicContact CG1-CE2 4.43Å; V602-Y633 HydrophobicContact CG1-CG 3.91Å; C603-Y633 CarbonylContact O-C 3.05Å; C603-Y633 VanDerWaalsContact O-CA 3.23Å; C603-Y633 WeakPolarHBondContact O-CA 3.37Å; C603-Y633 WeakPolarHBondContact O-CB 3.25Å; Y633-N635 HydrophobicContact CD2-CB 4Å; Y633-N635 HydrophobicContact CE2-CB 3.94Å; Y633-E639 WeakPolarHBondContact OH-CB 3.49Å; Y633-E639 PolarHBondContact OH-N 3.4Å; Y633-E639 VanDerWaalsContact OH-N 3.17Å
634	I	92.7	Very high	82.6	Confident	3 Å²	3	38 Å²	38	2%	0.015	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	127.9	173.2	-56.5	178.4	0	0	0	108.8	L530 N568 E569 C603 I605 I1038 I1196 N1197	L530-I634 HydrophobicContact CD2-CD1 4.3Å; L530-I634 HydrophobicContact CD2-CG2 4.23Å; N568-I634 HydrophobicContact CB-CG2 3.6Å; E569-I634 WeakPolarHBondContact O-CA 3.22Å; C603-I634 PolarHBondContact N-O 2.84Å; C603-I634 PolarHBondContact O-N 2.93Å; I605-I634 HydrophobicContact CD1-CD1 4.02Å; I605-I634 HydrophobicContact CD1-CG1 3.54Å; I605-I634 HydrophobicContact CG1-CD1 4.08Å; I605-I634 HydrophobicContact CG1-CG1 3.7Å; I634-I1038 HydrophobicContact CD1-CG2 3.71Å; I634-I1196 HydrophobicContact CG2-CG2 4.35Å; I634-N1197 HydrophobicContact CB-CB 4.43Å; I634-N1197 HydrophobicContact CG2-CB 3.82Å; I634-N1197 PolarHBondContact O-ND2 2.92Å
635	N	90.8	Very high	81.1	Confident	13 Å²	13	34.1 Å²	34.1	7%	0.07	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	160.3	170.1	-166.2	13.4	0	0	0	111.2	N568 E569 Y571 V602 Y633 T637	N568-N635 WeakPolarHBondContact OD1-CA 3.48Å; E569-N635 PolarHBondContact N-O 3.39Å; E569-N635 PolarHBondContact O-N 3.42Å; E569-N635 VanDerWaalsContact O-N 3.13Å; Y571-N635 WeakPolarHBondContact CE2-O 3.47Å; V602-N635 HydrophobicContact CG2-CB 4.27Å; Y633-N635 HydrophobicContact CD2-CB 4Å; Y633-N635 HydrophobicContact CE2-CB 3.94Å; N635-T637 VanDerWaalsContact C-N 3.26Å; N635-T637 PolarHBondContact ND2-O 3.49Å; N635-T637 PolarHBondContact O-N 3.1Å
636	I	85.3	Confident	79.6	Confident	56 Å²	56	35.6 Å²	35.6	29%	0.287	20%	0.201	S	C	.	.	S	Bend	trans	-69.9	-23.4	175.6	-56.6	174.3	0	0	0	112.1	L549 G567 N568	L549-I636 HydrophobicContact CD2-CG2 4.15Å; G567-I636 WeakPolarHBondContact O-CA 3.31Å; N568-I636 PolarHBondContact OD1-N 2.86Å
637	T	82.4	Confident	78	Confident	42 Å²	42	38.5 Å²	38.5	26%	0.258	21%	0.211	S	C	.	.	S	Bend	trans	-143.5	145.2	176.5	53.3	0	0	0	0	111.8	Y571 N635 S642	Y571-T637 VanDerWaalsContact CE2-C 3.42Å; N635-T637 VanDerWaalsContact C-N 3.26Å; N635-T637 PolarHBondContact ND2-O 3.49Å; N635-T637 PolarHBondContact O-N 3.1Å; T637-S642 WeakPolarHBondContact OG1-CB 3.49Å
638	K	82.1	Confident	76.4	Confident	35 Å²	35	42.5 Å²	42.5	15%	0.152	22%	0.223	C	C	.	.			trans	-62.1	139.2	173	-167	-176.5	178.9	-167.2	0	110.9	Y571 E640 N641 S642	Y571-K638 HydrophobicContact CD1-CB 3.98Å; Y571-K638 HydrophobicContact CD1-CD 4.45Å; Y571-K638 HydrophobicContact CD1-CG 4.04Å; Y571-K638 HydrophobicContact CD2-CB 4.33Å; Y571-K638 HydrophobicContact CE1-CB 3.83Å; Y571-K638 HydrophobicContact CE1-CG 4.37Å; Y571-K638 HydrophobicContact CE2-CB 4.15Å; Y571-K638 VanDerWaalsContact CE2-N 3.25Å; Y571-K638 HydrophobicContact CG-CB 4.24Å; Y571-K638 HydrophobicContact CG-CG 4.23Å; K638-E640 VanDerWaalsContact C-N 3.29Å; K638-E640 HydrophobicContact CD-CB 4.48Å; K638-E640 HydrophobicContact CD-CG 4.43Å; K638-E640 VanDerWaalsContact CE-CD 3.47Å; K638-E640 WeakPolarHBondContact CE-OE1 3.32Å; K638-E640 WeakPolarHBondContact CE-OE2 3.36Å; K638-E640 IonicContact NZ-OE1 2.7Å; K638-E640 PolarHBondContact NZ-OE1 2.88Å; K638-E640 IonicContact NZ-OE2 2.7Å; K638-E640 PolarHBondContact NZ-OE2 3.44Å; K638-E640 PolarHBondContact O-N 2.94Å; K638-N641 WeakPolarHBondContact O-CA 3.25Å; K638-N641 WeakPolarHBondContact O-CB 3.47Å; K638-N641 PolarHBondContact O-N 3.41Å; K638-S642 PolarHBondContact O-N 3.03Å; K638-S642 VanDerWaalsContact O-N 3.1Å
639	E	78.4	Confident	74.5	Confident	15 Å²	15	42.5 Å²	42.5	7%	0.07	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-41.2	-178.5	-171.6	171.1	-177.8	0	0	114.6	I573 K579 F580 Y633 N641 S642	I573-E639 VanDerWaalsContact CD1-OE2 3.3Å; I573-E639 WeakPolarHBondContact CD1-OE2 3.18Å; K579-E639 WeakPolarHBondContact CA-OE1 3.25Å; K579-E639 WeakPolarHBondContact CB-OE1 3.07Å; K579-E639 PolarHBondContact N-OE1 3.2Å; F580-E639 HydrophobicContact CD2-CB 4Å; F580-E639 HydrophobicContact CD2-CG 3.74Å; F580-E639 VanDerWaalsContact CD2-OE2 3.28Å; F580-E639 WeakPolarHBondContact CD2-OE2 3.4Å; F580-E639 HydrophobicContact CE2-CB 3.59Å; F580-E639 HydrophobicContact CE2-CG 3.57Å; F580-E639 HydrophobicContact CG-CG 4.33Å; F580-E639 HydrophobicContact CZ-CB 4.31Å; F580-E639 HydrophobicContact CZ-CG 4.03Å; F580-E639 PolarHBondContact N-OE1 3.23Å; Y633-E639 WeakPolarHBondContact OH-CB 3.49Å; Y633-E639 PolarHBondContact OH-N 3.4Å; Y633-E639 VanDerWaalsContact OH-N 3.17Å; E639-N641 PolarHBondContact O-N 2.83Å; E639-N641 VanDerWaalsContact O-N 3.13Å; E639-S642 WeakPolarHBondContact CA-OG 3.46Å; E639-S642 PolarHBondContact O-N 3.24Å; E639-S642 VanDerWaalsContact O-N 3.09Å; E639-S642 PolarHBondContact O-OG 3.04Å
640	E	66.4	Low	72.3	Confident	107 Å²	107	49 Å²	49	50%	0.5	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-32.7	174.7	-69.9	170.9	-173.1	0	0	113	R395 K638	R395-E640 IonicContact CZ-OE2 2.65Å; R395-E640 VanDerWaalsContact NH2-CD 3.33Å; R395-E640 IonicContact NH2-OE1 3.17Å; R395-E640 PolarHBondContact NH2-OE1 2.7Å; R395-E640 VanDerWaalsContact NH2-OE1 3.14Å; R395-E640 IonicContact NH2-OE2 2.64Å; R395-E640 PolarHBondContact NH2-OE2 3.48Å; K638-E640 VanDerWaalsContact C-N 3.29Å; K638-E640 HydrophobicContact CD-CB 4.48Å; K638-E640 HydrophobicContact CD-CG 4.43Å; K638-E640 VanDerWaalsContact CE-CD 3.47Å; K638-E640 WeakPolarHBondContact CE-OE1 3.32Å; K638-E640 WeakPolarHBondContact CE-OE2 3.36Å; K638-E640 IonicContact NZ-OE1 2.7Å; K638-E640 PolarHBondContact NZ-OE1 2.88Å; K638-E640 IonicContact NZ-OE2 2.7Å; K638-E640 PolarHBondContact NZ-OE2 3.44Å; K638-E640 PolarHBondContact O-N 2.94Å
641	N	70.3	Confident	69.8	Low	101 Å²	101	57.8 Å²	57.8	54%	0.54	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-18	-178.5	-59	-25.4	0	0	0	112.3	K638 E639 A643	K638-N641 WeakPolarHBondContact O-CA 3.25Å; K638-N641 WeakPolarHBondContact O-CB 3.47Å; K638-N641 PolarHBondContact O-N 3.41Å; E639-N641 PolarHBondContact O-N 2.83Å; E639-N641 VanDerWaalsContact O-N 3.13Å; N641-A643 VanDerWaalsContact C-N 3.25Å; N641-A643 PolarHBondContact O-N 3.3Å; N641-A643 VanDerWaalsContact O-N 3.16Å
642	S	63.1	Low	67.5	Low	0 Å²	0	65.7 Å²	65.7	0%	0	31%	0.314	C	S	.	.			trans	-87.9	28.2	-168.6	81.6	0	0	0	0	114.3	T637 K638 E639 F644 I645	T637-S642 WeakPolarHBondContact OG1-CB 3.49Å; K638-S642 PolarHBondContact O-N 3.03Å; K638-S642 VanDerWaalsContact O-N 3.1Å; E639-S642 WeakPolarHBondContact CA-OG 3.46Å; E639-S642 PolarHBondContact O-N 3.24Å; E639-S642 VanDerWaalsContact O-N 3.09Å; E639-S642 PolarHBondContact O-OG 3.04Å; S642-F644 PolarHBondContact O-N 2.87Å; S642-I645 PolarHBondContact O-N 3.35Å
643	A	56	Low	64.7	Low	56 Å²	56	68.3 Å²	68.3	46%	0.463	34%	0.344	S	S	.	.	H	α-helix	trans	-56.2	-17.8	-178	0	0	0	0	0	114.4	N641 N647	N641-A643 VanDerWaalsContact C-N 3.25Å; N641-A643 PolarHBondContact O-N 3.3Å; N641-A643 VanDerWaalsContact O-N 3.16Å; A643-N647 PolarHBondContact O-N 3.47Å
644	F	53.5	Low	61.6	Low	90 Å²	90	78.1 Å²	78.1	40%	0.395	38%	0.381	S	S	.	.	H	α-helix	trans	-67	-30.9	175.3	69.1	-90	0	0	0	113.8	S642 N647 Q648	S642-F644 PolarHBondContact O-N 2.87Å; F644-N647 PolarHBondContact O-N 3.09Å; F644-Q648 PolarHBondContact O-N 2.87Å; F644-Q648 VanDerWaalsContact O-N 3.13Å
645	I	59	Low	58.7	Low	22 Å²	22	84.2 Å²	84.2	11%	0.113	42%	0.421	C	S	.	.	H	α-helix	trans	-63.6	-54.3	-177.5	-59	178.2	0	0	0	109.4	F580 Y600 S642 N647 Q648 E649	F580-I645 HydrophobicContact CZ-CD1 4.4Å; Y600-I645 HydrophobicContact CD1-CG2 4.31Å; S642-I645 PolarHBondContact O-N 3.35Å; I645-N647 VanDerWaalsContact C-N 3.34Å; I645-N647 PolarHBondContact O-N 2.85Å; I645-Q648 PolarHBondContact O-N 2.86Å; I645-E649 PolarHBondContact O-N 2.86Å
646	F	57.8	Low	55.9	Low	34 Å²	34	89 Å²	89	15%	0.149	46%	0.463	C	S	.	.	H	α-helix	trans	-56.5	-44.8	177.6	-55.2	-78.4	0	0	0	112.2	K579 F580 Y600 Q648 E649 E650	K579-F646 HydrophobicContact CB-CE1 3.65Å; K579-F646 HydrophobicContact CB-CZ 3.61Å; K579-F646 HydrophobicContact CD-CE1 4.35Å; K579-F646 HydrophobicContact CD-CE2 4.3Å; K579-F646 HydrophobicContact CD-CZ 4.12Å; K579-F646 HydrophobicContact CG-CZ 4.49Å; F580-F646 HydrophobicContact CD1-CE1 4.12Å; F580-F646 AromaticContact CD1-CZ 3.68Å; F580-F646 HydrophobicContact CD1-CZ 3.68Å; F580-F646 HydrophobicContact CE1-CE1 4.13Å; F580-F646 HydrophobicContact CE1-CE2 4.09Å; F580-F646 AromaticContact CE1-CZ 3.46Å; F580-F646 HydrophobicContact CE1-CZ 3.46Å; F580-F646 VanDerWaalsContact CE1-CZ 3.46Å; F580-F646 HydrophobicContact CZ-CZ 4.25Å; Y600-F646 HydrophobicContact CE1-CD1 4.2Å; Y600-F646 AromaticContact CE1-CE1 3.81Å; Y600-F646 HydrophobicContact CE1-CE1 3.81Å; F646-Q648 PolarHBondContact O-N 3.4Å; F646-E649 PolarHBondContact O-N 3.19Å; F646-E650 PolarHBondContact O-N 3.35Å
647	N	56.6	Low	53.1	Low	100 Å²	100	90 Å²	90	54%	0.535	49%	0.487	S	S	.	.	H	α-helix	trans	-62.8	-25.8	177	-72.6	-11.3	0	0	0	113.7	A643 F644 I645 R651	A643-N647 PolarHBondContact O-N 3.47Å; F644-N647 PolarHBondContact O-N 3.09Å; I645-N647 VanDerWaalsContact C-N 3.34Å; I645-N647 PolarHBondContact O-N 2.85Å; N647-R651 WeakPolarHBondContact O-CG 3.44Å
648	Q	53.9	Low	50.6	Low	122 Å²	122	92 Å²	92	57%	0.57	52%	0.515	S	S	*	.	H	α-helix	trans	-86	-32	176.7	-162.3	172.8	15.2	0	0	111.9	F644 I645 F646 K652	F644-Q648 PolarHBondContact O-N 2.87Å; F644-Q648 VanDerWaalsContact O-N 3.13Å; I645-Q648 PolarHBondContact O-N 2.86Å; F646-Q648 PolarHBondContact O-N 3.4Å; Q648-K652 PolarHBondContact O-N 2.82Å
649	E	50.1	Low	48.3	Very low	56 Å²	56	97.7 Å²	97.7	26%	0.262	55%	0.545	S	S	.	.	H	α-helix	trans	-70.1	-44.5	172.5	-76.4	177.1	-152.7	0	0	112.8	Y600 I645 F646 R651 K652 G653	Y600-E649 WeakPolarHBondContact CD1-OE1 3.44Å; Y600-E649 VanDerWaalsContact CE1-OE2 3.26Å; Y600-E649 WeakPolarHBondContact CE1-OE2 3.13Å; I645-E649 PolarHBondContact O-N 2.86Å; F646-E649 PolarHBondContact O-N 3.19Å; E649-R651 PolarHBondContact O-N 2.93Å; E649-R651 VanDerWaalsContact O-N 3.14Å; E649-K652 CarbonylContact O-C 3.46Å; E649-K652 WeakPolarHBondContact O-CA 3.32Å; E649-K652 PolarHBondContact O-N 3.3Å; E649-G653 PolarHBondContact O-N 3.43Å
650	E	46.8	Very low	46	Very low	139 Å²	139	108.1 Å²	108.1	65%	0.65	59%	0.586	S	S	*	*	H	α-helix	trans	-57.1	-31	174.7	-75	-167.1	166.6	0	0	112.5	F646	F646-E650 PolarHBondContact O-N 3.35Å
651	R	40.2	Very low	44.2	Very low	212 Å²	212	111.1 Å²	111.1	80%	0.8	61%	0.605	S	S	*	*	H	α-helix	trans	-76.4	-30.6	173.8	-73.2	179.4	174.3	-153.6	-2.4	113.5	N647 E649	N647-R651 WeakPolarHBondContact O-CG 3.44Å; E649-R651 PolarHBondContact O-N 2.93Å; E649-R651 VanDerWaalsContact O-N 3.14Å
652	K	43.7	Very low	42.1	Very low	166 Å²	166	109.4 Å²	109.4	72%	0.722	61%	0.612	S	S	*	*	H	α-helix	trans	-76.4	-25.7	172	-72.6	179.2	179.5	178.9	0	112.5	Q648 E649 R654	Q648-K652 PolarHBondContact O-N 2.82Å; E649-K652 CarbonylContact O-C 3.46Å; E649-K652 WeakPolarHBondContact O-CA 3.32Å; E649-K652 PolarHBondContact O-N 3.3Å; K652-R654 VanDerWaalsContact C-N 3.26Å; K652-R654 PolarHBondContact O-N 3.42Å
653	G	36.2	Very low	40.7	Very low	65 Å²	65	115.1 Å²	115.1	67%	0.67	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-1.8	-179.1	0	0	0	0	0	116	E649	E649-G653 PolarHBondContact O-N 3.43Å
654	R	28.5	Very low	39.5	Very low	206 Å²	206	117.7 Å²	117.7	78%	0.777	66%	0.663	S	S	*	*	S	Bend	trans	-114.9	125.3	177.6	-63.9	-173.3	-177	-165.7	1.3	110.7	K652	K652-R654 VanDerWaalsContact C-N 3.26Å; K652-R654 PolarHBondContact O-N 3.42Å
655	P	30.6	Very low	38.2	Very low	131 Å²	131	122.6 Å²	122.6	85%	0.851	69%	0.688	S	S	*	*			trans	-66	141.2	173.5	28.7	-33.9	0	0	0	110.4	G657	P655-G657 PolarHBondContact O-N 3.31Å
656	A	32.4	Very low	36.8	Very low	115 Å²	115	128.6 Å²	128.6	95%	0.95	72%	0.719	S	S	*	*			trans	-70.9	124.9	-175.8	0	0	0	0	0	112.1
657	G	27.3	Very low	35.5	Very low	77 Å²	77	133.1 Å²	133.1	79%	0.794	75%	0.752	S	S	*	*			trans	-169.5	132.2	173.5	0	0	0	0	0	112.2	P655	P655-G657 PolarHBondContact O-N 3.31Å
658	G	29	Very low	34.2	Very low	83 Å²	83	133.8 Å²	133.8	86%	0.856	76%	0.759	S	S	*	*			trans	92	100	175.8	0	0	0	0	0	114.6
659	I	34.2	Very low	32.9	Very low	154 Å²	154	136.5 Å²	136.5	79%	0.79	77%	0.772	S	S	*	*			trans	-85.8	122.2	164.7	-64.7	165	0	0	0	108.1
660	Y	30.1	Very low	31.9	Very low	234 Å²	234	138.4 Å²	138.4	92%	0.918	79%	0.791	S	S	*	*			trans	-155.7	121.3	149.1	-91.8	-65.8	0	0	0	109.3
661	D	29	Very low	31.1	Very low	170 Å²	170	139.1 Å²	139.1	91%	0.909	80%	0.798	S	S	*	*			trans	-76.4	143.2	175.6	-84	-57.2	0	0	0	112
662	G	25.9	Very low	30.5	Very low	65 Å²	65	136.7 Å²	136.7	67%	0.67	80%	0.799	S	S	*	*			trans	-153.3	123.7	171.5	0	0	0	0	0	109.8
663	P	33	Very low	29.8	Very low	121 Å²	121	133.5 Å²	133.5	79%	0.786	80%	0.803	S	S	*	*			trans	-78.3	135.1	-167.2	29.5	-34.8	0	0	0	113.7
664	S	30.6	Very low	29.5	Very low	109 Å²	109	136 Å²	136	76%	0.762	81%	0.811	S	S	*	*			trans	5.3	115.2	154.7	57.8	0	0	0	0	118.5
665	Q	27.8	Very low	29.4	Very low	194 Å²	194	135.2 Å²	135.2	91%	0.907	82%	0.818	S	S	*	*			trans	-114.6	130.5	145.3	-79.2	-170.4	-16.3	0	0	109.9
666	L	27.8	Very low	29.2	Very low	147 Å²	147	132.2 Å²	132.2	77%	0.77	81%	0.811	S	S	*	*			trans	-87.6	134.7	175.1	-68.3	163.7	0	0	0	109.3	V668	L666-V668 VanDerWaalsContact C-N 3.3Å; L666-V668 HydrophobicContact CB-CG2 4.41Å; L666-V668 PolarHBondContact O-N 3.49Å
667	P	31.3	Very low	29	Very low	129 Å²	129	133.2 Å²	133.2	84%	0.838	81%	0.805	S	S	*	*			trans	-73.8	90.5	158.8	11.8	2.3	0	0	0	108	H669	P667-H669 PolarHBondContact O-N 2.85Å
668	V	28.7	Very low	28.8	Very low	114 Å²	114	135.8 Å²	135.8	69%	0.691	81%	0.805	S	S	*	*			trans	-71.3	111.6	163.6	175.9	0	0	0	0	107.3	L666	L666-V668 VanDerWaalsContact C-N 3.3Å; L666-V668 HydrophobicContact CB-CG2 4.41Å; L666-V668 PolarHBondContact O-N 3.49Å
669	H	27.2	Very low	28.7	Very low	180 Å²	180	136.1 Å²	136.1	83%	0.833	80%	0.8	S	S	*	*			trans	-168.2	126.1	131	-106	-70	0	0	0	111.2	P667	P667-H669 PolarHBondContact O-N 2.85Å
670	S	29.2	Very low	28.5	Very low	95 Å²	95	137 Å²	137	66%	0.664	80%	0.804	S	S	*	*			trans	-132.2	169.2	161.2	61.3	0	0	0	0	108.3
671	I	30.1	Very low	28.3	Very low	155 Å²	155	132.5 Å²	132.5	80%	0.795	80%	0.796	S	S	*	*			trans	75.8	153.5	176.9	-47.5	166	0	0	0	113.4
672	I	27.6	Very low	28.1	Very low	161 Å²	161	130.9 Å²	130.9	83%	0.826	79%	0.787	S	S	*	*			trans	75.5	90	-177.1	-43.8	177.7	0	0	0	114.7
673	A	28	Very low	28.2	Very low	98 Å²	98	135.1 Å²	135.1	81%	0.81	79%	0.789	S	S	*	*				173	93.6	114.3	0	0	0	0	0	112.2
674	S	30	Very low	27.8	Very low	119 Å²	119	135.2 Å²	135.2	83%	0.832	78%	0.783	S	S	*	*			trans	-114.7	96.4	153	48.4	0	0	0	0	108.6
675	M	26.4	Very low	27.6	Very low	189 Å²	189	135.4 Å²	135.4	93%	0.931	78%	0.78	S	S	*	*			trans	-168.9	146.5	163	-82.4	-125.1	79.5	0	0	106.5
676	G	26.6	Very low	27.4	Very low	67 Å²	67	131.2 Å²	131.2	69%	0.691	77%	0.772	S	S	*	*			trans	-139.7	146.1	-178.7	0	0	0	0	0	113
677	T	28	Very low	27.5	Very low	137 Å²	137	130.3 Å²	130.3	84%	0.84	78%	0.775	S	S	*	*			trans	-154.9	123	167.8	7.2	0	0	0	0	111.5
678	V	24.8	Very low	27.8	Very low	130 Å²	130	129 Å²	129	79%	0.788	77%	0.766	S	S	*	*			trans	32.7	111	134.8	-173.3	0	0	0	0	119.2
679	A	26.6	Very low	27.6	Very low	90 Å²	90	130.6 Å²	130.6	74%	0.744	77%	0.771	S	S	*	*			trans	37.5	138	138.8	0	0	0	0	0	122.9
680	I	30.3	Very low	27.6	Very low	173 Å²	173	129.2 Å²	129.2	89%	0.887	77%	0.768	S	S	*	*				-160.3	151.2	128.3	-110.2	163.3	0	0	0	112.4
681	D	24.9	Very low	27.5	Very low	140 Å²	140	130.3 Å²	130.3	75%	0.749	78%	0.776	S	S	*	*			trans	-59.8	170.9	171.4	-81.8	-53.2	0	0	0	114.5
682	L	25.6	Very low	27.4	Very low	135 Å²	135	126.9 Å²	126.9	71%	0.707	78%	0.779	S	S	*	*			cis	-176.5	170.9	-19.9	-172	73.9	0	0	0	106.1
683	Q	27.8	Very low	27.4	Very low	154 Å²	154	122.8 Å²	122.8	72%	0.72	78%	0.776	S	S	*	*			trans	73.8	149.5	166.5	-56.7	-172.9	23.8	0	0	116.1
684	N	24.9	Very low	27.2	Very low	123 Å²	123	127.5 Å²	127.5	66%	0.658	78%	0.779	S	S	*	*			cis	-167.6	162.6	-7.9	-101	-5.2	0	0	0	107.3
685	T	25.9	Very low	27	Very low	113 Å²	113	129 Å²	129	69%	0.693	78%	0.777	S	S	*	*			cis	-166	149.2	-5.2	15.7	0	0	0	0	110.8
686	S	23.4	Very low	26.9	Very low	106 Å²	106	126.1 Å²	126.1	74%	0.741	77%	0.769	S	S	*	*			trans	68.7	146.4	159.5	76.1	0	0	0	0	119
687	P	30.4	Very low	27.2	Very low	128 Å²	128	128.5 Å²	128.5	83%	0.831	77%	0.773	S	S	*	*				-121.7	169.3	87.6	38.3	-36.3	0	0	0	114.5
688	P	36.5	Very low	27.4	Very low	101 Å²	101	127.3 Å²	127.3	66%	0.656	77%	0.767	S	S	*	*			trans	-115.4	150.7	-171.6	39.9	-30.3	0	0	0	116.2
689	N	24.8	Very low	27.4	Very low	148 Å²	148	127.3 Å²	127.3	79%	0.791	77%	0.767	S	S	*	*			trans	62.7	154.5	140	-66.2	-6.8	0	0	0	120.1
690	I	28.4	Very low	27.6	Very low	152 Å²	152	128.9 Å²	128.9	78%	0.779	77%	0.768	S	S	*	*			cis	-146.8	165.4	3	-130	158.6	0	0	0	110.3
691	S	26.8	Very low	27.5	Very low	117 Å²	117	128.4 Å²	128.4	82%	0.818	77%	0.767	S	S	*	*			trans	-91.7	151.4	178.3	53.4	0	0	0	0	114
692	G	27.1	Very low	27.7	Very low	84 Å²	84	124.5 Å²	124.5	87%	0.866	76%	0.76	S	S	*	*			trans	159.9	129.9	168.2	0	0	0	0	0	113.2
693	G	26.9	Very low	27.8	Very low	75 Å²	75	125.6 Å²	125.6	77%	0.773	77%	0.772	S	S	*	*			trans	-151.3	154.1	176.7	0	0	0	0	0	113
694	K	25.6	Very low	27.9	Very low	197 Å²	197	121.6 Å²	121.6	86%	0.857	77%	0.772	S	S	*	*			trans	-170.5	125.4	159.9	-111.4	170.6	-176.3	-179.9	0	112.8
695	L	25.2	Very low	28	Very low	151 Å²	151	121.3 Å²	121.3	79%	0.791	78%	0.78	S	S	*	*			trans	38.4	123.6	134	-64.2	172.7	0	0	0	122.1
696	V	24.8	Very low	28.2	Very low	128 Å²	128	126.8 Å²	126.8	78%	0.776	79%	0.788	S	S	*	*			trans	76	123.5	140.5	-179.6	0	0	0	0	120.1
697	P	32	Very low	28.6	Very low	117 Å²	117	133.4 Å²	133.4	76%	0.76	80%	0.796	S	S	*	*			trans	-107.7	161.7	165.1	39.9	-32	0	0	0	113.9
698	P	32.8	Very low	28.5	Very low	112 Å²	112	133.5 Å²	133.5	73%	0.727	80%	0.797	S	S	*	*			trans	-134.9	161.5	163	38.2	-23.7	0	0	0	117.2
699	T	25.1	Very low	28.1	Very low	129 Å²	129	133.7 Å²	133.7	79%	0.791	80%	0.801	S	S	*	*			trans	76.8	92.2	149.2	43.2	0	0	0	0	124.3
700	V	30.1	Very low	28.5	Very low	124 Å²	124	134.6 Å²	134.6	75%	0.752	80%	0.804	S	S	*	*				19.5	150.8	129.5	-140.2	0	0	0	0	124.4
701	N	28.5	Very low	28.5	Very low	162 Å²	162	131.4 Å²	131.4	87%	0.866	80%	0.8	S	S	*	*			trans	103.4	135	157.5	-58.3	-51.8	0	0	0	116.7
702	G	29	Very low	28.7	Very low	58 Å²	58	132 Å²	132	60%	0.598	80%	0.801	S	S	*	*			cis	172.3	169.1	-5.7	0	0	0	0	0	114.3
703	T	28.3	Very low	28.6	Very low	158 Å²	158	134.9 Å²	134.9	97%	0.969	80%	0.802	S	S	*	*			trans	71.5	144	179.5	76.1	0	0	0	0	117.4
704	G	29.1	Very low	28.6	Very low	70 Å²	70	139.3 Å²	139.3	72%	0.722	80%	0.803	S	S	*	*			cis	170.5	139.4	-16.3	0	0	0	0	0	115.8
705	S	27.6	Very low	28.9	Very low	117 Å²	117	137.2 Å²	137.2	82%	0.818	80%	0.796	S	S	*	*			trans	70.1	139.4	170	-99.6	0	0	0	0	118.2
706	R	29.5	Very low	29	Very low	229 Å²	229	138.4 Å²	138.4	86%	0.864	80%	0.801	S	S	*	*			cis	-139.9	140.6	-2	-71.3	-173	172	167.2	-3.6	113.2
707	R	32.2	Very low	29.2	Very low	244 Å²	244	136 Å²	136	92%	0.921	79%	0.794	S	S	*	*			trans	1.5	127.4	163.5	-66.8	-177.3	177.9	177.7	-1.7	121.8
708	P	28.1	Very low	28.8	Very low	130 Å²	130	137.6 Å²	137.6	84%	0.844	80%	0.797	S	S	*	*			trans	-86.7	178.6	132	37.6	-33.1	0	0	0	111.6
709	S	27.8	Very low	28.5	Very low	106 Å²	106	138.5 Å²	138.5	74%	0.741	81%	0.806	S	S	*	*			trans	-105.7	119.9	178.4	55	0	0	0	0	113.7
710	I	32.7	Very low	28.6	Very low	166 Å²	166	137.4 Å²	137.4	85%	0.851	81%	0.81	S	S	*	*			trans	38.6	87	146.3	-46.9	173.8	0	0	0	114.5
711	A	29.3	Very low	28.5	Very low	85 Å²	85	135.8 Å²	135.8	70%	0.702	81%	0.81	S	S	*	*			cis	83.6	127.9	46.8	0	0	0	0	0	114.5
712	P	31.8	Very low	28.5	Very low	129 Å²	129	136.4 Å²	136.4	84%	0.838	81%	0.811	S	S	*	*			trans	-87	176.1	177.5	38	-36.9	0	0	0	112.4
713	V	25	Very low	28.4	Very low	146 Å²	146	141.2 Å²	141.2	89%	0.885	82%	0.822	S	S	*	*			trans	-127.4	138.6	170.3	179.7	0	0	0	0	109.1
714	Q	27.1	Very low	28.7	Very low	168 Å²	168	139.1 Å²	139.1	79%	0.785	81%	0.812	S	S	*	*			trans	-133.3	162.6	168.6	-172.8	165.1	6.7	0	0	109.9
715	E	31.6	Very low	28.5	Very low	153 Å²	153	142 Å²	142	72%	0.715	82%	0.819	S	S	*	*			trans	-61.3	160.1	-173.2	-47.1	118.7	131.2	0	0	115.3
716	I	27.4	Very low	28.5	Very low	175 Å²	175	143.5 Å²	143.5	90%	0.897	82%	0.818	S	S	*	*			trans	-156.3	151.8	135.8	-101.8	154.9	0	0	0	107.4
717	A	27.4	Very low	28.4	Very low	77 Å²	77	139.9 Å²	139.9	64%	0.636	82%	0.815	S	S	*	*			trans	-114.2	-173.2	-173.1	0	0	0	0	0	113.4
718	D	25	Very low	28.3	Very low	151 Å²	151	135.6 Å²	135.6	81%	0.807	81%	0.809	S	S	*	*			trans	69.3	100	159.3	-55.7	-21.6	0	0	0	120
719	S	25.3	Very low	28.2	Very low	131 Å²	131	133.8 Å²	133.8	92%	0.916	80%	0.8	S	S	*	*				-172.8	147.3	104.4	-77.8	0	0	0	0	111.8
720	A	28.6	Very low	28.2	Very low	106 Å²	106	136.9 Å²	136.9	88%	0.876	81%	0.808	S	S	*	*			trans	-98.5	138.4	-170.8	0	0	0	0	0	114.4
721	A	27.9	Very low	28.1	Very low	91 Å²	91	136.1 Å²	136.1	75%	0.752	80%	0.801	S	S	*	*			trans	-166.9	156	149.7	0	0	0	0	0	111.4
722	I	28.5	Very low	28.3	Very low	174 Å²	174	137.6 Å²	137.6	89%	0.892	81%	0.806	S	S	*	*			trans	86.9	102.1	172.3	-52.6	169.6	0	0	0	116
723	L	25.8	Very low	28.2	Very low	160 Å²	160	140.1 Å²	140.1	84%	0.838	81%	0.807	S	S	*	*			trans	-86.1	173.7	159.1	-74.2	155.3	0	0	0	110
724	P	34.2	Very low	28.5	Very low	114 Å²	114	138.5 Å²	138.5	74%	0.74	79%	0.793	S	S	*	*			cis	-129.1	166.2	-41.5	36.8	-23.5	0	0	0	111.2
725	C	26.2	Very low	28.8	Very low	131 Å²	131	138.1 Å²	138.1	89%	0.885	80%	0.796	S	S	*	*			trans	-158.6	136.6	155.4	-134	0	0	0	0	110.7
726	D	27.5	Very low	28.7	Very low	147 Å²	147	135.7 Å²	135.7	79%	0.786	79%	0.792	S	S	*	*			trans	-69.6	147	173.3	-53.2	-86.3	0	0	0	111.4
727	L	27.5	Very low	28.9	Very low	154 Å²	154	133.6 Å²	133.6	81%	0.806	79%	0.787	S	S	*	*				178.6	139.9	110.8	-95.2	163.2	0	0	0	112.8
728	L	29.1	Very low	28.8	Very low	153 Å²	153	139.3 Å²	139.3	80%	0.801	80%	0.798	S	S	*	*			trans	60.5	100.1	162.3	-56.5	179.7	0	0	0	117.8
729	S	25.8	Very low	29.1	Very low	92 Å²	92	137.5 Å²	137.5	64%	0.643	79%	0.793	S	S	*	*			trans	-66.6	128.1	145.1	42.8	0	0	0	0	110.5	Q731	S729-Q731 PolarHBondContact O-N 3.38Å
730	D	27.9	Very low	29.3	Very low	171 Å²	171	137.1 Å²	137.1	91%	0.914	78%	0.781	S	S	*	*			trans	-72.4	115.5	156.9	-85.2	-28	0	0	0	108.1
731	Q	31.7	Very low	29.4	Very low	151 Å²	151	141.5 Å²	141.5	71%	0.706	78%	0.783	S	S	*	*			trans	-81.7	142.4	-176.8	-64.8	172.9	-13.3	0	0	110.2	S729 E733	S729-Q731 PolarHBondContact O-N 3.38Å; Q731-E733 PolarHBondContact O-N 2.96Å
732	S	32.6	Very low	29.6	Very low	116 Å²	116	146.3 Å²	146.3	81%	0.811	79%	0.787	S	S	*	*			trans	-65.6	117.5	166.3	52.6	0	0	0	0	109.8	D734	S732-D734 PolarHBondContact O-N 3.35Å
733	E	30.1	Very low	29.6	Very low	182 Å²	182	141.6 Å²	141.6	85%	0.85	78%	0.781	S	S	*	*	S	Bend	trans	-65.4	96.9	-179.3	-66.9	-170.3	141	0	0	112.8	Q731	Q731-E733 PolarHBondContact O-N 2.96Å
734	D	32.2	Very low	29.9	Very low	111 Å²	111	138.2 Å²	138.2	59%	0.594	77%	0.771	S	S	*	*	S	Bend	trans	-167.9	41.9	147.1	-108.5	-20.7	0	0	0	113.2	S732 K829	S732-D734 PolarHBondContact O-N 3.35Å; D734-K829 WeakPolarHBondContact OD1-CE 3.12Å; D734-K829 IonicContact OD1-NZ 3.2Å; D734-K829 PolarHBondContact OD1-NZ 3.32Å; D734-K829 WeakPolarHBondContact OD2-CE 3.37Å; D734-K829 IonicContact OD2-NZ 2.63Å; D734-K829 PolarHBondContact OD2-NZ 2.96Å
735	D	33.5	Very low	29.9	Very low	160 Å²	160	138.1 Å²	138.1	86%	0.856	77%	0.773	S	S	*	*			trans	-147.3	38.1	172.7	-111	-27.3	0	0	0	113.4
736	T	28.6	Very low	30.7	Very low	103 Å²	103	140.5 Å²	140.5	63%	0.632	77%	0.768	S	S	*	*			trans	-101.2	110.8	172.3	45.7	0	0	0	0	111.5	F738	T736-F738 PolarHBondContact O-N 3.23Å; T736-F738 VanDerWaalsContact O-N 3.07Å
737	V	31.4	Very low	32.4	Very low	131 Å²	131	137.9 Å²	137.9	79%	0.794	76%	0.758	S	S	*	*			trans	-69.3	103.9	179	176.9	0	0	0	0	110.2	T739	V737-T739 HydrophobicContact CG1-CG2 4.25Å
738	F	26.2	Very low	34.8	Very low	196 Å²	196	137.5 Å²	137.5	86%	0.86	75%	0.752	S	S	*	*			trans	-82.3	109.9	161.7	-94.6	-88.1	0	0	0	110.1	T736	T736-F738 PolarHBondContact O-N 3.23Å; T736-F738 VanDerWaalsContact O-N 3.07Å
739	T	30.8	Very low	37.5	Very low	113 Å²	113	132 Å²	132	69%	0.693	72%	0.721	S	S	*	*			trans	-77.2	147.3	166.9	47.7	0	0	0	0	111.5	V737	V737-T739 HydrophobicContact CG1-CG2 4.25Å
740	D	29.8	Very low	40.5	Very low	124 Å²	124	131.1 Å²	131.1	66%	0.663	71%	0.712	S	S	*	*			trans	65.3	80.1	173.2	-70.5	-38.3	0	0	0	117.7
741	E	30.1	Very low	43.4	Very low	197 Å²	197	128.5 Å²	128.5	92%	0.921	69%	0.692	S	S	*	*				-130.5	140	100.2	-79.9	-145.4	135.8	0	0	110.5
742	K	32.5	Very low	46	Very low	193 Å²	193	122.1 Å²	122.1	84%	0.839	67%	0.667	S	S	*	*			trans	-93.8	102.8	-173.9	-68	173.1	-177.5	168.8	0	110.5
743	G	28.7	Very low	48.7	Very low	74 Å²	74	123.1 Å²	123.1	76%	0.763	65%	0.653	S	S	*	*			trans	-163.2	-5	-175.3	0	0	0	0	0	120.7
744	S	31.8	Very low	51.4	Low	90 Å²	90	115.2 Å²	115.2	63%	0.629	62%	0.618	S	S	*	*			trans	-164.2	148.3	169	43.2	0	0	0	0	113.1	F746	S744-F746 PolarHBondContact O-N 3.13Å
745	S	35.3	Very low	53.9	Low	112 Å²	112	114.3 Å²	114.3	78%	0.783	62%	0.618	S	S	*	*			trans	-76.1	107.1	168.3	51.4	0	0	0	0	109.6	T747	S745-T747 PolarHBondContact O-N 2.83Å
746	F	42.8	Very low	56.4	Low	180 Å²	180	109.3 Å²	109.3	79%	0.789	59%	0.591	S	S	*	*			trans	-67.5	113.4	173.4	-84.1	-100.5	0	0	0	109.9	S744 E748	S744-F746 PolarHBondContact O-N 3.13Å; F746-E748 PolarHBondContact O-N 3.47Å
747	T	62.6	Low	59.1	Low	93 Å²	93	107.5 Å²	107.5	57%	0.571	58%	0.583	S	S	*	*			trans	-74.2	120.1	168.8	26	0	0	0	0	109.8	S745	S745-T747 PolarHBondContact O-N 2.83Å
748	E	77.9	Confident	61.6	Low	146 Å²	146	102.4 Å²	102.4	68%	0.682	55%	0.553	S	S	*	*			trans	-78.4	137.3	179.1	-164.7	175.7	173.9	0	0	111.4	F746	F746-E748 PolarHBondContact O-N 3.47Å
749	Y	86.2	Confident	64.5	Low	38 Å²	38	93.4 Å²	93.4	15%	0.149	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	112.3	-177.3	-58.8	-26.4	0	0	0	111.6	L769 L770 R828 L831 P854 M855	Y749-L769 CarbonylContact C-O 3.54Å; Y749-L769 WeakPolarHBondContact CA-O 3.42Å; Y749-L770 HydrophobicContact CD1-CD2 4.16Å; Y749-L770 HydrophobicContact CE1-CD2 3.96Å; Y749-R828 HydrophobicContact CD2-CG 4.41Å; Y749-R828 PolarHBondContact O-NH2 2.79Å; Y749-L831 HydrophobicContact CD2-CD1 4.42Å; Y749-L831 HydrophobicContact CE2-CD1 4.37Å; Y749-P854 HydrophobicContact CD1-CB 3.88Å; Y749-P854 HydrophobicContact CD1-CG 4.38Å; Y749-P854 HydrophobicContact CE1-CB 3.45Å; Y749-P854 VanDerWaalsContact CE1-CB 3.45Å; Y749-P854 HydrophobicContact CE1-CG 4.34Å; Y749-P854 HydrophobicContact CE2-CB 4.35Å; Y749-P854 HydrophobicContact CG-CB 4.5Å; Y749-M855 PolarHBondContact OH-SD 2.92Å; Y749-M855 VanDerWaalsContact OH-SD 3.39Å
750	V	87.9	Confident	67.1	Low	73 Å²	73	93.4 Å²	93.4	44%	0.442	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	137.7	178.4	-176.4	0	0	0	0	109.4	L769 A771	V750-L769 PolarHBondContact N-O 3.09Å; V750-L769 PolarHBondContact O-N 2.94Å; V750-A771 HydrophobicContact CG2-CB 4.05Å
751	K	87.9	Confident	69.3	Low	116 Å²	116	88.7 Å²	88.7	50%	0.504	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	125	170.2	-70.9	-179.4	178.1	178.4	0	109.2	C767	K751-C767 WeakPolarHBondContact CA-O 3.38Å
752	G	87.3	Confident	71.7	Confident	17 Å²	17	80.5 Å²	80.5	18%	0.175	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.6	176.8	-179.8	0	0	0	0	0	113.5	C767	G752-C767 PolarHBondContact N-O 2.91Å; G752-C767 PolarHBondContact O-N 3.26Å
753	Y	88.4	Confident	73.8	Confident	136 Å²	136	72.5 Å²	72.5	53%	0.533	42%	0.421	S	S	.	.			trans	-85.2	134.9	170.8	-61.5	-74.4	0	0	0	109.6	P764 T765 L766 L769	Y753-P764 HydrophobicContact CD1-CB 3.85Å; Y753-P764 HydrophobicContact CE1-CB 4.19Å; Y753-P764 VanDerWaalsContact CE1-O 3.27Å; Y753-P764 WeakPolarHBondContact CE1-O 3.41Å; Y753-T765 WeakPolarHBondContact CD1-O 3.37Å; Y753-L766 HydrophobicContact CD1-CD2 4.05Å; Y753-L766 HydrophobicContact CD1-CG 4.32Å; Y753-L766 HydrophobicContact CD2-CD2 3.87Å; Y753-L766 HydrophobicContact CE1-CB 4.49Å; Y753-L766 HydrophobicContact CE1-CD2 3.75Å; Y753-L766 HydrophobicContact CE1-CG 3.69Å; Y753-L766 HydrophobicContact CE2-CD2 3.55Å; Y753-L766 HydrophobicContact CE2-CG 4.23Å; Y753-L766 HydrophobicContact CG-CD2 4.11Å; Y753-L766 VanDerWaalsContact CZ-CD2 3.49Å; Y753-L769 WeakPolarHBondContact O-CD1 3.44Å
754	P	87.3	Confident	76.3	Confident	16 Å²	16	73.4 Å²	73.4	10%	0.104	41%	0.413	C	S	.	.			trans	-61.7	130.1	176.8	24.7	-33.2	0	0	0	110.4	L769 Y815 F853	P754-L769 HydrophobicContact CB-CD2 4.28Å; P754-Y815 WeakPolarHBondContact CG-OH 3.45Å; P754-F853 HydrophobicContact CB-CE1 4.32Å; P754-F853 HydrophobicContact CB-CZ 4.09Å; P754-F853 HydrophobicContact CG-CZ 4.27Å
755	P	85	Confident	78.7	Confident	92 Å²	92	69.2 Å²	69.2	60%	0.597	38%	0.384	S	S	*	.	S	Bend	trans	-74.8	-30.3	-170.1	28.1	-35.7	0	0	0	113.8
756	N	85.2	Confident	81.1	Confident	55 Å²	55	65.7 Å²	65.7	29%	0.294	36%	0.357	S	S	.	.			trans	-108	101.1	179.8	-65.9	46.3	0	0	0	108.7	E848 A849	N756-E848 PolarHBondContact ND2-OE2 2.99Å; N756-A849 VanDerWaalsContact O-CB 3.3Å; N756-A849 WeakPolarHBondContact O-CB 3.35Å
757	S	86.4	Confident	83.3	Confident	65 Å²	65	57.1 Å²	57.1	46%	0.455	32%	0.319	S	S	.	.			trans	-80.5	126.1	166	52.9	0	0	0	0	109.6	Y759 S762	S757-Y759 VanDerWaalsContact C-N 3.26Å; S757-Y759 PolarHBondContact O-N 2.95Å; S757-S762 WeakPolarHBondContact CB-OG 3.36Å
758	P	84.6	Confident	84.7	Confident	25 Å²	25	52.9 Å²	52.9	16%	0.162	29%	0.292	C	S	.	.	S	Bend	trans	-76.4	-10.9	-175.2	29	-32.3	0	0	0	114	N812 Y815 A849	P758-N812 WeakPolarHBondContact CB-OD1 3.33Å; P758-Y815 HydrophobicContact CG-CD1 3.98Å; P758-Y815 HydrophobicContact CG-CD2 3.7Å; P758-Y815 HydrophobicContact CG-CE1 4.45Å; P758-Y815 HydrophobicContact CG-CE2 4.19Å; P758-Y815 HydrophobicContact CG-CG 3.56Å; P758-A849 HydrophobicContact CB-CB 4.07Å; P758-A849 HydrophobicContact CG-CB 4.03Å
759	Y	86.3	Confident	85.4	Confident	7 Å²	7	46.8 Å²	46.8	3%	0.027	26%	0.264	C	S	.	.	S	Bend	trans	-143.1	152.6	175.2	69	-89.1	0	0	0	112.2	P491 E508 S757 N812 Y815 N816	P491-Y759 HydrophobicContact CB-CD1 4.1Å; P491-Y759 HydrophobicContact CB-CD2 3.94Å; P491-Y759 HydrophobicContact CB-CE1 3.84Å; P491-Y759 HydrophobicContact CB-CE2 3.65Å; P491-Y759 HydrophobicContact CB-CG 4.15Å; P491-Y759 HydrophobicContact CG-CD1 4.17Å; P491-Y759 HydrophobicContact CG-CE1 4.18Å; P491-Y759 HydrophobicContact CG-CG 4.42Å; P491-Y759 WeakPolarHBondContact O-CD2 3.34Å; E508-Y759 PolarHBondContact OE1-OH 2.54Å; S757-Y759 VanDerWaalsContact C-N 3.26Å; S757-Y759 PolarHBondContact O-N 2.95Å; Y759-N812 HydrophobicContact CD1-CB 4.42Å; Y759-Y815 HydrophobicContact CE1-CD1 4.42Å; Y759-N816 PolarHBondContact OH-ND2 2.83Å; Y759-N816 PolarHBondContact OH-OD1 3.08Å
760	I	84.3	Confident	85.5	Confident	113 Å²	113	46.8 Å²	46.8	58%	0.579	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	130.9	179.6	-56.2	176.1	0	0	0	109.7	F495	F495-I760 HydrophobicContact CB-CB 4.42Å; F495-I760 HydrophobicContact CB-CG2 4.32Å; F495-I760 HydrophobicContact CD1-CG2 4.17Å; F495-I760 HydrophobicContact CD2-CG2 3.56Å; F495-I760 HydrophobicContact CE1-CG2 4.41Å; F495-I760 HydrophobicContact CE2-CG2 3.83Å; F495-I760 HydrophobicContact CG-CB 4.29Å; F495-I760 HydrophobicContact CG-CG2 3.74Å; F495-I760 HydrophobicContact CZ-CG2 4.25Å
761	G	76.7	Confident	85.4	Confident	25 Å²	25	46.8 Å²	46.8	26%	0.258	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.6	11.6	178	0	0	0	0	0	115.3
762	S	81.6	Confident	85.2	Confident	25 Å²	25	49.3 Å²	49.3	18%	0.175	29%	0.288	C	S	.	.			trans	-57.3	144.1	160.2	59.4	0	0	0	0	111.3	S757	S757-S762 WeakPolarHBondContact CB-OG 3.36Å
763	S	75.8	Confident	85.2	Confident	24 Å²	24	53.1 Å²	53.1	17%	0.168	30%	0.3	C	S	.	.			trans	-78.7	125.5	172.7	39.7	0	0	0	0	110.8	T765 L998 D999	S763-T765 PolarHBondContact O-N 2.67Å; S763-L998 WeakPolarHBondContact CB-O 3.26Å; S763-L998 PolarHBondContact OG-O 3.31Å; S763-D999 WeakPolarHBondContact CB-OD1 3.35Å
764	P	80.1	Confident	85.1	Confident	93 Å²	93	47.7 Å²	47.7	60%	0.604	28%	0.283	S	S	*	.			trans	-78.4	103.3	178.7	30.3	-33	0	0	0	110.6	Y753	Y753-P764 HydrophobicContact CD1-CB 3.85Å; Y753-P764 HydrophobicContact CE1-CB 4.19Å; Y753-P764 VanDerWaalsContact CE1-O 3.27Å; Y753-P764 WeakPolarHBondContact CE1-O 3.41Å
765	T	83	Confident	85.2	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.012	30%	0.296	C	S	.	.			trans	-94.8	144.4	172.2	57.3	0	0	0	0	111	Y753 S763 C767 V819 T1000	Y753-T765 WeakPolarHBondContact CD1-O 3.37Å; S763-T765 PolarHBondContact O-N 2.67Å; T765-C767 PolarHBondContact O-N 3.07Å; T765-C767 PolarHBondContact OG1-SG 3.31Å; T765-V819 HydrophobicContact CG2-CG1 3.89Å; T765-V819 WeakPolarHBondContact OG1-CG1 3.29Å; T765-T1000 HydrophobicContact CG2-CG2 4.1Å
766	L	86.3	Confident	85.4	Confident	39 Å²	39	49 Å²	49	20%	0.204	28%	0.284	C	S	.	.			trans	-71	125	168.4	-73.9	171.2	0	0	0	109.9	Y753 A823 Y824 L1218	Y753-L766 HydrophobicContact CD1-CD2 4.05Å; Y753-L766 HydrophobicContact CD1-CG 4.32Å; Y753-L766 HydrophobicContact CD2-CD2 3.87Å; Y753-L766 HydrophobicContact CE1-CB 4.49Å; Y753-L766 HydrophobicContact CE1-CD2 3.75Å; Y753-L766 HydrophobicContact CE1-CG 3.69Å; Y753-L766 HydrophobicContact CE2-CD2 3.55Å; Y753-L766 HydrophobicContact CE2-CG 4.23Å; Y753-L766 HydrophobicContact CG-CD2 4.11Å; Y753-L766 VanDerWaalsContact CZ-CD2 3.49Å; L766-A823 WeakPolarHBondContact O-CA 3.11Å; L766-Y824 HydrophobicContact CB-CD1 3.58Å; L766-Y824 HydrophobicContact CB-CE1 4.39Å; L766-Y824 HydrophobicContact CB-CG 3.93Å; L766-Y824 WeakPolarHBondContact O-CD1 2.96Å; L766-Y824 PolarHBondContact O-N 2.98Å; L766-L1218 HydrophobicContact CD1-CD1 3.83Å
767	C	89.3	Confident	85.5	Confident	0 Å²	0	49 Å²	49	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	163.4	178.1	-64.8	0	0	0	0	111.2	K751 G752 T765 L769 R822 F853	K751-C767 WeakPolarHBondContact CA-O 3.38Å; G752-C767 PolarHBondContact N-O 2.91Å; G752-C767 PolarHBondContact O-N 3.26Å; T765-C767 PolarHBondContact O-N 3.07Å; T765-C767 PolarHBondContact OG1-SG 3.31Å; C767-L769 HydrophobicContact CB-CD2 4.09Å; C767-R822 CarbonylContact C-O 3.58Å; C767-R822 VanDerWaalsContact CA-O 3.23Å; C767-R822 WeakPolarHBondContact CA-O 3.49Å; C767-R822 HydrophobicContact CB-CB 4.49Å; C767-R822 WeakPolarHBondContact CB-O 3.28Å; C767-F853 HydrophobicContact CB-CD1 4.34Å; C767-F853 HydrophobicContact CB-CE1 3.86Å
768	H	91.1	Very high	85.5	Confident	3 Å²	3	46.7 Å²	46.7	1%	0.014	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	124.8	160.1	-55.3	-81.7	0	0	0	108.1	R822 A823 R826 L831 P854	H768-R822 PolarHBondContact CD2-O 3.26Å; H768-R822 PolarHBondContact N-O 2.71Å; H768-A823 PolarHBondContact CD2-O 3.18Å; H768-A823 PolarHBondContact NE2-O 2.89Å; H768-R826 PolarHBondContact NE2-O 2.9Å; H768-L831 HydrophobicContact CB-CD1 4.42Å; H768-P854 HydrophobicContact CB-CG 4.39Å; H768-P854 WeakPolarHBondContact O-CD 3.26Å
769	L	92.1	Very high	85.7	Confident	18 Å²	18	45.9 Å²	45.9	9%	0.094	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	158.8	-178	-57.3	177.8	0	0	0	110.3	Y749 V750 Y753 P754 C767 C852 F853	Y749-L769 CarbonylContact C-O 3.54Å; Y749-L769 WeakPolarHBondContact CA-O 3.42Å; V750-L769 PolarHBondContact N-O 3.09Å; V750-L769 PolarHBondContact O-N 2.94Å; Y753-L769 WeakPolarHBondContact O-CD1 3.44Å; P754-L769 HydrophobicContact CB-CD2 4.28Å; C767-L769 HydrophobicContact CB-CD2 4.09Å; L769-C852 VanDerWaalsContact CA-O 3.3Å; L769-C852 WeakPolarHBondContact CA-O 3.28Å; L769-C852 HydrophobicContact CD2-CB 4.27Å; L769-F853 HydrophobicContact CD2-CD1 3.84Å; L769-F853 HydrophobicContact CD2-CE1 3.94Å
770	L	89.2	Confident	85.9	Confident	39 Å²	39	49 Å²	49	20%	0.204	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	142.1	168.5	-62.9	171.8	0	0	0	110.3	Y749 E772 A774 C852 P854	Y749-L770 HydrophobicContact CD1-CD2 4.16Å; Y749-L770 HydrophobicContact CE1-CD2 3.96Å; L770-E772 VanDerWaalsContact C-N 3.29Å; L770-E772 VanDerWaalsContact CB-O 3.25Å; L770-E772 WeakPolarHBondContact CB-O 3.16Å; L770-E772 PolarHBondContact O-N 2.98Å; L770-A774 HydrophobicContact CD1-CB 4Å; L770-C852 PolarHBondContact N-O 2.85Å; L770-P854 HydrophobicContact CD2-CB 3.85Å; L770-P854 HydrophobicContact CG-CB 4.31Å
771	A	84.8	Confident	85.9	Confident	72 Å²	72	43.7 Å²	43.7	60%	0.595	25%	0.25	S	C	*	.	S	Bend	trans	-64.7	-32.7	175.6	0	0	0	0	0	112.9	V750	V750-A771 HydrophobicContact CG2-CB 4.05Å
772	E	84.8	Confident	86	Confident	169 Å²	169	44.6 Å²	44.6	79%	0.79	25%	0.249	S	C	*	.	S	Bend	trans	-118.3	140	171.2	-64.5	-172.7	163.2	0	0	110.1	L770 A774	L770-E772 VanDerWaalsContact C-N 3.29Å; L770-E772 VanDerWaalsContact CB-O 3.25Å; L770-E772 WeakPolarHBondContact CB-O 3.16Å; L770-E772 PolarHBondContact O-N 2.98Å; E772-A774 PolarHBondContact O-N 2.89Å
773	K	86.9	Confident	86	Confident	98 Å²	98	48.7 Å²	48.7	43%	0.426	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-69.2	120.9	180	170.6	156.4	163	147.2	0	110.3	E848 C851	K773-E848 PolarHBondContact NZ-O 2.86Å; K773-C851 VanDerWaalsContact CD-SG 3.56Å; K773-C851 WeakPolarHBondContact CE-SG 3.46Å; K773-C851 HydrophobicContact CG-CB 4.31Å; K773-C851 VanDerWaalsContact CG-SG 3.58Å; K773-C851 PolarHBondContact NZ-SG 3.4Å; K773-C851 VanDerWaalsContact NZ-SG 3.42Å
774	A	86	Confident	86	Confident	22 Å²	22	49.8 Å²	49.8	18%	0.182	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-65.9	134.5	-177.7	0	0	0	0	0	111.5	L770 E772 L779 C851	L770-A774 HydrophobicContact CD1-CB 4Å; E772-A774 PolarHBondContact O-N 2.89Å; A774-L779 HydrophobicContact CB-CD1 3.79Å; A774-C851 PolarHBondContact N-O 2.96Å; A774-C851 WeakPolarHBondContact O-CB 3.17Å
775	P	89.3	Confident	86.1	Confident	59 Å²	59	46.6 Å²	46.6	38%	0.383	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-73	143.2	177.6	30.3	-34	0	0	0	110.3	C777 C778 L779	P775-C777 PolarHBondContact O-N 2.94Å; P775-C778 HydrophobicContact CG-CB 4.34Å; P775-C778 WeakPolarHBondContact O-CB 3.44Å; P775-C778 PolarHBondContact O-N 3.08Å; P775-L779 WeakPolarHBondContact O-CD1 3.43Å
776	F	89.6	Confident	85.9	Confident	76 Å²	76	55.5 Å²	55.5	33%	0.333	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-51.7	-33.9	-171	-53	-41	0	0	0	114.6	C778 L779 L847 E848	F776-C778 PolarHBondContact O-N 3Å; F776-L779 PolarHBondContact O-N 3.47Å; F776-L779 VanDerWaalsContact O-N 3.15Å; F776-L847 HydrophobicContact CB-CD1 4.48Å; F776-L847 HydrophobicContact CD1-CB 3.79Å; F776-L847 HydrophobicContact CE1-CB 3.91Å; F776-L847 HydrophobicContact CG-CB 4.44Å; F776-L847 HydrophobicContact CG-CD1 4.47Å; F776-E848 HydrophobicContact CE1-CG 4.01Å; F776-E848 HydrophobicContact CZ-CG 3.66Å
777	C	87.2	Confident	85.5	Confident	56 Å²	56	59.3 Å²	59.3	38%	0.378	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-63.7	-21.3	176.7	63	0	0	0	0	114.9	P775 C785 H787	P775-C777 PolarHBondContact O-N 2.94Å; C777-C785 HydrophobicContact CB-CB 3.84Å; C777-H787 PolarHBondContact SG-ND1 3.2Å; C777-H787 VanDerWaalsContact SG-ND1 3.39Å
778	C	87.1	Confident	85	Confident	16 Å²	16	62.1 Å²	62.1	11%	0.108	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-86.2	-11.6	176.8	-66.8	0	0	0	0	113.4	P775 F776 C785 H787	P775-C778 HydrophobicContact CG-CB 4.34Å; P775-C778 WeakPolarHBondContact O-CB 3.44Å; P775-C778 PolarHBondContact O-N 3.08Å; F776-C778 PolarHBondContact O-N 3Å; C778-C785 VanDerWaalsContact SG-SG 3.69Å; C778-H787 VanDerWaalsContact SG-CB 3.57Å; C778-H787 PolarHBondContact SG-ND1 3.2Å; C778-H787 VanDerWaalsContact SG-ND1 3.44Å
779	L	88.3	Confident	84.4	Confident	7 Å²	7	67.1 Å²	67.1	4%	0.037	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-22.2	176.2	-76.9	66.3	0	0	0	111.4	A774 P775 F776 L847 I850 C851 Y857 Y858	A774-L779 HydrophobicContact CB-CD1 3.79Å; P775-L779 WeakPolarHBondContact O-CD1 3.43Å; F776-L779 PolarHBondContact O-N 3.47Å; F776-L779 VanDerWaalsContact O-N 3.15Å; L779-L847 HydrophobicContact CD2-CD2 4.12Å; L779-I850 HydrophobicContact CD2-CG2 3.67Å; L779-C851 HydrophobicContact CD1-CB 4.27Å; L779-C851 HydrophobicContact CD2-CB 4.06Å; L779-Y857 CarbonylContact O-C 3.24Å; L779-Y857 WeakPolarHBondContact O-CA 3.35Å; L779-Y857 WeakPolarHBondContact O-CB 3.49Å; L779-Y858 HydrophobicContact CB-CD1 3.95Å; L779-Y858 HydrophobicContact CB-CE1 4Å; L779-Y858 WeakPolarHBondContact O-CD1 3.35Å; L779-Y858 PolarHBondContact O-N 3.3Å
780	R	90.1	Very high	83.9	Confident	74 Å²	74	70 Å²	70	28%	0.279	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-83.5	131.5	176.8	-172	177.3	-179.4	171.1	0.6	110.2	D782 Q783 Y858	R780-D782 IonicContact CZ-OD2 2.77Å; R780-D782 IonicContact NE-OD2 2.67Å; R780-D782 PolarHBondContact NE-OD2 3.42Å; R780-D782 IonicContact NH2-OD2 2.78Å; R780-D782 PolarHBondContact NH2-OD2 3.47Å; R780-Q783 VanDerWaalsContact CZ-OE1 3.29Å; R780-Q783 VanDerWaalsContact NH2-CD 3.31Å; R780-Y858 WeakPolarHBondContact CA-O 3.37Å; R780-Y858 HydrophobicContact CB-CE1 3.83Å; R780-Y858 HydrophobicContact CB-CE2 4.47Å; R780-Y858 HydrophobicContact CG-CE2 4.35Å
781	L	85.1	Confident	83.2	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	40%	0.4	C	S	.	.	S	Bend	trans	-86.8	-46.1	173.9	-63.9	175.1	0	0	0	112.3	Q783 E791 A793 Y796 V835 Y857 Y858 M859	L781-Q783 PolarHBondContact O-N 3.46Å; L781-E791 CarbonylContact O-C 3.52Å; L781-E791 WeakPolarHBondContact O-CA 3.4Å; L781-E791 VanDerWaalsContact O-O 3.11Å; L781-A793 HydrophobicContact CD1-CB 4.05Å; L781-Y796 HydrophobicContact CD2-CD2 3.82Å; L781-Y796 HydrophobicContact CD2-CE2 3.36Å; L781-V835 HydrophobicContact CD1-CG1 4.01Å; L781-V835 HydrophobicContact CD1-CG2 3.75Å; L781-Y857 HydrophobicContact CD2-CD1 3.83Å; L781-Y857 HydrophobicContact CD2-CE1 4.44Å; L781-Y857 HydrophobicContact CD2-CG 3.95Å; L781-Y857 HydrophobicContact CG-CD1 4.47Å; L781-Y857 HydrophobicContact CG-CG 4.3Å; L781-Y858 PolarHBondContact N-O 3.42Å; L781-Y858 VanDerWaalsContact N-O 3.08Å; L781-M859 HydrophobicContact CB-CE 4.02Å
782	D	78.7	Confident	82.9	Confident	44 Å²	44	72.1 Å²	72.1	24%	0.235	38%	0.38	C	S	.	.	S	Bend	trans	-62	-8.8	-172.2	143.4	97.9	0	0	0	115.4	R780 M859	R780-D782 IonicContact CZ-OD2 2.77Å; R780-D782 IonicContact NE-OD2 2.67Å; R780-D782 PolarHBondContact NE-OD2 3.42Å; R780-D782 IonicContact NH2-OD2 2.78Å; R780-D782 PolarHBondContact NH2-OD2 3.47Å; D782-M859 HydrophobicContact CB-CE 3.8Å; D782-M859 HydrophobicContact CB-CG 4.08Å
783	Q	81.1	Confident	82.8	Confident	112 Å²	112	64.1 Å²	64.1	52%	0.523	34%	0.342	S	S	.	.	S	Bend	trans	-139.5	112.4	171.5	-69	-174.5	-15	0	0	110.9	R780 L781	R780-Q783 VanDerWaalsContact CZ-OE1 3.29Å; R780-Q783 VanDerWaalsContact NH2-CD 3.31Å; L781-Q783 PolarHBondContact O-N 3.46Å
784	G	75.4	Confident	82.4	Confident	46 Å²	46	62.7 Å²	62.7	47%	0.474	34%	0.336	S	S	.	.			trans	-58.6	138.8	172.1	0	0	0	0	0	111.9	N788	G784-N788 WeakPolarHBondContact CA-O 3.11Å
785	C	83.3	Confident	82.2	Confident	26 Å²	26	64 Å²	64	18%	0.176	35%	0.346	C	S	.	.			trans	-116.3	172.1	-177	68.8	0	0	0	0	111.7	C777 C778 H787 N788	C777-C785 HydrophobicContact CB-CB 3.84Å; C778-C785 VanDerWaalsContact SG-SG 3.69Å; C785-H787 PolarHBondContact O-N 2.92Å; C785-N788 PolarHBondContact N-O 2.97Å; C785-N788 CarbonylContact O-C 3.55Å; C785-N788 VanDerWaalsContact O-C 3.24Å; C785-N788 PolarHBondContact O-N 3.23Å; C785-N788 VanDerWaalsContact O-N 3.14Å; C785-N788 VanDerWaalsContact O-O 3.1Å; C785-N788 PolarHBondContact SG-N 3.13Å
786	M	77.8	Confident	81.9	Confident	189 Å²	189	63 Å²	63	93%	0.931	34%	0.335	S	S	*	.	S	Bend	trans	-60.3	-16.5	179.2	-67.3	-60.4	-61.9	0	0	114.4
787	H	79.2	Confident	81.4	Confident	119 Å²	119	62 Å²	62	55%	0.551	35%	0.347	S	S	*	.	S	Bend	trans	-93.9	-32.9	176.6	-46.2	117.4	0	0	0	113.1	C777 C778 C785	C777-H787 PolarHBondContact SG-ND1 3.2Å; C777-H787 VanDerWaalsContact SG-ND1 3.39Å; C778-H787 VanDerWaalsContact SG-CB 3.57Å; C778-H787 PolarHBondContact SG-ND1 3.2Å; C778-H787 VanDerWaalsContact SG-ND1 3.44Å; C785-H787 PolarHBondContact O-N 2.92Å
788	N	78.3	Confident	81.3	Confident	60 Å²	60	60.9 Å²	60.9	32%	0.321	34%	0.336	S	S	.	.			trans	-145.9	114.1	-179.1	-85.9	-32.1	0	0	0	109.4	G784 C785 F790	G784-N788 WeakPolarHBondContact CA-O 3.11Å; C785-N788 PolarHBondContact N-O 2.97Å; C785-N788 CarbonylContact O-C 3.55Å; C785-N788 VanDerWaalsContact O-C 3.24Å; C785-N788 PolarHBondContact O-N 3.23Å; C785-N788 VanDerWaalsContact O-N 3.14Å; C785-N788 VanDerWaalsContact O-O 3.1Å; C785-N788 PolarHBondContact SG-N 3.13Å; N788-F790 HydrophobicContact CB-CD2 4.45Å; N788-F790 PolarHBondContact O-N 3.35Å
789	S	79.3	Confident	81	Confident	107 Å²	107	68.7 Å²	68.7	75%	0.748	37%	0.368	S	S	*	.			trans	-87.5	32.5	-179.3	67.4	0	0	0	0	113.6
790	F	79.8	Confident	80.9	Confident	79 Å²	79	70.7 Å²	70.7	35%	0.346	38%	0.378	S	S	.	.			trans	-101.4	122	-177.1	-62.6	-45.4	0	0	0	110.8	N788 A795 Y796	N788-F790 HydrophobicContact CB-CD2 4.45Å; N788-F790 PolarHBondContact O-N 3.35Å; F790-A795 HydrophobicContact CB-CB 4.07Å; F790-A795 HydrophobicContact CD1-CB 3.67Å; F790-A795 HydrophobicContact CE1-CB 4.39Å; F790-A795 HydrophobicContact CG-CB 4.04Å; F790-Y796 HydrophobicContact CB-CD2 3.82Å; F790-Y796 HydrophobicContact CB-CE1 4.47Å; F790-Y796 HydrophobicContact CB-CE2 3.37Å; F790-Y796 AromaticContact CD2-CD1 3.94Å; F790-Y796 HydrophobicContact CD2-CD1 3.94Å; F790-Y796 HydrophobicContact CD2-CD2 4.27Å; F790-Y796 AromaticContact CD2-CE1 3.85Å; F790-Y796 HydrophobicContact CD2-CE1 3.85Å; F790-Y796 HydrophobicContact CD2-CE2 4.18Å; F790-Y796 HydrophobicContact CD2-CG 4.15Å; F790-Y796 AromaticContact CD2-CZ 3.97Å; F790-Y796 HydrophobicContact CG-CD2 4.39Å; F790-Y796 HydrophobicContact CG-CE2 4.24Å
791	E	75.7	Confident	80.7	Confident	126 Å²	126	72.7 Å²	72.7	59%	0.589	39%	0.389	S	S	*	.			trans	-97.6	-26.2	-176.8	-168	173.8	180	0	0	112.7	L781	L781-E791 CarbonylContact O-C 3.52Å; L781-E791 WeakPolarHBondContact O-CA 3.4Å; L781-E791 VanDerWaalsContact O-O 3.11Å
792	D	79	Confident	81	Confident	30 Å²	30	72.7 Å²	72.7	16%	0.16	39%	0.389	C	S	.	.	S	Bend	trans	-106.8	143.1	177.4	-81.5	-47.9	0	0	0	112	K794 A795 Q871 L1155	D792-K794 PolarHBondContact O-N 3.16Å; D792-K794 VanDerWaalsContact O-N 3.15Å; D792-A795 HydrophobicContact CB-CB 4.44Å; D792-A795 WeakPolarHBondContact O-CB 3.38Å; D792-A795 PolarHBondContact O-N 3.27Å; D792-Q871 WeakPolarHBondContact OD1-CA 3.08Å; D792-L1155 HydrophobicContact CB-CD2 4.14Å; D792-L1155 VanDerWaalsContact OD2-CD2 3.28Å; D792-L1155 WeakPolarHBondContact OD2-CD2 3.33Å
793	A	81	Confident	81.8	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-55.1	-33.6	169.2	0	0	0	0	0	112.4	L781 A795 Y796 F798 Q871 C872 Y876	L781-A793 HydrophobicContact CD1-CB 4.05Å; A793-A795 VanDerWaalsContact C-N 3.28Å; A793-A795 PolarHBondContact O-N 3.01Å; A793-Y796 PolarHBondContact O-N 2.82Å; A793-F798 HydrophobicContact CB-CE2 4.22Å; A793-F798 WeakPolarHBondContact O-CE2 3.43Å; A793-Q871 VanDerWaalsContact CB-O 3.24Å; A793-Q871 WeakPolarHBondContact CB-O 3.3Å; A793-Q871 PolarHBondContact N-O 3.33Å; A793-C872 VanDerWaalsContact CB-O 3.26Å; A793-C872 WeakPolarHBondContact CB-O 3.35Å; A793-Y876 VanDerWaalsContact C-OH 3.31Å; A793-Y876 PolarHBondContact O-OH 3.43Å
794	K	80.2	Confident	82.4	Confident	68 Å²	68	65.3 Å²	65.3	30%	0.296	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-68.6	-24.7	179.9	-166.2	169.1	-177.1	170.9	0	113.1	D792 Y796 G797 Y876 L1155 P1156	D792-K794 PolarHBondContact O-N 3.16Å; D792-K794 VanDerWaalsContact O-N 3.15Å; K794-Y796 VanDerWaalsContact C-N 3.33Å; K794-G797 PolarHBondContact O-N 2.92Å; K794-Y876 WeakPolarHBondContact CA-OH 3.46Å; K794-Y876 HydrophobicContact CB-CE1 4.21Å; K794-Y876 HydrophobicContact CD-CE1 4.43Å; K794-Y876 HydrophobicContact CG-CE1 4.22Å; K794-Y876 PolarHBondContact N-OH 3.28Å; K794-L1155 HydrophobicContact CB-CD2 3.99Å; K794-L1155 HydrophobicContact CD-CD2 4.13Å; K794-P1156 HydrophobicContact CD-CG 4.37Å; K794-P1156 PolarHBondContact NZ-O 3.01Å
795	A	81.8	Confident	83.4	Confident	49 Å²	49	63.2 Å²	63.2	41%	0.405	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-73.4	-24.7	177.9	0	0	0	0	0	112.7	F790 D792 A793 G797	F790-A795 HydrophobicContact CB-CB 4.07Å; F790-A795 HydrophobicContact CD1-CB 3.67Å; F790-A795 HydrophobicContact CE1-CB 4.39Å; F790-A795 HydrophobicContact CG-CB 4.04Å; D792-A795 HydrophobicContact CB-CB 4.44Å; D792-A795 WeakPolarHBondContact O-CB 3.38Å; D792-A795 PolarHBondContact O-N 3.27Å; A793-A795 VanDerWaalsContact C-N 3.28Å; A793-A795 PolarHBondContact O-N 3.01Å; A795-G797 PolarHBondContact O-N 3.42Å
796	Y	81.5	Confident	83.8	Confident	39 Å²	39	62.1 Å²	62.1	15%	0.153	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-70.5	-10.5	173.8	-75.9	-92.6	0	0	0	114.1	L781 F790 A793 K794 F798 Y857	L781-Y796 HydrophobicContact CD2-CD2 3.82Å; L781-Y796 HydrophobicContact CD2-CE2 3.36Å; F790-Y796 HydrophobicContact CB-CD2 3.82Å; F790-Y796 HydrophobicContact CB-CE1 4.47Å; F790-Y796 HydrophobicContact CB-CE2 3.37Å; F790-Y796 AromaticContact CD2-CD1 3.94Å; F790-Y796 HydrophobicContact CD2-CD1 3.94Å; F790-Y796 HydrophobicContact CD2-CD2 4.27Å; F790-Y796 AromaticContact CD2-CE1 3.85Å; F790-Y796 HydrophobicContact CD2-CE1 3.85Å; F790-Y796 HydrophobicContact CD2-CE2 4.18Å; F790-Y796 HydrophobicContact CD2-CG 4.15Å; F790-Y796 AromaticContact CD2-CZ 3.97Å; F790-Y796 HydrophobicContact CG-CD2 4.39Å; F790-Y796 HydrophobicContact CG-CE2 4.24Å; A793-Y796 PolarHBondContact O-N 2.82Å; K794-Y796 VanDerWaalsContact C-N 3.33Å; Y796-F798 HydrophobicContact CG-CZ 4.16Å; Y796-F798 PolarHBondContact O-N 3.19Å; Y796-Y857 HydrophobicContact CE1-CE1 4.23Å
797	G	80.2	Confident	84.5	Confident	56 Å²	56	53.4 Å²	53.4	58%	0.577	28%	0.282	S	S	*	.			trans	62.3	38.6	171.5	0	0	0	0	0	114.8	K794 A795 K799	K794-G797 PolarHBondContact O-N 2.92Å; A795-G797 PolarHBondContact O-N 3.42Å; G797-K799 PolarHBondContact O-N 3.23Å
798	F	84.4	Confident	85	Confident	32 Å²	32	49.5 Å²	49.5	14%	0.14	26%	0.264	C	S	.	.			trans	-53.8	125.3	-176.7	-65.2	-52.5	0	0	0	113.2	A793 Y796 L802 P833 M855 Y857 Y876	A793-F798 HydrophobicContact CB-CE2 4.22Å; A793-F798 WeakPolarHBondContact O-CE2 3.43Å; Y796-F798 HydrophobicContact CG-CZ 4.16Å; Y796-F798 PolarHBondContact O-N 3.19Å; F798-L802 HydrophobicContact CD2-CD1 4.1Å; F798-L802 HydrophobicContact CE2-CD1 4.12Å; F798-P833 HydrophobicContact CB-CG 3.95Å; F798-P833 HydrophobicContact CD1-CB 3.89Å; F798-P833 HydrophobicContact CD1-CG 3.87Å; F798-P833 HydrophobicContact CD2-CB 4.5Å; F798-P833 HydrophobicContact CD2-CG 4.23Å; F798-P833 HydrophobicContact CE1-CB 3.99Å; F798-P833 HydrophobicContact CE1-CG 4.45Å; F798-P833 HydrophobicContact CG-CB 4.17Å; F798-P833 HydrophobicContact CG-CG 3.75Å; F798-P833 HydrophobicContact CZ-CB 4.33Å; F798-M855 HydrophobicContact CD1-CE 4.25Å; F798-Y857 AromaticContact CE1-CE2 3.71Å; F798-Y857 HydrophobicContact CE1-CE2 3.71Å; F798-Y857 HydrophobicContact CZ-CD2 4.05Å; F798-Y857 AromaticContact CZ-CE2 3.58Å; F798-Y857 HydrophobicContact CZ-CE2 3.58Å; F798-Y876 HydrophobicContact CD2-CE2 4.48Å
799	K	81.1	Confident	85.4	Confident	179 Å²	179	49.2 Å²	49.2	78%	0.778	26%	0.264	S	S	*	.	S	Bend	trans	-72.4	-39.3	-179.1	-62.8	-179.4	-179.5	178.2	0	113	G797	G797-K799 PolarHBondContact O-N 3.23Å
800	N	85.6	Confident	85.7	Confident	49 Å²	49	44.5 Å²	44.5	26%	0.262	23%	0.232	S	C	.	.	S	Bend	trans	-98.9	154.5	178.9	-68.3	-14.4	0	0	0	110.2	K829 L831	N800-K829 PolarHBondContact ND2-O 2.86Å; N800-L831 PolarHBondContact ND2-O 3.03Å
801	K	86.8	Confident	85.8	Confident	117 Å²	117	41.5 Å²	41.5	51%	0.509	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-60.9	148.5	177.9	-67.4	-176.2	177.7	-179.2	0	111.5	N832 P833 D878	K801-N832 PolarHBondContact O-OD1 3.19Å; K801-P833 WeakPolarHBondContact O-CD 3.29Å; K801-D878 HydrophobicContact CB-CB 3.82Å; K801-D878 HydrophobicContact CD-CB 3.59Å; K801-D878 WeakPolarHBondContact CD-OD1 3.31Å; K801-D878 WeakPolarHBondContact CE-OD1 3.44Å; K801-D878 HydrophobicContact CG-CB 4.42Å; K801-D878 IonicContact NZ-OD1 2.95Å; K801-D878 PolarHBondContact NZ-OD1 3.11Å
802	L	91.6	Very high	86.4	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	145.3	-176	-163.1	66	0	0	0	112.7	F798 I804 P833 V835 C872 Y876 A877 D878	F798-L802 HydrophobicContact CD2-CD1 4.1Å; F798-L802 HydrophobicContact CE2-CD1 4.12Å; L802-I804 HydrophobicContact CD2-CD1 4.06Å; L802-I804 HydrophobicContact CD2-CG1 3.74Å; L802-I804 HydrophobicContact CG-CG1 4.08Å; L802-P833 HydrophobicContact CD1-CB 3.71Å; L802-P833 HydrophobicContact CD1-CG 3.65Å; L802-V835 HydrophobicContact CD1-CG2 3.83Å; L802-V835 HydrophobicContact CD2-CG2 4.15Å; L802-V835 HydrophobicContact CG-CG2 4.35Å; L802-C872 WeakPolarHBondContact CD2-O 3.47Å; L802-Y876 HydrophobicContact CB-CE2 4.3Å; L802-A877 HydrophobicContact CB-CB 4.07Å; L802-A877 CarbonylContact O-C 3.5Å; L802-A877 VanDerWaalsContact O-CA 3.27Å; L802-A877 WeakPolarHBondContact O-CA 3.49Å; L802-A877 WeakPolarHBondContact O-CB 3.39Å; L802-D878 PolarHBondContact O-N 2.95Å
803	I	94.5	Very high	86.7	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	123.8	161.2	-62	168.3	0	0	0	107.5	C518 V805 F817 L821 N832 P833 I834 V835	C518-I803 HydrophobicContact CB-CD1 3.75Å; C518-I803 HydrophobicContact CB-CG1 4.24Å; C518-I803 HydrophobicContact CB-CG2 4.49Å; I803-V805 HydrophobicContact CG2-CG2 4.29Å; I803-F817 HydrophobicContact CG2-CE1 4.35Å; I803-F817 HydrophobicContact CG2-CZ 4.14Å; I803-L821 HydrophobicContact CD1-CD1 4.27Å; I803-L821 HydrophobicContact CD1-CD2 4.46Å; I803-N832 HydrophobicContact CD1-CB 3.76Å; I803-N832 HydrophobicContact CG1-CB 4.06Å; I803-P833 PolarHBondContact N-O 3.05Å; I803-I834 HydrophobicContact CB-CG1 4.47Å; I803-I834 WeakPolarHBondContact O-CA 3.43Å; I803-V835 PolarHBondContact O-N 2.9Å
804	I	94.8	Very high	87.2	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129.8	174.3	-58.5	174.6	0	0	0	108.2	L802 V835 L837 C872 I874 A877 N879 L880 V881	L802-I804 HydrophobicContact CD2-CD1 4.06Å; L802-I804 HydrophobicContact CD2-CG1 3.74Å; L802-I804 HydrophobicContact CG-CG1 4.08Å; I804-V835 WeakPolarHBondContact CA-O 3.27Å; I804-L837 HydrophobicContact CG2-CB 4.5Å; I804-C872 HydrophobicContact CD1-CB 4Å; I804-I874 HydrophobicContact CD1-CB 3.98Å; I804-I874 HydrophobicContact CD1-CG1 4.32Å; I804-A877 HydrophobicContact CD1-CB 3.98Å; I804-A877 HydrophobicContact CG1-CB 4.22Å; I804-N879 PolarHBondContact N-O 3.41Å; I804-L880 HydrophobicContact CB-CD1 3.98Å; I804-L880 HydrophobicContact CG2-CD1 3.78Å; I804-L880 CarbonylContact O-C 3.59Å; I804-L880 WeakPolarHBondContact O-CA 3.41Å; I804-V881 PolarHBondContact O-N 3.08Å
805	V	95.1	Very high	87.7	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	127.1	174	-172.1	0	0	0	0	108.5	I803 L814 F817 I834 V835 L836 L837 V881 V883	I803-V805 HydrophobicContact CG2-CG2 4.29Å; V805-L814 HydrophobicContact CG1-CD2 4.02Å; V805-F817 HydrophobicContact CG2-CD1 4.1Å; V805-F817 HydrophobicContact CG2-CE1 3.41Å; V805-F817 VanDerWaalsContact CG2-CE1 3.41Å; V805-F817 HydrophobicContact CG2-CE2 4.17Å; V805-F817 HydrophobicContact CG2-CZ 3.46Å; V805-F817 VanDerWaalsContact CG2-CZ 3.46Å; V805-I834 HydrophobicContact CG2-CG2 4.48Å; V805-V835 PolarHBondContact N-O 2.94Å; V805-L836 HydrophobicContact CB-CD2 3.85Å; V805-L836 HydrophobicContact CG1-CD2 4.48Å; V805-L836 HydrophobicContact CG2-CD2 4.11Å; V805-L836 CarbonylContact O-C 3.57Å; V805-L837 PolarHBondContact O-N 2.89Å; V805-V881 WeakPolarHBondContact CA-O 3.36Å; V805-V881 HydrophobicContact CB-CB 4.48Å; V805-V881 HydrophobicContact CG1-CB 4.25Å; V805-V881 HydrophobicContact CG1-CG1 4.24Å; V805-V881 HydrophobicContact CG2-CB 4.28Å; V805-V883 HydrophobicContact CG1-CG2 3.95Å
806	S	93.1	Very high	88.2	Confident	4 Å²	4	30.5 Å²	30.5	3%	0.028	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.1	172.7	-171.4	0	0	0	0	110.5	L837 I863 V881 V883	S806-L837 WeakPolarHBondContact CA-O 3.31Å; S806-I863 WeakPolarHBondContact OG-CD1 3.33Å; S806-I863 WeakPolarHBondContact OG-CG1 3.35Å; S806-V881 PolarHBondContact N-O 2.97Å; S806-V883 VanDerWaalsContact O-CB 3.24Å; S806-V883 WeakPolarHBondContact O-CB 3.32Å; S806-V883 WeakPolarHBondContact O-CG2 3.48Å; S806-V883 PolarHBondContact O-N 3.24Å; S806-V883 VanDerWaalsContact O-N 3.09Å
807	A	91.6	Very high	88.8	Confident	5 Å²	5	28.7 Å²	28.7	4%	0.041	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	163.1	174.2	0	0	0	0	0	111.7	L814 L837 L838 D839 V883	A807-L814 HydrophobicContact CB-CD1 4.04Å; A807-L837 PolarHBondContact N-O 2.97Å; A807-L838 HydrophobicContact CB-CD2 4.1Å; A807-L838 WeakPolarHBondContact O-CA 3.46Å; A807-D839 PolarHBondContact O-N 3.28Å; A807-V883 HydrophobicContact CB-CB 4.28Å; A807-V883 HydrophobicContact CB-CG2 4.42Å
808	E	89	Confident	89.4	Confident	38 Å²	38	26 Å²	26	18%	0.178	13%	0.13	C	C	.	.	S	Bend	trans	-77	-40.1	178.8	-175.5	171.5	-138	0	0	112.8	D839 N840 K885 E886 S887	E808-D839 WeakPolarHBondContact CA-OD2 3.34Å; E808-N840 WeakPolarHBondContact O-CB 3.49Å; E808-N840 PolarHBondContact O-N 3.05Å; E808-N840 VanDerWaalsContact O-N 3.15Å; E808-N840 PolarHBondContact O-ND2 3.44Å; E808-K885 HydrophobicContact CB-CB 4.07Å; E808-K885 HydrophobicContact CB-CD 4.28Å; E808-K885 HydrophobicContact CB-CG 4.16Å; E808-K885 HydrophobicContact CG-CB 4.48Å; E808-K885 HydrophobicContact CG-CD 4.48Å; E808-K885 WeakPolarHBondContact OE2-CB 3.37Å; E808-E886 PolarHBondContact OE2-N 3.4Å; E808-S887 VanDerWaalsContact CD-OG 3.31Å; E808-S887 VanDerWaalsContact OE1-CB 3.3Å; E808-S887 WeakPolarHBondContact OE1-CB 3.5Å; E808-S887 PolarHBondContact OE1-OG 3.43Å; E808-S887 PolarHBondContact OE2-N 2.8Å; E808-S887 PolarHBondContact OE2-OG 3.5Å
809	T	87.6	Confident	89.7	Confident	53 Å²	53	24.8 Å²	24.8	33%	0.325	13%	0.125	S	C	.	.	S	Bend	trans	-136.9	158.9	-178.6	55.2	0	0	0	0	110.2	G811 N840	T809-G811 PolarHBondContact O-N 3.47Å; T809-N840 HydrophobicContact CG2-CB 4.43Å
810	A	85.8	Confident	90.2	Very high	8 Å²	8	16.3 Å²	16.3	7%	0.066	9%	0.088	C	C	.	.			trans	-83.1	54.7	175.8	0	0	0	0	0	112.1	L838 P842 F846	A810-L838 HydrophobicContact CB-CD1 3.98Å; A810-P842 HydrophobicContact CB-CB 3.49Å; A810-P842 VanDerWaalsContact CB-CB 3.49Å; A810-F846 HydrophobicContact CB-CB 4.45Å; A810-F846 HydrophobicContact CB-CD1 3.75Å; A810-F846 HydrophobicContact CB-CD2 4.43Å; A810-F846 HydrophobicContact CB-CE1 4.02Å; A810-F846 HydrophobicContact CB-CG 3.96Å; A810-F846 HydrophobicContact CB-CZ 4.49Å; A810-F846 VanDerWaalsContact O-CD2 3.3Å; A810-F846 WeakPolarHBondContact O-CD2 3.34Å
811	G	82.1	Confident	90.5	Very high	17 Å²	17	14.4 Å²	14.4	18%	0.175	8%	0.078	C	C	.	.			trans	-64	151.5	-176.8	0	0	0	0	0	113.4	T809 G813 L814	T809-G811 PolarHBondContact O-N 3.47Å; G811-G813 PolarHBondContact O-N 3.28Å; G811-L814 WeakPolarHBondContact O-CB 3.4Å; G811-L814 PolarHBondContact O-N 2.67Å
812	N	87.3	Confident	90.7	Very high	27 Å²	27	9 Å²	9	14%	0.144	5%	0.054	C	C	.	.	G	3₁₀ helix	trans	-58.8	-22.3	-175.6	-76.5	-24.5	0	0	0	114.4	P491 E492 P758 Y759 L814 Y815	P491-N812 HydrophobicContact CG-CB 4.13Å; E492-N812 VanDerWaalsContact CD-ND2 3.32Å; E492-N812 PolarHBondContact OE1-ND2 3.01Å; P758-N812 WeakPolarHBondContact CB-OD1 3.33Å; Y759-N812 HydrophobicContact CD1-CB 4.42Å; N812-L814 VanDerWaalsContact C-N 3.26Å; N812-L814 PolarHBondContact O-N 3.11Å; N812-Y815 VanDerWaalsContact O-CB 3.31Å; N812-Y815 WeakPolarHBondContact O-CB 3.4Å; N812-Y815 PolarHBondContact O-N 3.37Å
813	G	85.9	Confident	90.5	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	6%	0.055	C	C	.	.	G	3₁₀ helix	trans	-58.1	-31.5	169.3	0	0	0	0	0	114.4	Y511 G811 Y815 N816	Y511-G813 WeakPolarHBondContact CB-O 3.41Å; Y511-G813 VanDerWaalsContact CD2-CA 3.44Å; Y511-G813 WeakPolarHBondContact CD2-O 3.42Å; Y511-G813 VanDerWaalsContact CG-O 3.28Å; G811-G813 PolarHBondContact O-N 3.28Å; G813-Y815 PolarHBondContact O-N 2.77Å; G813-N816 WeakPolarHBondContact O-CB 3.49Å; G813-N816 PolarHBondContact O-N 2.85Å
814	L	91.3	Very high	90.2	Very high	1 Å²	1	10 Å²	10	1%	0.005	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-66.4	-21.1	178	-75.9	167.4	0	0	0	113.4	Y511 V805 A807 G811 N812 N816 F817 I818 L838 F846	Y511-L814 HydrophobicContact CD1-CD2 3.98Å; Y511-L814 HydrophobicContact CE1-CD2 3.53Å; Y511-L814 HydrophobicContact CE1-CG 3.99Å; V805-L814 HydrophobicContact CG1-CD2 4.02Å; A807-L814 HydrophobicContact CB-CD1 4.04Å; G811-L814 WeakPolarHBondContact O-CB 3.4Å; G811-L814 PolarHBondContact O-N 2.67Å; N812-L814 VanDerWaalsContact C-N 3.26Å; N812-L814 PolarHBondContact O-N 3.11Å; L814-N816 VanDerWaalsContact C-N 3.26Å; L814-N816 PolarHBondContact O-N 2.87Å; L814-F817 WeakPolarHBondContact O-CB 3.48Å; L814-F817 PolarHBondContact O-N 3.3Å; L814-I818 PolarHBondContact O-N 3.3Å; L814-L838 HydrophobicContact CD1-CD2 4.44Å; L814-F846 HydrophobicContact CB-CE2 3.79Å; L814-F846 HydrophobicContact CB-CZ 3.86Å
815	Y	91.4	Very high	89.7	Confident	10 Å²	10	10.9 Å²	10.9	4%	0.039	6%	0.062	C	C	.	.	H	α-helix	trans	-60.7	-40.1	169.5	178.9	-97.5	0	0	0	110.9	P754 P758 Y759 N812 G813 F817 I818 V819 A849 F853	P754-Y815 WeakPolarHBondContact CG-OH 3.45Å; P758-Y815 HydrophobicContact CG-CD1 3.98Å; P758-Y815 HydrophobicContact CG-CD2 3.7Å; P758-Y815 HydrophobicContact CG-CE1 4.45Å; P758-Y815 HydrophobicContact CG-CE2 4.19Å; P758-Y815 HydrophobicContact CG-CG 3.56Å; Y759-Y815 HydrophobicContact CE1-CD1 4.42Å; N812-Y815 VanDerWaalsContact O-CB 3.31Å; N812-Y815 WeakPolarHBondContact O-CB 3.4Å; N812-Y815 PolarHBondContact O-N 3.37Å; G813-Y815 PolarHBondContact O-N 2.77Å; Y815-F817 PolarHBondContact O-N 2.76Å; Y815-I818 PolarHBondContact O-N 2.94Å; Y815-V819 HydrophobicContact CD1-CG2 3.93Å; Y815-V819 HydrophobicContact CE1-CG2 3.62Å; Y815-V819 HydrophobicContact CE2-CG2 4.5Å; Y815-V819 WeakPolarHBondContact O-CG2 3.42Å; Y815-V819 PolarHBondContact O-N 3.4Å; Y815-V819 VanDerWaalsContact O-N 3.07Å; Y815-A849 HydrophobicContact CD2-CB 3.97Å; Y815-A849 HydrophobicContact CE2-CB 3.94Å; Y815-F853 HydrophobicContact CD2-CE2 4.14Å; Y815-F853 AromaticContact CE2-CE2 3.78Å; Y815-F853 HydrophobicContact CE2-CE2 3.78Å; Y815-F853 AromaticContact CE2-CZ 3.94Å; Y815-F853 HydrophobicContact CE2-CZ 3.94Å
816	N	91.9	Very high	89.3	Confident	4 Å²	4	11.4 Å²	11.4	2%	0.021	6%	0.064	C	C	.	.	H	α-helix	trans	-73.2	-11	178.3	-59.3	-33.1	0	0	0	113.4	Y759 G813 L814 P820 L998	Y759-N816 PolarHBondContact OH-ND2 2.83Å; Y759-N816 PolarHBondContact OH-OD1 3.08Å; G813-N816 WeakPolarHBondContact O-CB 3.49Å; G813-N816 PolarHBondContact O-N 2.85Å; L814-N816 VanDerWaalsContact C-N 3.26Å; L814-N816 PolarHBondContact O-N 2.87Å; N816-P820 WeakPolarHBondContact O-CD 3.39Å; N816-P820 WeakPolarHBondContact O-CG 2.98Å; N816-L998 HydrophobicContact CB-CD2 4.39Å
817	F	93.9	Very high	88.9	Confident	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-76.9	-40.2	166	-177.7	-86.6	0	0	0	111.2	Y511 L514 A515 I803 V805 L814 Y815 L821 I834 V881	Y511-F817 HydrophobicContact CD1-CB 4.29Å; Y511-F817 WeakPolarHBondContact O-CD2 3.48Å; L514-F817 HydrophobicContact CB-CD2 4.09Å; L514-F817 HydrophobicContact CB-CE2 3.98Å; A515-F817 VanDerWaalsContact CA-CE2 3.45Å; A515-F817 HydrophobicContact CB-CB 4.47Å; A515-F817 HydrophobicContact CB-CD1 4.47Å; A515-F817 HydrophobicContact CB-CD2 3.68Å; A515-F817 HydrophobicContact CB-CE2 3.95Å; A515-F817 HydrophobicContact CB-CG 3.95Å; A515-F817 HydrophobicContact CB-CZ 4.44Å; A515-F817 WeakPolarHBondContact CB-O 3.39Å; I803-F817 HydrophobicContact CG2-CE1 4.35Å; I803-F817 HydrophobicContact CG2-CZ 4.14Å; V805-F817 HydrophobicContact CG2-CD1 4.1Å; V805-F817 HydrophobicContact CG2-CE1 3.41Å; V805-F817 VanDerWaalsContact CG2-CE1 3.41Å; V805-F817 HydrophobicContact CG2-CE2 4.17Å; V805-F817 HydrophobicContact CG2-CZ 3.46Å; V805-F817 VanDerWaalsContact CG2-CZ 3.46Å; L814-F817 WeakPolarHBondContact O-CB 3.48Å; L814-F817 PolarHBondContact O-N 3.3Å; Y815-F817 PolarHBondContact O-N 2.76Å; F817-L821 HydrophobicContact CD1-CD1 3.8Å; F817-L821 HydrophobicContact CE1-CD1 3.33Å; F817-L821 HydrophobicContact CZ-CD1 3.9Å; F817-I834 HydrophobicContact CE1-CG2 4.48Å; F817-V881 HydrophobicContact CE2-CG1 4.24Å; F817-V881 HydrophobicContact CE2-CG2 4.05Å; F817-V881 HydrophobicContact CZ-CG2 4.03Å
818	I	93.2	Very high	88.7	Confident	1 Å²	1	20.9 Å²	20.9	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-80	-39	-171.5	-62.2	160.8	0	0	0	111.4	L814 Y815 L821 R822 I834 I850 F853 V856	L814-I818 PolarHBondContact O-N 3.3Å; Y815-I818 PolarHBondContact O-N 2.94Å; I818-L821 CarbonylContact O-C 3.57Å; I818-L821 WeakPolarHBondContact O-CB 3.48Å; I818-L821 PolarHBondContact O-N 2.74Å; I818-L821 VanDerWaalsContact O-N 3.12Å; I818-R822 HydrophobicContact CG2-CG 3.96Å; I818-R822 PolarHBondContact O-N 2.96Å; I818-I834 HydrophobicContact CG2-CD1 4.47Å; I818-I850 HydrophobicContact CD1-CD1 3.41Å; I818-I850 VanDerWaalsContact CD1-CD1 3.41Å; I818-I850 HydrophobicContact CD1-CG1 3.8Å; I818-F853 HydrophobicContact CG2-CB 4.37Å; I818-F853 HydrophobicContact CG2-CD2 3.66Å; I818-F853 HydrophobicContact CG2-CE2 4.03Å; I818-F853 HydrophobicContact CG2-CG 3.96Å; I818-V856 HydrophobicContact CD1-CG1 4.15Å; I818-V856 HydrophobicContact CG2-CG2 4.18Å
819	V	91	Very high	88.4	Confident	5 Å²	5	25.7 Å²	25.7	3%	0.03	13%	0.127	C	C	.	.	H	α-helix	trans	-47.9	-58.8	178.7	161.5	0	0	0	0	113.6	T765 Y815 L821 R822 A823 F853	T765-V819 HydrophobicContact CG2-CG1 3.89Å; T765-V819 WeakPolarHBondContact OG1-CG1 3.29Å; Y815-V819 HydrophobicContact CD1-CG2 3.93Å; Y815-V819 HydrophobicContact CE1-CG2 3.62Å; Y815-V819 HydrophobicContact CE2-CG2 4.5Å; Y815-V819 WeakPolarHBondContact O-CG2 3.42Å; Y815-V819 PolarHBondContact O-N 3.4Å; Y815-V819 VanDerWaalsContact O-N 3.07Å; V819-L821 PolarHBondContact O-N 2.98Å; V819-R822 CarbonylContact O-C 3.56Å; V819-R822 PolarHBondContact O-N 3.07Å; V819-R822 VanDerWaalsContact O-N 3.07Å; V819-A823 PolarHBondContact O-N 3.41Å; V819-F853 HydrophobicContact CG2-CZ 4.2Å
820	P	90.6	Very high	88.3	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.006	13%	0.133	C	C	.	.	H	α-helix	trans	-69.1	-17.8	-178.4	27.5	-35.6	0	0	0	114	A515 N816	A515-P820 HydrophobicContact CB-CG 3.85Å; N816-P820 WeakPolarHBondContact O-CD 3.39Å; N816-P820 WeakPolarHBondContact O-CG 2.98Å
821	L	91.3	Very high	88.5	Confident	10 Å²	10	27.6 Å²	27.6	5%	0.052	13%	0.131	C	C	.	.	H	α-helix	trans	-85.5	-13.5	173.2	-68.6	175.4	0	0	0	113.9	A515 V519 I803 F817 I818 V819 I834	A515-L821 HydrophobicContact CB-CD1 4.16Å; A515-L821 HydrophobicContact CB-CG 4.05Å; A515-L821 WeakPolarHBondContact O-CD2 3.36Å; V519-L821 HydrophobicContact CG2-CD2 3.46Å; V519-L821 VanDerWaalsContact CG2-CD2 3.46Å; I803-L821 HydrophobicContact CD1-CD1 4.27Å; I803-L821 HydrophobicContact CD1-CD2 4.46Å; F817-L821 HydrophobicContact CD1-CD1 3.8Å; F817-L821 HydrophobicContact CE1-CD1 3.33Å; F817-L821 HydrophobicContact CZ-CD1 3.9Å; I818-L821 CarbonylContact O-C 3.57Å; I818-L821 WeakPolarHBondContact O-CB 3.48Å; I818-L821 PolarHBondContact O-N 2.74Å; I818-L821 VanDerWaalsContact O-N 3.12Å; V819-L821 PolarHBondContact O-N 2.98Å; L821-I834 HydrophobicContact CB-CD1 4.07Å; L821-I834 HydrophobicContact CD1-CD1 3.71Å; L821-I834 HydrophobicContact CD1-CG1 4.41Å
822	R	91.5	Very high	88.8	Confident	3 Å²	3	28.6 Å²	28.6	1%	0.011	13%	0.133	C	C	.	.	H	α-helix	trans	-117.6	3.8	179.6	-67	-65.8	-177.9	-100.9	4.9	113.3	C767 H768 I818 V819 N832 F853 P854 M855	C767-R822 CarbonylContact C-O 3.58Å; C767-R822 VanDerWaalsContact CA-O 3.23Å; C767-R822 WeakPolarHBondContact CA-O 3.49Å; C767-R822 HydrophobicContact CB-CB 4.49Å; C767-R822 WeakPolarHBondContact CB-O 3.28Å; H768-R822 PolarHBondContact CD2-O 3.26Å; H768-R822 PolarHBondContact N-O 2.71Å; I818-R822 HydrophobicContact CG2-CG 3.96Å; I818-R822 PolarHBondContact O-N 2.96Å; V819-R822 CarbonylContact O-C 3.56Å; V819-R822 PolarHBondContact O-N 3.07Å; V819-R822 VanDerWaalsContact O-N 3.07Å; R822-N832 VanDerWaalsContact CZ-O 3.32Å; R822-N832 PolarHBondContact NH1-O 2.81Å; R822-N832 PolarHBondContact NH2-O 2.77Å; R822-F853 HydrophobicContact CB-CD1 3.96Å; R822-F853 HydrophobicContact CB-CE1 4.39Å; R822-F853 HydrophobicContact CG-CB 4.34Å; R822-F853 HydrophobicContact CG-CD1 4.21Å; R822-F853 HydrophobicContact CG-CG 4.43Å; R822-P854 PolarHBondContact NE-O 2.95Å; R822-P854 PolarHBondContact NH2-O 2.97Å; R822-P854 VanDerWaalsContact NH2-O 3.13Å; R822-M855 PolarHBondContact NH2-O 2.83Å
823	A	88.3	Confident	89.1	Confident	2 Å²	2	27.3 Å²	27.3	2%	0.017	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	-58.7	146.7	178.7	0	0	0	0	0	114	L766 H768 V819 Y825 R826	L766-A823 WeakPolarHBondContact O-CA 3.11Å; H768-A823 PolarHBondContact CD2-O 3.18Å; H768-A823 PolarHBondContact NE2-O 2.89Å; V819-A823 PolarHBondContact O-N 3.41Å; A823-Y825 HydrophobicContact CB-CD1 4.01Å; A823-Y825 HydrophobicContact CB-CD2 4.26Å; A823-Y825 HydrophobicContact CB-CE1 3.5Å; A823-Y825 HydrophobicContact CB-CE2 3.76Å; A823-Y825 HydrophobicContact CB-CG 4.35Å; A823-Y825 PolarHBondContact O-N 3.35Å; A823-R826 PolarHBondContact O-N 3.33Å; A823-R826 VanDerWaalsContact O-N 3.09Å
824	Y	87.4	Confident	89.5	Confident	19 Å²	19	27.3 Å²	27.3	8%	0.075	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-25.7	-172.8	76.4	-81.9	0	0	0	115.2	L766 R826 D1216 P1217 L1218	L766-Y824 HydrophobicContact CB-CD1 3.58Å; L766-Y824 HydrophobicContact CB-CE1 4.39Å; L766-Y824 HydrophobicContact CB-CG 3.93Å; L766-Y824 WeakPolarHBondContact O-CD1 2.96Å; L766-Y824 PolarHBondContact O-N 2.98Å; Y824-R826 VanDerWaalsContact C-N 3.34Å; Y824-D1216 PolarHBondContact OH-OD1 3.47Å; Y824-D1216 VanDerWaalsContact OH-OD1 3.08Å; Y824-P1217 HydrophobicContact CE2-CG 4.41Å; Y824-L1218 HydrophobicContact CD2-CD1 3.81Å; Y824-L1218 HydrophobicContact CD2-CG 4.13Å; Y824-L1218 HydrophobicContact CE2-CD1 3.51Å; Y824-L1218 HydrophobicContact CE2-CG 3.7Å
825	Y	84.8	Confident	89.7	Confident	19 Å²	19	27.2 Å²	27.2	8%	0.075	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-12.5	-177.4	53.2	-115.6	0	0	0	113.6	A823 T1000 F1006	A823-Y825 HydrophobicContact CB-CD1 4.01Å; A823-Y825 HydrophobicContact CB-CD2 4.26Å; A823-Y825 HydrophobicContact CB-CE1 3.5Å; A823-Y825 HydrophobicContact CB-CE2 3.76Å; A823-Y825 HydrophobicContact CB-CG 4.35Å; A823-Y825 PolarHBondContact O-N 3.35Å; Y825-T1000 HydrophobicContact CE1-CG2 4.32Å; Y825-F1006 HydrophobicContact CD1-CB 4.07Å; Y825-F1006 HydrophobicContact CD1-CD1 4.23Å; Y825-F1006 HydrophobicContact CD1-CG 4.05Å; Y825-F1006 HydrophobicContact CD2-CB 4.17Å; Y825-F1006 HydrophobicContact CD2-CD1 4.23Å; Y825-F1006 AromaticContact CD2-CD2 3.38Å; Y825-F1006 HydrophobicContact CD2-CD2 3.38Å; Y825-F1006 AromaticContact CD2-CE2 3.73Å; Y825-F1006 HydrophobicContact CD2-CE2 3.73Å; Y825-F1006 AromaticContact CD2-CG 3.66Å; Y825-F1006 HydrophobicContact CD2-CG 3.66Å; Y825-F1006 HydrophobicContact CD2-CZ 4.3Å; Y825-F1006 HydrophobicContact CE1-CB 4.03Å; Y825-F1006 HydrophobicContact CE1-CG 4.43Å; Y825-F1006 HydrophobicContact CE2-CB 4.15Å; Y825-F1006 AromaticContact CE2-CD2 3.83Å; Y825-F1006 HydrophobicContact CE2-CD2 3.83Å; Y825-F1006 HydrophobicContact CE2-CG 4.1Å; Y825-F1006 HydrophobicContact CG-CB 4.15Å; Y825-F1006 AromaticContact CG-CD1 3.82Å; Y825-F1006 HydrophobicContact CG-CD1 3.82Å; Y825-F1006 AromaticContact CG-CD2 3.85Å; Y825-F1006 HydrophobicContact CG-CD2 3.85Å; Y825-F1006 HydrophobicContact CG-CE1 4.17Å; Y825-F1006 HydrophobicContact CG-CE2 4.18Å; Y825-F1006 AromaticContact CG-CG 3.66Å; Y825-F1006 HydrophobicContact CG-CG 3.66Å; Y825-F1006 HydrophobicContact CG-CZ 4.32Å
826	R	85.8	Confident	89.8	Confident	13 Å²	13	26.8 Å²	26.8	5%	0.049	12%	0.124	C	C	.	.	S	Bend	trans	-80	133.2	168.8	-60.7	-61.3	-179.3	-146.2	-7	109.4	H768 A823 Y824 L831 L1007	H768-R826 PolarHBondContact NE2-O 2.9Å; A823-R826 PolarHBondContact O-N 3.33Å; A823-R826 VanDerWaalsContact O-N 3.09Å; Y824-R826 VanDerWaalsContact C-N 3.34Å; R826-L831 HydrophobicContact CB-CD2 4.18Å; R826-L1007 PolarHBondContact NH1-O 3.41Å; R826-L1007 PolarHBondContact NH2-O 2.94Å
827	P	85.6	Confident	89.9	Confident	70 Å²	70	26.6 Å²	26.6	46%	0.455	12%	0.123	S	C	.	.			trans	-71.3	142.2	178.8	28.6	-32.4	0	0	0	111.1	K829 E830	P827-K829 PolarHBondContact O-N 2.98Å; P827-E830 WeakPolarHBondContact CD-OE2 3.42Å; P827-E830 HydrophobicContact CG-CB 3.78Å; P827-E830 WeakPolarHBondContact CG-OE2 3.05Å; P827-E830 PolarHBondContact O-N 3.17Å
828	R	86.1	Confident	89.9	Confident	137 Å²	137	26.8 Å²	26.8	52%	0.517	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-52.8	-33.8	-175.9	-70.1	176.5	173.3	159.6	-9.9	113.4	Y749 E830	Y749-R828 HydrophobicContact CD2-CG 4.41Å; Y749-R828 PolarHBondContact O-NH2 2.79Å; R828-E830 VanDerWaalsContact C-N 3.33Å; R828-E830 PolarHBondContact O-N 3.48Å
829	K	84.5	Confident	89.8	Confident	140 Å²	140	29.4 Å²	29.4	61%	0.609	14%	0.138	S	C	*	.	G	3₁₀ helix	trans	-70.7	-21.6	179.9	-69.6	171	176.1	163.8	0	113.9	D734 N800 P827	D734-K829 WeakPolarHBondContact OD1-CE 3.12Å; D734-K829 IonicContact OD1-NZ 3.2Å; D734-K829 PolarHBondContact OD1-NZ 3.32Å; D734-K829 WeakPolarHBondContact OD2-CE 3.37Å; D734-K829 IonicContact OD2-NZ 2.63Å; D734-K829 PolarHBondContact OD2-NZ 2.96Å; N800-K829 PolarHBondContact ND2-O 2.86Å; P827-K829 PolarHBondContact O-N 2.98Å
830	E	85.5	Confident	89.8	Confident	96 Å²	96	32.9 Å²	32.9	45%	0.449	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-97.7	-0.7	-176.9	-165	-178.1	179.4	0	0	112.9	P827 R828 N832	P827-E830 WeakPolarHBondContact CD-OE2 3.42Å; P827-E830 HydrophobicContact CG-CB 3.78Å; P827-E830 WeakPolarHBondContact CG-OE2 3.05Å; P827-E830 PolarHBondContact O-N 3.17Å; R828-E830 VanDerWaalsContact C-N 3.33Å; R828-E830 PolarHBondContact O-N 3.48Å; E830-N832 PolarHBondContact O-N 2.7Å
831	L	88.6	Confident	89.7	Confident	5 Å²	5	38.1 Å²	38.1	3%	0.026	19%	0.19	C	C	.	.			trans	-66.7	108.5	-179	-64.4	177.7	0	0	0	110.9	Y749 H768 N800 R826	Y749-L831 HydrophobicContact CD2-CD1 4.42Å; Y749-L831 HydrophobicContact CE2-CD1 4.37Å; H768-L831 HydrophobicContact CB-CD1 4.42Å; N800-L831 PolarHBondContact ND2-O 3.03Å; R826-L831 HydrophobicContact CB-CD2 4.18Å
832	N	89.5	Confident	89.7	Confident	37 Å²	37	38.3 Å²	38.3	20%	0.198	19%	0.192	C	C	.	.			trans	-75.9	134.3	172.7	-68.7	-28.3	0	0	0	110.3	K801 I803 R822 E830	K801-N832 PolarHBondContact O-OD1 3.19Å; I803-N832 HydrophobicContact CD1-CB 3.76Å; I803-N832 HydrophobicContact CG1-CB 4.06Å; R822-N832 VanDerWaalsContact CZ-O 3.32Å; R822-N832 PolarHBondContact NH1-O 2.81Å; R822-N832 PolarHBondContact NH2-O 2.77Å; E830-N832 PolarHBondContact O-N 2.7Å
833	P	92.8	Very high	89.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.22	C	C	.	.			trans	-63.1	147.9	170.5	22.2	-28.3	0	0	0	111.5	F798 K801 L802 I803 M855	F798-P833 HydrophobicContact CB-CG 3.95Å; F798-P833 HydrophobicContact CD1-CB 3.89Å; F798-P833 HydrophobicContact CD1-CG 3.87Å; F798-P833 HydrophobicContact CD2-CB 4.5Å; F798-P833 HydrophobicContact CD2-CG 4.23Å; F798-P833 HydrophobicContact CE1-CB 3.99Å; F798-P833 HydrophobicContact CE1-CG 4.45Å; F798-P833 HydrophobicContact CG-CB 4.17Å; F798-P833 HydrophobicContact CG-CG 3.75Å; F798-P833 HydrophobicContact CZ-CB 4.33Å; K801-P833 WeakPolarHBondContact O-CD 3.29Å; L802-P833 HydrophobicContact CD1-CB 3.71Å; L802-P833 HydrophobicContact CD1-CG 3.65Å; I803-P833 PolarHBondContact N-O 3.05Å; P833-M855 WeakPolarHBondContact CA-O 3.17Å; P833-M855 HydrophobicContact CB-CB 4.26Å; P833-M855 HydrophobicContact CB-CE 3.86Å; P833-M855 HydrophobicContact CG-CE 4.03Å
834	I	95	Very high	89.7	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	130.3	-178.3	-59.5	168	0	0	0	109.1	I803 V805 F817 I818 L821 L836 M855 V856 Y857	I803-I834 HydrophobicContact CB-CG1 4.47Å; I803-I834 WeakPolarHBondContact O-CA 3.43Å; V805-I834 HydrophobicContact CG2-CG2 4.48Å; F817-I834 HydrophobicContact CE1-CG2 4.48Å; I818-I834 HydrophobicContact CG2-CD1 4.47Å; L821-I834 HydrophobicContact CB-CD1 4.07Å; L821-I834 HydrophobicContact CD1-CD1 3.71Å; L821-I834 HydrophobicContact CD1-CG1 4.41Å; I834-L836 HydrophobicContact CG2-CD2 4.07Å; I834-M855 PolarHBondContact N-O 3.25Å; I834-V856 HydrophobicContact CB-CG1 4.2Å; I834-V856 HydrophobicContact CB-CG2 4.47Å; I834-V856 HydrophobicContact CD1-CG2 4.44Å; I834-V856 HydrophobicContact CG2-CG1 4.3Å; I834-V856 WeakPolarHBondContact O-CA 3.33Å; I834-Y857 PolarHBondContact O-N 3.35Å
835	V	94.3	Very high	89.7	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	121.5	173.8	173	0	0	0	0	109.9	L781 L802 I803 I804 V805 Y857 C872	L781-V835 HydrophobicContact CD1-CG1 4.01Å; L781-V835 HydrophobicContact CD1-CG2 3.75Å; L802-V835 HydrophobicContact CD1-CG2 3.83Å; L802-V835 HydrophobicContact CD2-CG2 4.15Å; L802-V835 HydrophobicContact CG-CG2 4.35Å; I803-V835 PolarHBondContact O-N 2.9Å; I804-V835 WeakPolarHBondContact CA-O 3.27Å; V805-V835 PolarHBondContact N-O 2.94Å; V835-Y857 WeakPolarHBondContact CA-O 3.46Å; V835-C872 HydrophobicContact CG1-CB 4.44Å
836	L	94.7	Very high	90	Very high	1 Å²	1	54 Å²	54	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	107.6	174.6	-53.5	-177	0	0	0	109.6	V805 I834 L838 F846 I850 Y857 Y858 M859	V805-L836 HydrophobicContact CB-CD2 3.85Å; V805-L836 HydrophobicContact CG1-CD2 4.48Å; V805-L836 HydrophobicContact CG2-CD2 4.11Å; V805-L836 CarbonylContact O-C 3.57Å; I834-L836 HydrophobicContact CG2-CD2 4.07Å; L836-L838 HydrophobicContact CB-CD1 4.43Å; L836-L838 HydrophobicContact CB-CD2 4.42Å; L836-L838 HydrophobicContact CB-CG 4.23Å; L836-F846 HydrophobicContact CD1-CE1 3.74Å; L836-F846 HydrophobicContact CD1-CZ 3.83Å; L836-I850 HydrophobicContact CD1-CD1 3.68Å; L836-Y857 PolarHBondContact N-O 2.91Å; L836-Y858 CarbonylContact O-C 3.58Å; L836-Y858 WeakPolarHBondContact O-CA 3.26Å; L836-M859 PolarHBondContact O-N 3.3Å
837	L	94.2	Very high	90.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	117.1	168.8	-177.1	72.7	0	0	0	108.4	I804 V805 S806 A807 M859 I863 L869	I804-L837 HydrophobicContact CG2-CB 4.5Å; V805-L837 PolarHBondContact O-N 2.89Å; S806-L837 WeakPolarHBondContact CA-O 3.31Å; A807-L837 PolarHBondContact N-O 2.97Å; L837-M859 HydrophobicContact CD1-CG 4.36Å; L837-I863 HydrophobicContact CD2-CG1 4.46Å; L837-L869 HydrophobicContact CD2-CD2 3.61Å
838	L	93.3	Very high	90.4	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	130.9	-172.3	-58.6	171	0	0	0	111.1	A807 A810 L814 L836 N840 P842 Y858 M859 G860 G861	A807-L838 HydrophobicContact CB-CD2 4.1Å; A807-L838 WeakPolarHBondContact O-CA 3.46Å; A810-L838 HydrophobicContact CB-CD1 3.98Å; L814-L838 HydrophobicContact CD1-CD2 4.44Å; L836-L838 HydrophobicContact CB-CD1 4.43Å; L836-L838 HydrophobicContact CB-CD2 4.42Å; L836-L838 HydrophobicContact CB-CG 4.23Å; L838-N840 VanDerWaalsContact C-N 3.34Å; L838-N840 VanDerWaalsContact CB-O 3.26Å; L838-N840 WeakPolarHBondContact CB-O 3.45Å; L838-P842 HydrophobicContact CD1-CB 4.1Å; L838-P842 HydrophobicContact CD1-CG 4.32Å; L838-Y858 HydrophobicContact CD1-CD2 4.49Å; L838-M859 PolarHBondContact N-O 3.44Å; L838-G860 WeakPolarHBondContact O-CA 3.5Å; L838-G861 CarbonylContact C-O 3.45Å; L838-G861 PolarHBondContact O-N 2.7Å; L838-G861 VanDerWaalsContact O-O 3.09Å
839	D	90.9	Very high	90.6	Very high	57 Å²	57	47.7 Å²	47.7	31%	0.305	25%	0.245	S	C	.	.	S	Bend	trans	-65.7	-40.7	173.3	-60.1	-78.8	0	0	0	111	A807 E808 G861 S862 K885	A807-D839 PolarHBondContact O-N 3.28Å; E808-D839 WeakPolarHBondContact CA-OD2 3.34Å; D839-G861 PolarHBondContact N-O 3.29Å; D839-S862 WeakPolarHBondContact OD1-CB 3.26Å; D839-K885 IonicContact OD1-NZ 2.7Å; D839-K885 PolarHBondContact OD1-NZ 2.68Å; D839-K885 WeakPolarHBondContact OD2-CE 3.12Å; D839-K885 IonicContact OD2-NZ 3.21Å; D839-K885 PolarHBondContact OD2-NZ 2.85Å
840	N	91	Very high	90.9	Very high	77 Å²	77	41.5 Å²	41.5	41%	0.412	22%	0.218	S	C	.	.	S	Bend	trans	-106.3	148.8	178.3	-62.3	-76.5	0	0	0	111.4	E808 T809 L838	E808-N840 WeakPolarHBondContact O-CB 3.49Å; E808-N840 PolarHBondContact O-N 3.05Å; E808-N840 VanDerWaalsContact O-N 3.15Å; E808-N840 PolarHBondContact O-ND2 3.44Å; T809-N840 HydrophobicContact CG2-CB 4.43Å; L838-N840 VanDerWaalsContact C-N 3.34Å; L838-N840 VanDerWaalsContact CB-O 3.26Å; L838-N840 WeakPolarHBondContact CB-O 3.45Å
841	P	88.9	Confident	91.2	Very high	111 Å²	111	37 Å²	37	72%	0.721	20%	0.197	S	C	*	.	P	Polyproline II helix	trans	-63.4	146.6	176.2	27.7	-35	0	0	0	111.9
842	P	92.1	Very high	91.3	Very high	14 Å²	14	37.1 Å²	37.1	9%	0.091	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-74.2	147	179.3	30.4	-35.8	0	0	0	112.9	A810 L838 F846 L847 Y858	A810-P842 HydrophobicContact CB-CB 3.49Å; A810-P842 VanDerWaalsContact CB-CB 3.49Å; L838-P842 HydrophobicContact CD1-CB 4.1Å; L838-P842 HydrophobicContact CD1-CG 4.32Å; P842-F846 HydrophobicContact CB-CD1 4.29Å; P842-L847 HydrophobicContact CB-CD2 4.25Å; P842-L847 HydrophobicContact CB-CG 4.23Å; P842-L847 HydrophobicContact CG-CD1 4.19Å; P842-L847 HydrophobicContact CG-CD2 3.83Å; P842-L847 HydrophobicContact CG-CG 4.07Å; P842-Y858 VanDerWaalsContact CD-CE2 3.47Å; P842-Y858 HydrophobicContact CG-CD1 4.39Å; P842-Y858 HydrophobicContact CG-CD2 3.74Å; P842-Y858 HydrophobicContact CG-CE1 4.25Å; P842-Y858 HydrophobicContact CG-CE2 3.56Å; P842-Y858 HydrophobicContact CG-CG 4.15Å
843	D	89.5	Confident	91.4	Very high	114 Å²	114	35.6 Å²	35.6	61%	0.61	19%	0.19	S	C	*	.	P	Polyproline II helix	trans	-71.5	150.4	173.5	-75.8	-49	0	0	0	113	H845 F846 L847	D843-H845 VanDerWaalsContact C-N 3.26Å; D843-H845 PolarHBondContact O-N 2.69Å; D843-F846 WeakPolarHBondContact O-CB 3.49Å; D843-F846 PolarHBondContact O-N 2.64Å; D843-F846 VanDerWaalsContact O-N 3.08Å; D843-L847 PolarHBondContact O-N 3.03Å
844	N	89.5	Confident	91.3	Very high	106 Å²	106	35.7 Å²	35.7	57%	0.567	19%	0.19	S	C	*	.	H	α-helix	trans	-57	-37.4	177.9	-69.7	-14.9	0	0	0	112.8	F846 L847 E848	N844-F846 VanDerWaalsContact C-N 3.32Å; N844-F846 PolarHBondContact O-N 3.16Å; N844-L847 PolarHBondContact O-N 3Å; N844-E848 WeakPolarHBondContact O-CB 3.37Å; N844-E848 PolarHBondContact O-N 3.37Å
845	H	86.8	Confident	91	Very high	147 Å²	147	37.9 Å²	37.9	68%	0.681	20%	0.201	S	C	*	.	H	α-helix	trans	-60.5	-40.1	177.2	-59.3	111.8	0	0	0	112.4	D843 A849	D843-H845 VanDerWaalsContact C-N 3.26Å; D843-H845 PolarHBondContact O-N 2.69Å; H845-A849 PolarHBondContact O-N 3.03Å
846	F	90.4	Very high	90.9	Very high	6 Å²	6	38.3 Å²	38.3	3%	0.026	20%	0.204	C	C	.	.	H	α-helix	trans	-70.3	-44.3	175.6	-176.1	-94.1	0	0	0	111	A810 L814 L836 P842 D843 N844 E848 A849 I850	A810-F846 HydrophobicContact CB-CB 4.45Å; A810-F846 HydrophobicContact CB-CD1 3.75Å; A810-F846 HydrophobicContact CB-CD2 4.43Å; A810-F846 HydrophobicContact CB-CE1 4.02Å; A810-F846 HydrophobicContact CB-CG 3.96Å; A810-F846 HydrophobicContact CB-CZ 4.49Å; A810-F846 VanDerWaalsContact O-CD2 3.3Å; A810-F846 WeakPolarHBondContact O-CD2 3.34Å; L814-F846 HydrophobicContact CB-CE2 3.79Å; L814-F846 HydrophobicContact CB-CZ 3.86Å; L836-F846 HydrophobicContact CD1-CE1 3.74Å; L836-F846 HydrophobicContact CD1-CZ 3.83Å; P842-F846 HydrophobicContact CB-CD1 4.29Å; D843-F846 WeakPolarHBondContact O-CB 3.49Å; D843-F846 PolarHBondContact O-N 2.64Å; D843-F846 VanDerWaalsContact O-N 3.08Å; N844-F846 VanDerWaalsContact C-N 3.32Å; N844-F846 PolarHBondContact O-N 3.16Å; F846-E848 PolarHBondContact O-N 2.92Å; F846-A849 PolarHBondContact O-N 2.91Å; F846-I850 HydrophobicContact CD1-CD1 4.45Å; F846-I850 HydrophobicContact CD1-CG2 4.35Å; F846-I850 HydrophobicContact CE1-CB 4.44Å; F846-I850 HydrophobicContact CE1-CD1 3.53Å; F846-I850 HydrophobicContact CE1-CG2 4.39Å; F846-I850 HydrophobicContact CZ-CD1 3.84Å; F846-I850 VanDerWaalsContact O-CG2 3.25Å; F846-I850 WeakPolarHBondContact O-CG2 3.4Å; F846-I850 PolarHBondContact O-N 2.95Å
847	L	91.3	Very high	90.8	Very high	9 Å²	9	40 Å²	40	5%	0.047	21%	0.211	C	C	.	.	H	α-helix	trans	-59	-33.6	175.4	-70.5	176.4	0	0	0	112.9	F776 L779 P842 D843 N844 I850 C851 Y858	F776-L847 HydrophobicContact CB-CD1 4.48Å; F776-L847 HydrophobicContact CD1-CB 3.79Å; F776-L847 HydrophobicContact CE1-CB 3.91Å; F776-L847 HydrophobicContact CG-CB 4.44Å; F776-L847 HydrophobicContact CG-CD1 4.47Å; L779-L847 HydrophobicContact CD2-CD2 4.12Å; P842-L847 HydrophobicContact CB-CD2 4.25Å; P842-L847 HydrophobicContact CB-CG 4.23Å; P842-L847 HydrophobicContact CG-CD1 4.19Å; P842-L847 HydrophobicContact CG-CD2 3.83Å; P842-L847 HydrophobicContact CG-CG 4.07Å; D843-L847 PolarHBondContact O-N 3.03Å; N844-L847 PolarHBondContact O-N 3Å; L847-I850 HydrophobicContact CD2-CG2 4.46Å; L847-C851 VanDerWaalsContact O-CB 3.28Å; L847-C851 WeakPolarHBondContact O-CB 3.27Å; L847-C851 PolarHBondContact O-N 2.75Å; L847-C851 PolarHBondContact O-SG 3Å; L847-Y858 HydrophobicContact CD2-CD1 4.19Å; L847-Y858 HydrophobicContact CD2-CE1 3.87Å
848	E	90.4	Very high	90.8	Very high	77 Å²	77	41.9 Å²	41.9	36%	0.36	22%	0.218	S	C	.	.	H	α-helix	trans	-73.2	-26.6	178	-86.5	-164.8	-143.9	0	0	115.2	N756 K773 F776 N844 F846 C851	N756-E848 PolarHBondContact ND2-OE2 2.99Å; K773-E848 PolarHBondContact NZ-O 2.86Å; F776-E848 HydrophobicContact CE1-CG 4.01Å; F776-E848 HydrophobicContact CZ-CG 3.66Å; N844-E848 WeakPolarHBondContact O-CB 3.37Å; N844-E848 PolarHBondContact O-N 3.37Å; F846-E848 PolarHBondContact O-N 2.92Å; E848-C851 VanDerWaalsContact C-SG 3.6Å; E848-C851 PolarHBondContact O-SG 3.46Å
849	A	88.9	Confident	90.7	Very high	2 Å²	2	41.8 Å²	41.8	2%	0.017	22%	0.217	C	C	.	.	H	α-helix	trans	-82.4	-44.2	174.4	0	0	0	0	0	111.5	N756 P758 Y815 H845 F846	N756-A849 VanDerWaalsContact O-CB 3.3Å; N756-A849 WeakPolarHBondContact O-CB 3.35Å; P758-A849 HydrophobicContact CB-CB 4.07Å; P758-A849 HydrophobicContact CG-CB 4.03Å; Y815-A849 HydrophobicContact CD2-CB 3.97Å; Y815-A849 HydrophobicContact CE2-CB 3.94Å; H845-A849 PolarHBondContact O-N 3.03Å; F846-A849 PolarHBondContact O-N 2.91Å
850	I	91.6	Very high	90.7	Very high	9 Å²	9	41 Å²	41	5%	0.046	22%	0.223	C	C	.	.	H	α-helix	trans	-75.3	-29.4	-171.5	-163.9	170.2	0	0	0	113.9	L779 I818 L836 F846 L847 C852 F853 V856	L779-I850 HydrophobicContact CD2-CG2 3.67Å; I818-I850 HydrophobicContact CD1-CD1 3.41Å; I818-I850 VanDerWaalsContact CD1-CD1 3.41Å; I818-I850 HydrophobicContact CD1-CG1 3.8Å; L836-I850 HydrophobicContact CD1-CD1 3.68Å; F846-I850 HydrophobicContact CD1-CD1 4.45Å; F846-I850 HydrophobicContact CD1-CG2 4.35Å; F846-I850 HydrophobicContact CE1-CB 4.44Å; F846-I850 HydrophobicContact CE1-CD1 3.53Å; F846-I850 HydrophobicContact CE1-CG2 4.39Å; F846-I850 HydrophobicContact CZ-CD1 3.84Å; F846-I850 VanDerWaalsContact O-CG2 3.25Å; F846-I850 WeakPolarHBondContact O-CG2 3.4Å; F846-I850 PolarHBondContact O-N 2.95Å; L847-I850 HydrophobicContact CD2-CG2 4.46Å; I850-C852 PolarHBondContact O-N 3.22Å; I850-F853 PolarHBondContact O-N 2.7Å; I850-V856 HydrophobicContact CD1-CG1 3.59Å; I850-V856 HydrophobicContact CG1-CB 4.31Å; I850-V856 HydrophobicContact CG1-CG1 3.75Å
851	C	90.9	Very high	90.6	Very high	2 Å²	2	38 Å²	38	1%	0.014	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-8.8	-178.9	60.9	0	0	0	0	115.8	K773 A774 L779 L847 E848	K773-C851 VanDerWaalsContact CD-SG 3.56Å; K773-C851 WeakPolarHBondContact CE-SG 3.46Å; K773-C851 HydrophobicContact CG-CB 4.31Å; K773-C851 VanDerWaalsContact CG-SG 3.58Å; K773-C851 PolarHBondContact NZ-SG 3.4Å; K773-C851 VanDerWaalsContact NZ-SG 3.42Å; A774-C851 PolarHBondContact N-O 2.96Å; A774-C851 WeakPolarHBondContact O-CB 3.17Å; L779-C851 HydrophobicContact CD1-CB 4.27Å; L779-C851 HydrophobicContact CD2-CB 4.06Å; L847-C851 VanDerWaalsContact O-CB 3.28Å; L847-C851 WeakPolarHBondContact O-CB 3.27Å; L847-C851 PolarHBondContact O-N 2.75Å; L847-C851 PolarHBondContact O-SG 3Å; E848-C851 VanDerWaalsContact C-SG 3.6Å; E848-C851 PolarHBondContact O-SG 3.46Å
852	C	90.4	Very high	90.6	Very high	8 Å²	8	33.4 Å²	33.4	5%	0.054	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-18.4	176.1	-59.4	0	0	0	0	112.2	L769 L770 I850	L769-C852 VanDerWaalsContact CA-O 3.3Å; L769-C852 WeakPolarHBondContact CA-O 3.28Å; L769-C852 HydrophobicContact CD2-CB 4.27Å; L770-C852 PolarHBondContact N-O 2.85Å; I850-C852 PolarHBondContact O-N 3.22Å
853	F	91.9	Very high	90.5	Very high	5 Å²	5	33.1 Å²	33.1	2%	0.022	18%	0.178	C	C	.	.	S	Bend	trans	-88.8	141.6	-178.4	-61.3	-63.1	0	0	0	112.3	P754 C767 L769 Y815 I818 V819 R822 I850 V856	P754-F853 HydrophobicContact CB-CE1 4.32Å; P754-F853 HydrophobicContact CB-CZ 4.09Å; P754-F853 HydrophobicContact CG-CZ 4.27Å; C767-F853 HydrophobicContact CB-CD1 4.34Å; C767-F853 HydrophobicContact CB-CE1 3.86Å; L769-F853 HydrophobicContact CD2-CD1 3.84Å; L769-F853 HydrophobicContact CD2-CE1 3.94Å; Y815-F853 HydrophobicContact CD2-CE2 4.14Å; Y815-F853 AromaticContact CE2-CE2 3.78Å; Y815-F853 HydrophobicContact CE2-CE2 3.78Å; Y815-F853 AromaticContact CE2-CZ 3.94Å; Y815-F853 HydrophobicContact CE2-CZ 3.94Å; I818-F853 HydrophobicContact CG2-CB 4.37Å; I818-F853 HydrophobicContact CG2-CD2 3.66Å; I818-F853 HydrophobicContact CG2-CE2 4.03Å; I818-F853 HydrophobicContact CG2-CG 3.96Å; V819-F853 HydrophobicContact CG2-CZ 4.2Å; R822-F853 HydrophobicContact CB-CD1 3.96Å; R822-F853 HydrophobicContact CB-CE1 4.39Å; R822-F853 HydrophobicContact CG-CB 4.34Å; R822-F853 HydrophobicContact CG-CD1 4.21Å; R822-F853 HydrophobicContact CG-CG 4.43Å; I850-F853 PolarHBondContact O-N 2.7Å; F853-V856 HydrophobicContact CB-CG2 3.87Å
854	P	91.3	Very high	90.5	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.006	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	143.6	177.8	30.2	-35	0	0	0	112.1	Y749 H768 L770 R822 V856	Y749-P854 HydrophobicContact CD1-CB 3.88Å; Y749-P854 HydrophobicContact CD1-CG 4.38Å; Y749-P854 HydrophobicContact CE1-CB 3.45Å; Y749-P854 VanDerWaalsContact CE1-CB 3.45Å; Y749-P854 HydrophobicContact CE1-CG 4.34Å; Y749-P854 HydrophobicContact CE2-CB 4.35Å; Y749-P854 HydrophobicContact CG-CB 4.5Å; H768-P854 HydrophobicContact CB-CG 4.39Å; H768-P854 WeakPolarHBondContact O-CD 3.26Å; L770-P854 HydrophobicContact CD2-CB 3.85Å; L770-P854 HydrophobicContact CG-CB 4.31Å; R822-P854 PolarHBondContact NE-O 2.95Å; R822-P854 PolarHBondContact NH2-O 2.97Å; R822-P854 VanDerWaalsContact NH2-O 3.13Å; P854-V856 WeakPolarHBondContact O-CG2 3.29Å; P854-V856 PolarHBondContact O-N 3.28Å
855	M	88.6	Confident	90.5	Very high	47 Å²	47	30.3 Å²	30.3	23%	0.232	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	47.7	171.2	-57	170	60.1	0	0	113.3	Y749 F798 R822 P833 I834 Y857	Y749-M855 PolarHBondContact OH-SD 2.92Å; Y749-M855 VanDerWaalsContact OH-SD 3.39Å; F798-M855 HydrophobicContact CD1-CE 4.25Å; R822-M855 PolarHBondContact NH2-O 2.83Å; P833-M855 WeakPolarHBondContact CA-O 3.17Å; P833-M855 HydrophobicContact CB-CB 4.26Å; P833-M855 HydrophobicContact CB-CE 3.86Å; P833-M855 HydrophobicContact CG-CE 4.03Å; I834-M855 PolarHBondContact N-O 3.25Å; M855-Y857 HydrophobicContact CB-CE2 4.47Å
856	V	93.1	Very high	90.7	Very high	8 Å²	8	24.6 Å²	24.6	5%	0.048	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	129.3	173.8	-169.1	0	0	0	0	109.2	I818 I834 I850 F853 P854	I818-V856 HydrophobicContact CD1-CG1 4.15Å; I818-V856 HydrophobicContact CG2-CG2 4.18Å; I834-V856 HydrophobicContact CB-CG1 4.2Å; I834-V856 HydrophobicContact CB-CG2 4.47Å; I834-V856 HydrophobicContact CD1-CG2 4.44Å; I834-V856 HydrophobicContact CG2-CG1 4.3Å; I834-V856 WeakPolarHBondContact O-CA 3.33Å; I850-V856 HydrophobicContact CD1-CG1 3.59Å; I850-V856 HydrophobicContact CG1-CB 4.31Å; I850-V856 HydrophobicContact CG1-CG1 3.75Å; F853-V856 HydrophobicContact CB-CG2 3.87Å; P854-V856 WeakPolarHBondContact O-CG2 3.29Å; P854-V856 PolarHBondContact O-N 3.28Å
857	Y	92.4	Very high	90.7	Very high	38 Å²	38	26.4 Å²	26.4	15%	0.149	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	167.7	-172.2	-54	-88.6	0	0	0	111.6	L779 L781 Y796 F798 I834 V835 L836 M855	L779-Y857 CarbonylContact O-C 3.24Å; L779-Y857 WeakPolarHBondContact O-CA 3.35Å; L779-Y857 WeakPolarHBondContact O-CB 3.49Å; L781-Y857 HydrophobicContact CD2-CD1 3.83Å; L781-Y857 HydrophobicContact CD2-CE1 4.44Å; L781-Y857 HydrophobicContact CD2-CG 3.95Å; L781-Y857 HydrophobicContact CG-CD1 4.47Å; L781-Y857 HydrophobicContact CG-CG 4.3Å; Y796-Y857 HydrophobicContact CE1-CE1 4.23Å; F798-Y857 AromaticContact CE1-CE2 3.71Å; F798-Y857 HydrophobicContact CE1-CE2 3.71Å; F798-Y857 HydrophobicContact CZ-CD2 4.05Å; F798-Y857 AromaticContact CZ-CE2 3.58Å; F798-Y857 HydrophobicContact CZ-CE2 3.58Å; I834-Y857 PolarHBondContact O-N 3.35Å; V835-Y857 WeakPolarHBondContact CA-O 3.46Å; L836-Y857 PolarHBondContact N-O 2.91Å; M855-Y857 HydrophobicContact CB-CE2 4.47Å
858	Y	93.4	Very high	90.7	Very high	38 Å²	38	26.7 Å²	26.7	15%	0.149	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	157.5	171.8	79.7	-79.6	0	0	0	113.1	L779 R780 L781 L836 L838 P842 L847	L779-Y858 HydrophobicContact CB-CD1 3.95Å; L779-Y858 HydrophobicContact CB-CE1 4Å; L779-Y858 WeakPolarHBondContact O-CD1 3.35Å; L779-Y858 PolarHBondContact O-N 3.3Å; R780-Y858 WeakPolarHBondContact CA-O 3.37Å; R780-Y858 HydrophobicContact CB-CE1 3.83Å; R780-Y858 HydrophobicContact CB-CE2 4.47Å; R780-Y858 HydrophobicContact CG-CE2 4.35Å; L781-Y858 PolarHBondContact N-O 3.42Å; L781-Y858 VanDerWaalsContact N-O 3.08Å; L836-Y858 CarbonylContact O-C 3.58Å; L836-Y858 WeakPolarHBondContact O-CA 3.26Å; L838-Y858 HydrophobicContact CD1-CD2 4.49Å; P842-Y858 VanDerWaalsContact CD-CE2 3.47Å; P842-Y858 HydrophobicContact CG-CD1 4.39Å; P842-Y858 HydrophobicContact CG-CD2 3.74Å; P842-Y858 HydrophobicContact CG-CE1 4.25Å; P842-Y858 HydrophobicContact CG-CE2 3.56Å; P842-Y858 HydrophobicContact CG-CG 4.15Å; L847-Y858 HydrophobicContact CD2-CD1 4.19Å; L847-Y858 HydrophobicContact CD2-CE1 3.87Å
859	M	92	Very high	90.7	Very high	1 Å²	1	23 Å²	23	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	138.4	174.1	174.6	170.4	-82.5	0	0	109.3	L781 D782 L836 L837 L838 Q871 C872	L781-M859 HydrophobicContact CB-CE 4.02Å; D782-M859 HydrophobicContact CB-CE 3.8Å; D782-M859 HydrophobicContact CB-CG 4.08Å; L836-M859 PolarHBondContact O-N 3.3Å; L837-M859 HydrophobicContact CD1-CG 4.36Å; L838-M859 PolarHBondContact N-O 3.44Å; M859-Q871 HydrophobicContact CE-CB 3.58Å; M859-Q871 HydrophobicContact SD-CB 3.94Å; M859-C872 PolarHBondContact SD-SG 2.96Å
860	G	89.8	Confident	90.7	Very high	42 Å²	42	23.2 Å²	23.2	43%	0.433	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	127.4	169.9	0	0	0	0	0	110.4	L838	L838-G860 WeakPolarHBondContact O-CA 3.5Å
861	G	89.2	Confident	90.5	Very high	14 Å²	14	24.3 Å²	24.3	14%	0.144	14%	0.139	C	C	.	.			trans	159.8	-178.1	-179.1	0	0	0	0	0	113.2	L838 D839	L838-G861 CarbonylContact C-O 3.45Å; L838-G861 PolarHBondContact O-N 2.7Å; L838-G861 VanDerWaalsContact O-O 3.09Å; D839-G861 PolarHBondContact N-O 3.29Å
862	S	89.4	Confident	90.4	Very high	13 Å²	13	24.2 Å²	24.2	9%	0.091	14%	0.138	C	C	.	.			trans	-142.1	158.9	-175.2	71.4	0	0	0	0	111.7	D839 D864 N865	D839-S862 WeakPolarHBondContact OD1-CB 3.26Å; S862-D864 PolarHBondContact O-N 3.1Å; S862-N865 PolarHBondContact O-N 2.79Å
863	I	89.7	Confident	90.2	Very high	9 Å²	9	24 Å²	24	5%	0.046	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-29.5	177.7	-54.8	161.5	0	0	0	111.5	S806 L837 N865 L869 V882 N904 M908	S806-I863 WeakPolarHBondContact OG-CD1 3.33Å; S806-I863 WeakPolarHBondContact OG-CG1 3.35Å; L837-I863 HydrophobicContact CD2-CG1 4.46Å; I863-N865 PolarHBondContact O-N 2.83Å; I863-L869 HydrophobicContact CG2-CD1 4.2Å; I863-V882 HydrophobicContact CD1-CB 4.22Å; I863-V882 HydrophobicContact CD1-CG1 3.63Å; I863-V882 HydrophobicContact CD1-CG2 3.65Å; I863-N904 HydrophobicContact CB-CB 4.41Å; I863-N904 HydrophobicContact CG2-CB 3.94Å; I863-M908 HydrophobicContact CG2-CE 4.04Å; I863-M908 HydrophobicContact CG2-CG 3.97Å
864	D	88.4	Confident	90.1	Very high	75 Å²	75	23.9 Å²	23.9	40%	0.401	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-35.3	173.7	-52.8	22.2	0	0	0	111.5	S862 L866 K900 N904	S862-D864 PolarHBondContact O-N 3.1Å; D864-L866 PolarHBondContact O-N 3.07Å; D864-K900 VanDerWaalsContact CG-CE 3.5Å; D864-K900 WeakPolarHBondContact OD1-CE 3.19Å; D864-K900 IonicContact OD1-NZ 2.77Å; D864-K900 PolarHBondContact OD1-NZ 3.02Å; D864-K900 WeakPolarHBondContact OD2-CE 3.22Å; D864-K900 IonicContact OD2-NZ 3.78Å; D864-K900 PolarHBondContact OD2-NZ 3.35Å; D864-N904 PolarHBondContact OD1-ND2 2.91Å
865	N	90.6	Very high	89.9	Confident	86 Å²	86	25.4 Å²	25.4	46%	0.46	15%	0.145	S	C	.	.			trans	-93.5	94.8	-174.9	-71.3	-16.5	0	0	0	111.1	S862 I863 D867 S868 L869	S862-N865 PolarHBondContact O-N 2.79Å; I863-N865 PolarHBondContact O-N 2.83Å; N865-D867 PolarHBondContact O-N 3.15Å; N865-D867 VanDerWaalsContact O-N 3.11Å; N865-S868 PolarHBondContact O-N 3.03Å; N865-S868 VanDerWaalsContact O-N 3.11Å; N865-L869 PolarHBondContact O-N 3.23Å
866	L	90.1	Very high	89.7	Confident	27 Å²	27	26.2 Å²	26.2	14%	0.141	15%	0.146	C	C	.	.	H	α-helix	trans	-52.2	-34.1	176.1	-179.9	60.5	0	0	0	113.3	D864 L869 L870 L911 F912 L1145 R1149	D864-L866 PolarHBondContact O-N 3.07Å; L866-L869 PolarHBondContact O-N 3.07Å; L866-L870 HydrophobicContact CD1-CG 4.32Å; L866-L870 HydrophobicContact CG-CD1 4.18Å; L866-L870 HydrophobicContact CG-CG 4.43Å; L866-L870 WeakPolarHBondContact O-CG 3.44Å; L866-L870 PolarHBondContact O-N 3.04Å; L866-L911 HydrophobicContact CD1-CD1 4.26Å; L866-F912 HydrophobicContact CD1-CE2 4.04Å; L866-F912 HydrophobicContact CD1-CZ 4.07Å; L866-L1145 HydrophobicContact CD2-CD2 4.38Å; L866-L1145 HydrophobicContact CD2-CG 4.26Å; L866-R1149 HydrophobicContact CD2-CG 4.41Å
867	D	90.8	Very high	89.5	Confident	44 Å²	44	26.4 Å²	26.4	24%	0.235	15%	0.148	C	C	.	.	H	α-helix	trans	-63.5	-44.7	179.9	-58.5	-49.1	0	0	0	111.7	N865 L869 L870 Q871 R1149 L1153	N865-D867 PolarHBondContact O-N 3.15Å; N865-D867 VanDerWaalsContact O-N 3.11Å; D867-L869 VanDerWaalsContact C-N 3.33Å; D867-L869 PolarHBondContact O-N 3.46Å; D867-L870 WeakPolarHBondContact O-CB 3.2Å; D867-L870 PolarHBondContact O-N 2.87Å; D867-L870 VanDerWaalsContact O-N 3.11Å; D867-Q871 PolarHBondContact O-N 2.9Å; D867-R1149 WeakPolarHBondContact OD1-CD 3.43Å; D867-R1149 IonicContact OD1-CZ 3.48Å; D867-R1149 IonicContact OD1-NE 3.34Å; D867-R1149 IonicContact OD1-NH1 3.85Å; D867-R1149 PolarHBondContact OD1-NH1 3.3Å; D867-R1149 IonicContact OD2-CZ 3.06Å; D867-R1149 IonicContact OD2-NH1 2.7Å; D867-R1149 PolarHBondContact OD2-NH1 2.83Å; D867-R1149 IonicContact OD2-NH2 3.44Å; D867-L1153 HydrophobicContact CB-CD1 4.38Å
868	S	91.1	Very high	89.2	Confident	15 Å²	15	27.1 Å²	27.1	11%	0.105	15%	0.154	C	C	.	.	H	α-helix	trans	-62.2	-38.9	176.6	-54	0	0	0	0	112.3	N865 L870 Q871 C872	N865-S868 PolarHBondContact O-N 3.03Å; N865-S868 VanDerWaalsContact O-N 3.11Å; S868-L870 VanDerWaalsContact C-N 3.31Å; S868-L870 PolarHBondContact O-N 3.11Å; S868-Q871 PolarHBondContact O-N 3.31Å; S868-C872 WeakPolarHBondContact O-CB 3.47Å; S868-C872 PolarHBondContact O-N 3.16Å; S868-C872 PolarHBondContact O-SG 2.89Å
869	L	90.5	Very high	89.2	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-66.4	-32.5	175.6	-63.6	175.3	0	0	0	112.5	L837 I863 N865 L866 D867 G873 I874 M908	L837-L869 HydrophobicContact CD2-CD2 3.61Å; I863-L869 HydrophobicContact CG2-CD1 4.2Å; N865-L869 PolarHBondContact O-N 3.23Å; L866-L869 PolarHBondContact O-N 3.07Å; D867-L869 VanDerWaalsContact C-N 3.33Å; D867-L869 PolarHBondContact O-N 3.46Å; L869-G873 PolarHBondContact O-N 2.81Å; L869-I874 HydrophobicContact CB-CB 4.4Å; L869-I874 HydrophobicContact CB-CD1 4.21Å; L869-I874 HydrophobicContact CB-CG2 4.14Å; L869-I874 HydrophobicContact CD1-CD1 4.21Å; L869-I874 HydrophobicContact CD2-CD1 4.31Å; L869-I874 WeakPolarHBondContact O-CB 3.42Å; L869-I874 VanDerWaalsContact O-CG2 3.27Å; L869-I874 WeakPolarHBondContact O-CG2 3.43Å; L869-I874 PolarHBondContact O-N 3.47Å; L869-I874 VanDerWaalsContact O-N 3.09Å; L869-M908 HydrophobicContact CD1-CE 3.4Å; L869-M908 VanDerWaalsContact CD1-CE 3.4Å; L869-M908 HydrophobicContact CD1-SD 3.55Å; L869-M908 VanDerWaalsContact CD1-SD 3.55Å
870	L	89.8	Confident	89.3	Confident	5 Å²	5	25.6 Å²	25.6	3%	0.026	15%	0.149	C	C	.	.	H	α-helix	trans	-73	-41.8	176.2	-72.2	175.7	0	0	0	112	L866 D867 S868 C872 G873 I874 I875 F912 V1146 R1149 M1150 L1153 L1155	L866-L870 HydrophobicContact CD1-CG 4.32Å; L866-L870 HydrophobicContact CG-CD1 4.18Å; L866-L870 HydrophobicContact CG-CG 4.43Å; L866-L870 WeakPolarHBondContact O-CG 3.44Å; L866-L870 PolarHBondContact O-N 3.04Å; D867-L870 WeakPolarHBondContact O-CB 3.2Å; D867-L870 PolarHBondContact O-N 2.87Å; D867-L870 VanDerWaalsContact O-N 3.11Å; S868-L870 VanDerWaalsContact C-N 3.31Å; S868-L870 PolarHBondContact O-N 3.11Å; L870-C872 VanDerWaalsContact C-N 3.32Å; L870-G873 WeakPolarHBondContact O-CA 3.27Å; L870-G873 PolarHBondContact O-N 3.08Å; L870-I874 HydrophobicContact CD2-CG2 4.36Å; L870-I875 HydrophobicContact CD2-CD1 3.72Å; L870-I875 HydrophobicContact CD2-CG1 4.2Å; L870-F912 HydrophobicContact CD2-CZ 4.38Å; L870-V1146 HydrophobicContact CD2-CG1 4.21Å; L870-R1149 HydrophobicContact CD1-CB 3.59Å; L870-M1150 HydrophobicContact CD1-CG 4.26Å; L870-M1150 HydrophobicContact CD2-CG 4.07Å; L870-L1153 HydrophobicContact CB-CD1 3.6Å; L870-L1153 HydrophobicContact CD1-CD1 4.14Å; L870-L1155 HydrophobicContact CB-CD1 4.15Å; L870-L1155 WeakPolarHBondContact O-CD1 3.26Å
871	Q	88.3	Confident	89.5	Confident	32 Å²	32	23.6 Å²	23.6	15%	0.15	13%	0.128	C	C	.	.	H	α-helix	trans	-63.3	-37.8	172.5	-64.1	174.5	-75.9	0	0	111.8	D792 A793 M859 D867 S868 G873 L1153	D792-Q871 WeakPolarHBondContact OD1-CA 3.08Å; A793-Q871 VanDerWaalsContact CB-O 3.24Å; A793-Q871 WeakPolarHBondContact CB-O 3.3Å; A793-Q871 PolarHBondContact N-O 3.33Å; M859-Q871 HydrophobicContact CE-CB 3.58Å; M859-Q871 HydrophobicContact SD-CB 3.94Å; D867-Q871 PolarHBondContact O-N 2.9Å; S868-Q871 PolarHBondContact O-N 3.31Å; Q871-G873 PolarHBondContact O-N 2.82Å; Q871-L1153 HydrophobicContact CG-CD1 4.15Å; Q871-L1153 HydrophobicContact CG-CD2 4.1Å
872	C	87.5	Confident	89.7	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.6	169.2	-74.8	0	0	0	0	113.5	A793 L802 I804 V835 M859 S868 L870	A793-C872 VanDerWaalsContact CB-O 3.26Å; A793-C872 WeakPolarHBondContact CB-O 3.35Å; L802-C872 WeakPolarHBondContact CD2-O 3.47Å; I804-C872 HydrophobicContact CD1-CB 4Å; V835-C872 HydrophobicContact CG1-CB 4.44Å; M859-C872 PolarHBondContact SD-SG 2.96Å; S868-C872 WeakPolarHBondContact O-CB 3.47Å; S868-C872 PolarHBondContact O-N 3.16Å; S868-C872 PolarHBondContact O-SG 2.89Å; L870-C872 VanDerWaalsContact C-N 3.32Å
873	G	87.3	Confident	89.8	Confident	4 Å²	4	22.6 Å²	22.6	4%	0.041	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.1	26.8	178.3	0	0	0	0	0	116	L869 L870 Q871 I875 Y876	L869-G873 PolarHBondContact O-N 2.81Å; L870-G873 WeakPolarHBondContact O-CA 3.27Å; L870-G873 PolarHBondContact O-N 3.08Å; Q871-G873 PolarHBondContact O-N 2.82Å; G873-I875 PolarHBondContact O-N 3.44Å; G873-Y876 WeakPolarHBondContact O-CD1 3.48Å; G873-Y876 VanDerWaalsContact O-CE1 3.28Å; G873-Y876 WeakPolarHBondContact O-CE1 3.5Å; G873-Y876 PolarHBondContact O-N 3.04Å; G873-Y876 VanDerWaalsContact O-N 3.1Å
874	I	89.3	Confident	89.5	Confident	3 Å²	3	22.5 Å²	22.5	2%	0.015	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-47.5	-27.1	-176.8	-167.6	166.4	0	0	0	115.8	I804 L869 L870 Y876 A877 L880 M908 F912 L915	I804-I874 HydrophobicContact CD1-CB 3.98Å; I804-I874 HydrophobicContact CD1-CG1 4.32Å; L869-I874 HydrophobicContact CB-CB 4.4Å; L869-I874 HydrophobicContact CB-CD1 4.21Å; L869-I874 HydrophobicContact CB-CG2 4.14Å; L869-I874 HydrophobicContact CD1-CD1 4.21Å; L869-I874 HydrophobicContact CD2-CD1 4.31Å; L869-I874 WeakPolarHBondContact O-CB 3.42Å; L869-I874 VanDerWaalsContact O-CG2 3.27Å; L869-I874 WeakPolarHBondContact O-CG2 3.43Å; L869-I874 PolarHBondContact O-N 3.47Å; L869-I874 VanDerWaalsContact O-N 3.09Å; L870-I874 HydrophobicContact CD2-CG2 4.36Å; I874-Y876 VanDerWaalsContact C-N 3.26Å; I874-Y876 PolarHBondContact O-N 3.14Å; I874-A877 PolarHBondContact O-N 2.83Å; I874-L880 HydrophobicContact CD1-CD2 4.23Å; I874-M908 HydrophobicContact CD1-SD 4.27Å; I874-F912 HydrophobicContact CD1-CD2 3.97Å; I874-F912 HydrophobicContact CD1-CE2 4.06Å; I874-F912 HydrophobicContact CG1-CD2 4.36Å; I874-F912 HydrophobicContact CG1-CE2 4.49Å; I874-F912 HydrophobicContact CG2-CD2 4.42Å; I874-F912 HydrophobicContact CG2-CE1 4.24Å; I874-F912 HydrophobicContact CG2-CE2 3.82Å; I874-F912 HydrophobicContact CG2-CZ 3.72Å; I874-L915 HydrophobicContact CD1-CD2 3.74Å; I874-L915 HydrophobicContact CG1-CD2 3.68Å
875	I	86.4	Confident	89.2	Confident	33 Å²	33	20.2 Å²	20.2	17%	0.169	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-62.7	-28.7	-178.3	-63.9	165.9	0	0	0	113	L870 G873 F912 V1146 M1150 Y1160	L870-I875 HydrophobicContact CD2-CD1 3.72Å; L870-I875 HydrophobicContact CD2-CG1 4.2Å; G873-I875 PolarHBondContact O-N 3.44Å; I875-F912 HydrophobicContact CG1-CE1 3.91Å; I875-V1146 HydrophobicContact CD1-CG1 4.31Å; I875-M1150 HydrophobicContact CD1-CE 3.56Å; I875-M1150 HydrophobicContact CD1-CG 4.13Å; I875-M1150 HydrophobicContact CD1-SD 3.33Å; I875-M1150 WeakPolarHBondContact CD1-SD 3.36Å; I875-Y1160 HydrophobicContact CD1-CD2 4.49Å
876	Y	85.4	Confident	88.6	Confident	64 Å²	64	19 Å²	19	25%	0.251	10%	0.096	S	C	.	.	G	3₁₀ helix	trans	-118.5	14	179.2	64	-88.8	0	0	0	112.9	A793 K794 F798 L802 G873 I874	A793-Y876 VanDerWaalsContact C-OH 3.31Å; A793-Y876 PolarHBondContact O-OH 3.43Å; K794-Y876 WeakPolarHBondContact CA-OH 3.46Å; K794-Y876 HydrophobicContact CB-CE1 4.21Å; K794-Y876 HydrophobicContact CD-CE1 4.43Å; K794-Y876 HydrophobicContact CG-CE1 4.22Å; K794-Y876 PolarHBondContact N-OH 3.28Å; F798-Y876 HydrophobicContact CD2-CE2 4.48Å; L802-Y876 HydrophobicContact CB-CE2 4.3Å; G873-Y876 WeakPolarHBondContact O-CD1 3.48Å; G873-Y876 VanDerWaalsContact O-CE1 3.28Å; G873-Y876 WeakPolarHBondContact O-CE1 3.5Å; G873-Y876 PolarHBondContact O-N 3.04Å; G873-Y876 VanDerWaalsContact O-N 3.1Å; I874-Y876 VanDerWaalsContact C-N 3.26Å; I874-Y876 PolarHBondContact O-N 3.14Å
877	A	88.6	Confident	87.9	Confident	11 Å²	11	21.2 Å²	21.2	9%	0.091	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	146.8	167.7	0	0	0	0	0	110.7	L802 I804 I874 L915	L802-A877 HydrophobicContact CB-CB 4.07Å; L802-A877 CarbonylContact O-C 3.5Å; L802-A877 VanDerWaalsContact O-CA 3.27Å; L802-A877 WeakPolarHBondContact O-CA 3.49Å; L802-A877 WeakPolarHBondContact O-CB 3.39Å; I804-A877 HydrophobicContact CD1-CB 3.98Å; I804-A877 HydrophobicContact CG1-CB 4.22Å; I874-A877 PolarHBondContact O-N 2.83Å; A877-L915 HydrophobicContact CB-CD1 3.96Å
878	D	86.9	Confident	87.3	Confident	53 Å²	53	20.6 Å²	20.6	28%	0.283	11%	0.112	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-49.9	170.9	-157.9	57.7	0	0	0	110.2	K801 L802 S916	K801-D878 HydrophobicContact CB-CB 3.82Å; K801-D878 HydrophobicContact CD-CB 3.59Å; K801-D878 WeakPolarHBondContact CD-OD1 3.31Å; K801-D878 WeakPolarHBondContact CE-OD1 3.44Å; K801-D878 HydrophobicContact CG-CB 4.42Å; K801-D878 IonicContact NZ-OD1 2.95Å; K801-D878 PolarHBondContact NZ-OD1 3.11Å; L802-D878 PolarHBondContact O-N 2.95Å; D878-S916 WeakPolarHBondContact O-CB 3.29Å; D878-S916 PolarHBondContact O-N 2.87Å; D878-S916 VanDerWaalsContact O-N 3.13Å
879	N	91.9	Very high	86.4	Confident	7 Å²	7	20.3 Å²	20.3	4%	0.037	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	132.1	-174.5	-65.3	-82.2	0	0	0	111.3	C518 I804 S916 I918	C518-N879 HydrophobicContact CB-CB 4.37Å; I804-N879 PolarHBondContact N-O 3.41Å; N879-S916 CarbonylContact C-O 3.57Å; N879-S916 WeakPolarHBondContact CA-O 3.36Å; N879-S916 WeakPolarHBondContact OD1-CB 3.35Å; N879-S916 PolarHBondContact OD1-OG 3.26Å; N879-I918 HydrophobicContact CB-CD1 4.24Å
880	L	93.8	Very high	85.6	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	118.2	163.7	172.1	65.3	0	0	0	108.7	I804 I874 V882 M908 L915 S916 I917 I918	I804-L880 HydrophobicContact CB-CD1 3.98Å; I804-L880 HydrophobicContact CG2-CD1 3.78Å; I804-L880 CarbonylContact O-C 3.59Å; I804-L880 WeakPolarHBondContact O-CA 3.41Å; I874-L880 HydrophobicContact CD1-CD2 4.23Å; L880-V882 HydrophobicContact CD2-CG2 4.26Å; L880-V882 HydrophobicContact CG-CG2 4.07Å; L880-M908 HydrophobicContact CD2-CG 4.48Å; L880-L915 HydrophobicContact CB-CD1 4.31Å; L880-L915 HydrophobicContact CB-CD2 3.83Å; L880-L915 HydrophobicContact CB-CG 4.18Å; L880-L915 HydrophobicContact CD2-CD2 4.04Å; L880-S916 PolarHBondContact N-O 2.64Å; L880-I917 HydrophobicContact CB-CG2 4.49Å; L880-I917 HydrophobicContact CD2-CG2 4.3Å; L880-I917 HydrophobicContact CG-CG2 4.4Å; L880-I917 WeakPolarHBondContact O-CA 3.41Å; L880-I918 PolarHBondContact O-N 3.31Å
881	V	94.8	Very high	84.9	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	118.2	173.4	-179.5	0	0	0	0	108.5	L514 C518 I804 V805 S806 F817 V883 I918	L514-V881 HydrophobicContact CB-CG1 4.13Å; L514-V881 HydrophobicContact CD1-CG1 4.16Å; L514-V881 HydrophobicContact CD2-CG1 4.27Å; L514-V881 HydrophobicContact CG-CG1 4.43Å; C518-V881 WeakPolarHBondContact SG-CG2 3.48Å; I804-V881 PolarHBondContact O-N 3.08Å; V805-V881 WeakPolarHBondContact CA-O 3.36Å; V805-V881 HydrophobicContact CB-CB 4.48Å; V805-V881 HydrophobicContact CG1-CB 4.25Å; V805-V881 HydrophobicContact CG1-CG1 4.24Å; V805-V881 HydrophobicContact CG2-CB 4.28Å; S806-V881 PolarHBondContact N-O 2.97Å; F817-V881 HydrophobicContact CE2-CG1 4.24Å; F817-V881 HydrophobicContact CE2-CG2 4.05Å; F817-V881 HydrophobicContact CZ-CG2 4.03Å; V881-V883 HydrophobicContact CG1-CG2 4.3Å; V881-I918 WeakPolarHBondContact CA-O 3.4Å; V881-I918 HydrophobicContact CG2-CB 4.43Å; V881-I918 HydrophobicContact CG2-CD1 4.11Å
882	V	93.4	Very high	84.2	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	106.4	173.1	-179	0	0	0	0	108.3	I863 L880 T901 V905 I917 I918 T919 E920	I863-V882 HydrophobicContact CD1-CB 4.22Å; I863-V882 HydrophobicContact CD1-CG1 3.63Å; I863-V882 HydrophobicContact CD1-CG2 3.65Å; L880-V882 HydrophobicContact CD2-CG2 4.26Å; L880-V882 HydrophobicContact CG-CG2 4.07Å; V882-T901 HydrophobicContact CG1-CG2 4.09Å; V882-V905 HydrophobicContact CB-CG2 4.25Å; V882-V905 HydrophobicContact CG1-CG2 4.3Å; V882-V905 HydrophobicContact CG2-CG2 3.79Å; V882-I917 HydrophobicContact CG2-CG2 4.31Å; V882-I918 PolarHBondContact N-O 3.1Å; V882-T919 HydrophobicContact CB-CG2 4.26Å; V882-E920 PolarHBondContact O-N 3.41Å
883	V	90.8	Very high	83.8	Confident	6 Å²	6	36.8 Å²	36.8	4%	0.036	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-80.8	140.5	168.9	-170	0	0	0	0	107.5	Y511 V805 S806 A807 V881 E920	Y511-V883 HydrophobicContact CE1-CG1 4Å; Y511-V883 HydrophobicContact CE1-CG2 4.01Å; V805-V883 HydrophobicContact CG1-CG2 3.95Å; S806-V883 VanDerWaalsContact O-CB 3.24Å; S806-V883 WeakPolarHBondContact O-CB 3.32Å; S806-V883 WeakPolarHBondContact O-CG2 3.48Å; S806-V883 PolarHBondContact O-N 3.24Å; S806-V883 VanDerWaalsContact O-N 3.09Å; A807-V883 HydrophobicContact CB-CB 4.28Å; A807-V883 HydrophobicContact CB-CG2 4.42Å; V881-V883 HydrophobicContact CG1-CG2 4.3Å; V883-E920 WeakPolarHBondContact CG1-OE2 3.41Å
884	D	83.6	Confident	83.2	Confident	6 Å²	6	39.3 Å²	39.3	3%	0.032	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-78.2	153.4	174.4	-172.4	48.6	0	0	0	111.3	T888 M889 T901 E920 T922	D884-T888 PolarHBondContact OD1-OG1 3.31Å; D884-T888 PolarHBondContact OD2-OG1 3.34Å; D884-M889 HydrophobicContact CB-CE 3.73Å; D884-M889 WeakPolarHBondContact OD2-CE 3.34Å; D884-T901 HydrophobicContact CB-CG2 4.39Å; D884-T901 WeakPolarHBondContact OD1-CG2 3.43Å; D884-E920 HydrophobicContact CB-CB 4.44Å; D884-E920 HydrophobicContact CB-CG 4.16Å; D884-E920 PolarHBondContact N-OE2 3.34Å; D884-T922 WeakPolarHBondContact OD2-CG2 3.47Å
885	K	82.3	Confident	82.6	Confident	27 Å²	27	44.8 Å²	44.8	12%	0.117	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-83.3	138.4	-169.4	-54.2	-160.9	-179.5	-156	0	110.8	E808 D839 S887 T888 M889	E808-K885 HydrophobicContact CB-CB 4.07Å; E808-K885 HydrophobicContact CB-CD 4.28Å; E808-K885 HydrophobicContact CB-CG 4.16Å; E808-K885 HydrophobicContact CG-CB 4.48Å; E808-K885 HydrophobicContact CG-CD 4.48Å; E808-K885 WeakPolarHBondContact OE2-CB 3.37Å; D839-K885 IonicContact OD1-NZ 2.7Å; D839-K885 PolarHBondContact OD1-NZ 2.68Å; D839-K885 WeakPolarHBondContact OD2-CE 3.12Å; D839-K885 IonicContact OD2-NZ 3.21Å; D839-K885 PolarHBondContact OD2-NZ 2.85Å; K885-S887 PolarHBondContact O-N 3.36Å; K885-T888 WeakPolarHBondContact CB-OG1 3.36Å; K885-T888 PolarHBondContact O-N 3.31Å; K885-T888 VanDerWaalsContact O-N 3.08Å; K885-T888 PolarHBondContact O-OG1 3.03Å; K885-M889 WeakPolarHBondContact O-CG 3.43Å; K885-M889 PolarHBondContact O-N 2.85Å
886	E	78.6	Confident	82.5	Confident	61 Å²	61	49.2 Å²	49.2	29%	0.285	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-34	178.8	-68.9	-164.2	-146.4	0	0	110.7	K490 E808 T888	K490-E886 IonicContact NZ-OE1 3.09Å; K490-E886 PolarHBondContact NZ-OE1 3.29Å; K490-E886 IonicContact NZ-OE2 3.55Å; K490-E886 PolarHBondContact NZ-OE2 3.18Å; E808-E886 PolarHBondContact OE2-N 3.4Å; E886-T888 PolarHBondContact O-N 2.79Å
887	S	74.8	Confident	82.4	Confident	73 Å²	73	46.3 Å²	46.3	51%	0.51	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-19.7	176.9	67	0	0	0	0	115.8	E808 K885	E808-S887 VanDerWaalsContact CD-OG 3.31Å; E808-S887 VanDerWaalsContact OE1-CB 3.3Å; E808-S887 WeakPolarHBondContact OE1-CB 3.5Å; E808-S887 PolarHBondContact OE1-OG 3.43Å; E808-S887 PolarHBondContact OE2-N 2.8Å; E808-S887 PolarHBondContact OE2-OG 3.5Å; K885-S887 PolarHBondContact O-N 3.36Å
888	T	77.6	Confident	82.4	Confident	31 Å²	31	45.8 Å²	45.8	19%	0.19	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-19.8	178.1	43.5	0	0	0	0	113.6	D884 K885 E886 S890 A891 A897	D884-T888 PolarHBondContact OD1-OG1 3.31Å; D884-T888 PolarHBondContact OD2-OG1 3.34Å; K885-T888 WeakPolarHBondContact CB-OG1 3.36Å; K885-T888 PolarHBondContact O-N 3.31Å; K885-T888 VanDerWaalsContact O-N 3.08Å; K885-T888 PolarHBondContact O-OG1 3.03Å; E886-T888 PolarHBondContact O-N 2.79Å; T888-S890 VanDerWaalsContact C-N 3.28Å; T888-S890 PolarHBondContact O-N 2.98Å; T888-A891 PolarHBondContact O-N 3.23Å; T888-A897 WeakPolarHBondContact CB-O 3.47Å; T888-A897 WeakPolarHBondContact O-CA 3.48Å; T888-A897 WeakPolarHBondContact O-CB 3.38Å
889	M	72.9	Confident	82.5	Confident	9 Å²	9	45.4 Å²	45.4	4%	0.044	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-19.9	-177	-61.3	-152.3	170.5	0	0	114.9	N457 D884 K885 A891 T922 I972	N457-M889 PolarHBondContact ND2-O 3.18Å; D884-M889 HydrophobicContact CB-CE 3.73Å; D884-M889 WeakPolarHBondContact OD2-CE 3.34Å; K885-M889 WeakPolarHBondContact O-CG 3.43Å; K885-M889 PolarHBondContact O-N 2.85Å; M889-A891 VanDerWaalsContact C-N 3.29Å; M889-A891 PolarHBondContact O-N 2.6Å; M889-T922 HydrophobicContact CB-CG2 4.15Å; M889-T922 HydrophobicContact CE-CG2 3.9Å; M889-T922 HydrophobicContact CG-CG2 3.6Å; M889-T922 HydrophobicContact SD-CG2 3.94Å; M889-I972 HydrophobicContact CE-CD1 4.18Å; M889-I972 HydrophobicContact SD-CD1 4.35Å
890	S	74	Confident	82.3	Confident	42 Å²	42	49.1 Å²	49.1	29%	0.294	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	22.7	-179.3	76.9	0	0	0	0	114.1	T888	T888-S890 VanDerWaalsContact C-N 3.28Å; T888-S890 PolarHBondContact O-N 2.98Å
891	A	74.7	Confident	82.1	Confident	28 Å²	28	49.6 Å²	49.6	23%	0.231	26%	0.258	C	S	.	.			trans	-70.8	144.2	177.9	0	0	0	0	0	112.5	T888 M889 M896 A897	T888-A891 PolarHBondContact O-N 3.23Å; M889-A891 VanDerWaalsContact C-N 3.29Å; M889-A891 PolarHBondContact O-N 2.6Å; A891-M896 HydrophobicContact CB-CB 4.17Å; A891-A897 HydrophobicContact CB-CB 4.13Å
892	E	73.2	Confident	81.9	Confident	199 Å²	199	50.4 Å²	50.4	93%	0.93	26%	0.262	S	S	*	.	S	Bend	trans	-70.7	-36	177.4	-64.1	-177.2	173.4	0	0	112.8
893	E	78.8	Confident	81.8	Confident	114 Å²	114	54.7 Å²	54.7	53%	0.533	29%	0.289	S	S	.	.	S	Bend	trans	-100.3	128.1	174.8	-68.5	-165.6	175.6	0	0	111.3	Y895 M896	E893-Y895 PolarHBondContact O-N 3.28Å; E893-M896 HydrophobicContact CB-CB 4.4Å; E893-M896 HydrophobicContact CB-CG 4.11Å; E893-M896 HydrophobicContact CB-SD 4.46Å; E893-M896 PolarHBondContact O-N 3.19Å
894	D	76.4	Confident	81.7	Confident	58 Å²	58	55.3 Å²	55.3	31%	0.31	29%	0.292	S	S	.	.	H	α-helix	trans	-57.7	-24.5	179.7	-47.2	-55	0	0	0	112.7	K379 H923 N926	K379-D894 IonicContact NZ-OD1 2.76Å; K379-D894 PolarHBondContact NZ-OD1 2.82Å; D894-H923 IonicContact OD1-CD2 2.69Å; D894-H923 IonicContact OD1-CE1 3.47Å; D894-H923 IonicContact OD1-NE2 3.39Å; D894-H923 PolarHBondContact OD1-NE2 3.12Å; D894-N926 PolarHBondContact O-ND2 2.84Å
895	Y	76.8	Confident	82	Confident	118 Å²	118	55.1 Å²	55.1	46%	0.463	29%	0.291	S	S	.	.	H	α-helix	trans	-76.1	-23	175.9	-63.6	-51.7	0	0	0	114.3	E893 N926 R928 F929	E893-Y895 PolarHBondContact O-N 3.28Å; Y895-N926 WeakPolarHBondContact CD1-OD1 3.42Å; Y895-R928 PolarHBondContact OH-NH2 3.24Å; Y895-R928 VanDerWaalsContact OH-NH2 3.08Å; Y895-F929 HydrophobicContact CD1-CE2 4.12Å; Y895-F929 HydrophobicContact CE1-CE2 4.45Å
896	M	83.3	Confident	82.2	Confident	126 Å²	126	55.6 Å²	55.6	62%	0.621	29%	0.293	S	S	*	.	H	α-helix	trans	-86.4	-26.8	-175.4	-72.4	-170.5	65.3	0	0	112.8	A891 E893 A899	A891-M896 HydrophobicContact CB-CB 4.17Å; E893-M896 HydrophobicContact CB-CB 4.4Å; E893-M896 HydrophobicContact CB-CG 4.11Å; E893-M896 HydrophobicContact CB-SD 4.46Å; E893-M896 PolarHBondContact O-N 3.19Å; M896-A899 WeakPolarHBondContact O-CB 3.4Å; M896-A899 PolarHBondContact O-N 2.81Å
897	A	84	Confident	82.6	Confident	2 Å²	2	55.5 Å²	55.5	2%	0.017	30%	0.297	C	S	.	.	H	α-helix	trans	-56.9	-62.9	177.7	0	0	0	0	0	111.7	T888 A891 A899 T922	T888-A897 WeakPolarHBondContact CB-O 3.47Å; T888-A897 WeakPolarHBondContact O-CA 3.48Å; T888-A897 WeakPolarHBondContact O-CB 3.38Å; A891-A897 HydrophobicContact CB-CB 4.13Å; A897-A899 PolarHBondContact O-N 2.92Å; A897-T922 HydrophobicContact CB-CG2 4.13Å; A897-T922 WeakPolarHBondContact CB-OG1 3.42Å
898	D	88.2	Confident	83.2	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	1.2	-176.3	-56.1	-30.4	0	0	0	113.9	K900 T901 I902 L921 T922 H923 N926	D898-K900 VanDerWaalsContact C-N 3.29Å; D898-K900 PolarHBondContact O-N 2.93Å; D898-T901 PolarHBondContact O-N 3.39Å; D898-T901 PolarHBondContact O-OG1 3.18Å; D898-I902 HydrophobicContact CB-CD1 3.56Å; D898-I902 HydrophobicContact CB-CG1 4.11Å; D898-I902 WeakPolarHBondContact O-CB 3.33Å; D898-I902 WeakPolarHBondContact O-CD1 3.44Å; D898-I902 VanDerWaalsContact O-CG1 3.22Å; D898-I902 WeakPolarHBondContact O-CG1 3.5Å; D898-I902 PolarHBondContact O-N 2.73Å; D898-L921 HydrophobicContact CB-CD2 3.75Å; D898-L921 WeakPolarHBondContact OD2-CB 3.33Å; D898-T922 WeakPolarHBondContact OD1-CB 3.35Å; D898-T922 PolarHBondContact OD1-N 2.9Å; D898-T922 PolarHBondContact OD1-OG1 3.19Å; D898-T922 PolarHBondContact OD2-N 3.43Å; D898-T922 PolarHBondContact OD2-OG1 3.12Å; D898-H923 PolarHBondContact OD2-N 3.09Å; D898-N926 HydrophobicContact CB-CB 4.25Å; D898-N926 WeakPolarHBondContact OD2-CB 3.38Å; D898-N926 PolarHBondContact OD2-ND2 3.11Å
899	A	88.5	Confident	83.5	Confident	45 Å²	45	52.5 Å²	52.5	37%	0.372	27%	0.272	S	S	.	.	H	α-helix	trans	-59.3	-38.7	-168.6	0	0	0	0	0	112.8	M896 A897 V903	M896-A899 WeakPolarHBondContact O-CB 3.4Å; M896-A899 PolarHBondContact O-N 2.81Å; A897-A899 PolarHBondContact O-N 2.92Å; A899-V903 VanDerWaalsContact O-CG2 3.26Å; A899-V903 WeakPolarHBondContact O-CG2 3.19Å; A899-V903 PolarHBondContact O-N 3.48Å
900	K	88.8	Confident	84	Confident	85 Å²	85	58.3 Å²	58.3	37%	0.37	29%	0.294	S	S	.	.	H	α-helix	trans	-75.8	-46.2	-178.9	-176.9	167.8	-178.9	167.7	0	112.4	D864 D898 I902 V903 N904	D864-K900 VanDerWaalsContact CG-CE 3.5Å; D864-K900 WeakPolarHBondContact OD1-CE 3.19Å; D864-K900 IonicContact OD1-NZ 2.77Å; D864-K900 PolarHBondContact OD1-NZ 3.02Å; D864-K900 WeakPolarHBondContact OD2-CE 3.22Å; D864-K900 IonicContact OD2-NZ 3.78Å; D864-K900 PolarHBondContact OD2-NZ 3.35Å; D898-K900 VanDerWaalsContact C-N 3.29Å; D898-K900 PolarHBondContact O-N 2.93Å; K900-I902 PolarHBondContact O-N 3.2Å; K900-V903 PolarHBondContact O-N 3.32Å; K900-N904 WeakPolarHBondContact O-CB 3.28Å; K900-N904 VanDerWaalsContact O-CG 3.3Å; K900-N904 PolarHBondContact O-N 2.81Å
901	T	89.6	Confident	84.5	Confident	10 Å²	10	57 Å²	57	6%	0.061	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-43.5	-179.8	43.8	0	0	0	0	111.3	V882 D884 D898 N904 V905	V882-T901 HydrophobicContact CG1-CG2 4.09Å; D884-T901 HydrophobicContact CB-CG2 4.39Å; D884-T901 WeakPolarHBondContact OD1-CG2 3.43Å; D898-T901 PolarHBondContact O-N 3.39Å; D898-T901 PolarHBondContact O-OG1 3.18Å; T901-N904 PolarHBondContact O-N 3.41Å; T901-V905 WeakPolarHBondContact O-CB 3.25Å; T901-V905 VanDerWaalsContact O-CG2 3.29Å; T901-V905 WeakPolarHBondContact O-CG2 3.48Å; T901-V905 PolarHBondContact O-N 3.25Å
902	I	90.4	Very high	85	Confident	17 Å²	17	56 Å²	56	9%	0.087	27%	0.274	C	S	.	.	H	α-helix	trans	-62	-46.2	176.6	-66.7	168.9	0	0	0	111.9	D898 K900 V905 Q906 L921 N926 F929 M930	D898-I902 HydrophobicContact CB-CD1 3.56Å; D898-I902 HydrophobicContact CB-CG1 4.11Å; D898-I902 WeakPolarHBondContact O-CB 3.33Å; D898-I902 WeakPolarHBondContact O-CD1 3.44Å; D898-I902 VanDerWaalsContact O-CG1 3.22Å; D898-I902 WeakPolarHBondContact O-CG1 3.5Å; D898-I902 PolarHBondContact O-N 2.73Å; K900-I902 PolarHBondContact O-N 3.2Å; I902-V905 PolarHBondContact O-N 3.39Å; I902-Q906 VanDerWaalsContact O-CB 3.27Å; I902-Q906 WeakPolarHBondContact O-CB 3.36Å; I902-Q906 PolarHBondContact O-N 3.45Å; I902-L921 HydrophobicContact CD1-CD2 3.97Å; I902-L921 HydrophobicContact CG1-CD2 3.75Å; I902-N926 HydrophobicContact CD1-CB 3.85Å; I902-F929 HydrophobicContact CD1-CB 4.31Å; I902-F929 HydrophobicContact CD1-CD2 4.33Å; I902-F929 HydrophobicContact CG2-CB 3.68Å; I902-M930 HydrophobicContact CB-SD 4.47Å; I902-M930 HydrophobicContact CG1-SD 3.87Å; I902-M930 HydrophobicContact CG2-SD 4.44Å
903	V	89.7	Confident	85.2	Confident	92 Å²	92	48 Å²	48	56%	0.558	24%	0.239	S	C	*	.	H	α-helix	trans	-63.2	-44.1	178.8	167.2	0	0	0	0	111.1	A899 K900 Q906 T907	A899-V903 VanDerWaalsContact O-CG2 3.26Å; A899-V903 WeakPolarHBondContact O-CG2 3.19Å; A899-V903 PolarHBondContact O-N 3.48Å; K900-V903 PolarHBondContact O-N 3.32Å; V903-Q906 PolarHBondContact O-N 2.92Å; V903-T907 PolarHBondContact O-N 2.97Å; V903-T907 VanDerWaalsContact O-N 3.13Å
904	N	89.7	Confident	85.1	Confident	19 Å²	19	46.2 Å²	46.2	10%	0.102	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-47	177.2	-76	-1.7	0	0	0	111.9	I863 D864 K900 T901 Q906 T907 M908	I863-N904 HydrophobicContact CB-CB 4.41Å; I863-N904 HydrophobicContact CG2-CB 3.94Å; D864-N904 PolarHBondContact OD1-ND2 2.91Å; K900-N904 WeakPolarHBondContact O-CB 3.28Å; K900-N904 VanDerWaalsContact O-CG 3.3Å; K900-N904 PolarHBondContact O-N 2.81Å; T901-N904 PolarHBondContact O-N 3.41Å; N904-Q906 VanDerWaalsContact C-N 3.3Å; N904-Q906 PolarHBondContact O-N 2.74Å; N904-T907 PolarHBondContact O-N 3.16Å; N904-T907 VanDerWaalsContact O-N 3.16Å; N904-T907 PolarHBondContact O-OG1 2.95Å; N904-M908 WeakPolarHBondContact O-CG 3.49Å; N904-M908 PolarHBondContact O-N 3.48Å; N904-M908 VanDerWaalsContact O-N 3.09Å
905	V	89.9	Confident	85.5	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-67.1	-33.8	179.5	172.3	0	0	0	0	111.5	V882 T901 I902 T907 M908 F909 I917 T919 M930	V882-V905 HydrophobicContact CB-CG2 4.25Å; V882-V905 HydrophobicContact CG1-CG2 4.3Å; V882-V905 HydrophobicContact CG2-CG2 3.79Å; T901-V905 WeakPolarHBondContact O-CB 3.25Å; T901-V905 VanDerWaalsContact O-CG2 3.29Å; T901-V905 WeakPolarHBondContact O-CG2 3.48Å; T901-V905 PolarHBondContact O-N 3.25Å; I902-V905 PolarHBondContact O-N 3.39Å; V905-T907 VanDerWaalsContact C-N 3.31Å; V905-T907 PolarHBondContact O-N 3.26Å; V905-M908 PolarHBondContact O-N 2.91Å; V905-M908 VanDerWaalsContact O-N 3.17Å; V905-F909 HydrophobicContact CG1-CD2 3.69Å; V905-F909 HydrophobicContact CG1-CE2 3.44Å; V905-F909 VanDerWaalsContact CG1-CE2 3.44Å; V905-F909 HydrophobicContact CG1-CZ 4.2Å; V905-F909 WeakPolarHBondContact O-CD2 3.33Å; V905-F909 PolarHBondContact O-N 2.96Å; V905-I917 HydrophobicContact CG1-CB 4.5Å; V905-I917 HydrophobicContact CG1-CD1 4.17Å; V905-I917 HydrophobicContact CG1-CG2 3.88Å; V905-I917 HydrophobicContact CG2-CG2 4.27Å; V905-T919 HydrophobicContact CB-CG2 4.25Å; V905-T919 HydrophobicContact CG1-CG2 3.89Å; V905-T919 HydrophobicContact CG2-CG2 3.62Å; V905-M930 HydrophobicContact CB-CE 4.36Å; V905-M930 HydrophobicContact CG1-CE 3.71Å
906	Q	87	Confident	86	Confident	37 Å²	37	40.1 Å²	40.1	17%	0.173	22%	0.218	C	C	.	.	H	α-helix	trans	-70.2	-21.6	175	-175.8	64	-8.9	0	0	113.5	I902 V903 N904 R910 F932	I902-Q906 VanDerWaalsContact O-CB 3.27Å; I902-Q906 WeakPolarHBondContact O-CB 3.36Å; I902-Q906 PolarHBondContact O-N 3.45Å; V903-Q906 PolarHBondContact O-N 2.92Å; N904-Q906 VanDerWaalsContact C-N 3.3Å; N904-Q906 PolarHBondContact O-N 2.74Å; Q906-R910 WeakPolarHBondContact O-CD 3.45Å; Q906-R910 WeakPolarHBondContact O-CG 3.28Å; Q906-F932 PolarHBondContact NE2-O 3.49Å
907	T	87.3	Confident	86.4	Confident	59 Å²	59	34.1 Å²	34.1	36%	0.362	19%	0.188	S	C	.	.	H	α-helix	trans	-78.2	-39.8	165.7	68.4	0	0	0	0	111.3	V903 N904 V905 F909 R910 L911	V903-T907 PolarHBondContact O-N 2.97Å; V903-T907 VanDerWaalsContact O-N 3.13Å; N904-T907 PolarHBondContact O-N 3.16Å; N904-T907 VanDerWaalsContact O-N 3.16Å; N904-T907 PolarHBondContact O-OG1 2.95Å; V905-T907 VanDerWaalsContact C-N 3.31Å; V905-T907 PolarHBondContact O-N 3.26Å; T907-F909 PolarHBondContact O-N 3.33Å; T907-R910 WeakPolarHBondContact O-CB 3.27Å; T907-R910 PolarHBondContact O-N 2.65Å; T907-R910 VanDerWaalsContact O-N 3.1Å; T907-L911 WeakPolarHBondContact O-CG 3.44Å; T907-L911 PolarHBondContact O-N 2.92Å
908	M	87.3	Confident	86.8	Confident	5 Å²	5	34.2 Å²	34.2	3%	0.025	19%	0.188	C	C	.	.	H	α-helix	trans	-62.5	-42.1	177.1	-65.6	-56.1	134.9	0	0	113	I863 L869 I874 L880 N904 V905 R910 L911 F912 I917	I863-M908 HydrophobicContact CG2-CE 4.04Å; I863-M908 HydrophobicContact CG2-CG 3.97Å; L869-M908 HydrophobicContact CD1-CE 3.4Å; L869-M908 VanDerWaalsContact CD1-CE 3.4Å; L869-M908 HydrophobicContact CD1-SD 3.55Å; L869-M908 VanDerWaalsContact CD1-SD 3.55Å; I874-M908 HydrophobicContact CD1-SD 4.27Å; L880-M908 HydrophobicContact CD2-CG 4.48Å; N904-M908 WeakPolarHBondContact O-CG 3.49Å; N904-M908 PolarHBondContact O-N 3.48Å; N904-M908 VanDerWaalsContact O-N 3.09Å; V905-M908 PolarHBondContact O-N 2.91Å; V905-M908 VanDerWaalsContact O-N 3.17Å; M908-R910 PolarHBondContact O-N 3.34Å; M908-L911 HydrophobicContact CE-CD1 3.92Å; M908-L911 PolarHBondContact O-N 3.39Å; M908-L911 HydrophobicContact SD-CD1 4.13Å; M908-F912 PolarHBondContact O-N 3.36Å; M908-F912 HydrophobicContact SD-CD2 4.03Å; M908-F912 HydrophobicContact SD-CE2 4.09Å; M908-I917 HydrophobicContact CB-CD1 3.74Å
909	F	83.8	Confident	87.1	Confident	36 Å²	36	34.4 Å²	34.4	16%	0.158	19%	0.189	C	C	.	.	H	α-helix	trans	-60.4	-25.6	173.8	-81.9	-50	0	0	0	113.8	V905 T907 I917 M930	V905-F909 HydrophobicContact CG1-CD2 3.69Å; V905-F909 HydrophobicContact CG1-CE2 3.44Å; V905-F909 VanDerWaalsContact CG1-CE2 3.44Å; V905-F909 HydrophobicContact CG1-CZ 4.2Å; V905-F909 WeakPolarHBondContact O-CD2 3.33Å; V905-F909 PolarHBondContact O-N 2.96Å; T907-F909 PolarHBondContact O-N 3.33Å; F909-I917 HydrophobicContact CD1-CD1 3.75Å; F909-I917 HydrophobicContact CD1-CG1 4.32Å; F909-I917 HydrophobicContact CD2-CD1 4.47Å; F909-I917 HydrophobicContact CE1-CB 4.02Å; F909-I917 HydrophobicContact CE1-CD1 3.76Å; F909-I917 HydrophobicContact CE1-CG1 3.89Å; F909-I917 HydrophobicContact CE2-CD1 4.5Å; F909-I917 HydrophobicContact CG-CD1 4.1Å; F909-I917 HydrophobicContact CZ-CB 3.94Å; F909-I917 HydrophobicContact CZ-CD1 4.15Å; F909-I917 HydrophobicContact CZ-CG1 4.28Å; F909-M930 HydrophobicContact CE2-CE 4.2Å
910	R	83.3	Confident	87.2	Confident	132 Å²	132	32.2 Å²	32.2	50%	0.498	17%	0.172	S	C	.	.	H	α-helix	trans	-82.5	-40.4	176.2	-67.5	172.3	177.3	-176	-2.3	112.1	Q906 T907 M908 R1139 L1142	Q906-R910 WeakPolarHBondContact O-CD 3.45Å; Q906-R910 WeakPolarHBondContact O-CG 3.28Å; T907-R910 WeakPolarHBondContact O-CB 3.27Å; T907-R910 PolarHBondContact O-N 2.65Å; T907-R910 VanDerWaalsContact O-N 3.1Å; M908-R910 PolarHBondContact O-N 3.34Å; R910-R1139 PolarHBondContact O-NH1 3.1Å; R910-L1142 HydrophobicContact CB-CD1 3.97Å
911	L	84.3	Confident	87.3	Confident	14 Å²	14	28.2 Å²	28.2	7%	0.073	15%	0.154	C	C	.	.	H	α-helix	trans	-70.5	-49.4	178.7	-71.7	162.2	0	0	0	111.8	L866 T907 M908 L1142 V1146	L866-L911 HydrophobicContact CD1-CD1 4.26Å; T907-L911 WeakPolarHBondContact O-CG 3.44Å; T907-L911 PolarHBondContact O-N 2.92Å; M908-L911 HydrophobicContact CE-CD1 3.92Å; M908-L911 PolarHBondContact O-N 3.39Å; M908-L911 HydrophobicContact SD-CD1 4.13Å; L911-L1142 HydrophobicContact CD2-CB 4.35Å; L911-L1142 HydrophobicContact CD2-CD2 3.72Å; L911-L1142 HydrophobicContact CG-CD2 4.31Å; L911-V1146 HydrophobicContact CD2-CG2 3.85Å
912	F	84.8	Confident	87.2	Confident	8 Å²	8	28.4 Å²	28.4	4%	0.035	16%	0.155	C	C	.	.			trans	-129.2	67.1	-168.3	-53	-67.2	0	0	0	111.7	L866 L870 I874 I875 M908 S914 L915 V1146 Y1160	L866-F912 HydrophobicContact CD1-CE2 4.04Å; L866-F912 HydrophobicContact CD1-CZ 4.07Å; L870-F912 HydrophobicContact CD2-CZ 4.38Å; I874-F912 HydrophobicContact CD1-CD2 3.97Å; I874-F912 HydrophobicContact CD1-CE2 4.06Å; I874-F912 HydrophobicContact CG1-CD2 4.36Å; I874-F912 HydrophobicContact CG1-CE2 4.49Å; I874-F912 HydrophobicContact CG2-CD2 4.42Å; I874-F912 HydrophobicContact CG2-CE1 4.24Å; I874-F912 HydrophobicContact CG2-CE2 3.82Å; I874-F912 HydrophobicContact CG2-CZ 3.72Å; I875-F912 HydrophobicContact CG1-CE1 3.91Å; M908-F912 PolarHBondContact O-N 3.36Å; M908-F912 HydrophobicContact SD-CD2 4.03Å; M908-F912 HydrophobicContact SD-CE2 4.09Å; F912-S914 PolarHBondContact O-N 3.34Å; F912-S914 VanDerWaalsContact O-N 3.15Å; F912-L915 HydrophobicContact CB-CB 4.05Å; F912-L915 HydrophobicContact CB-CD2 4.32Å; F912-L915 VanDerWaalsContact O-CB 3.28Å; F912-L915 WeakPolarHBondContact O-CB 3.43Å; F912-L915 PolarHBondContact O-N 2.91Å; F912-L915 VanDerWaalsContact O-N 3.09Å; F912-V1146 HydrophobicContact CE1-CG1 4.21Å; F912-V1146 HydrophobicContact CE1-CG2 4.16Å; F912-V1146 HydrophobicContact CZ-CG1 4.49Å; F912-V1146 HydrophobicContact CZ-CG2 4.07Å; F912-Y1160 HydrophobicContact CE1-CE2 4.42Å
913	P	76.4	Confident	86.9	Confident	29 Å²	29	28.8 Å²	28.8	19%	0.188	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-17.2	-178.2	27.9	-36.1	0	0	0	114	L915 Q1188	P913-L915 VanDerWaalsContact C-N 3.29Å; P913-Q1188 PolarHBondContact O-NE2 2.9Å
914	S	77.3	Confident	86.7	Confident	78 Å²	78	25.7 Å²	25.7	55%	0.545	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-13.4	174.5	52.1	0	0	0	0	114	F912	F912-S914 PolarHBondContact O-N 3.34Å; F912-S914 VanDerWaalsContact O-N 3.15Å
915	L	84.9	Confident	86.4	Confident	5 Å²	5	27.5 Å²	27.5	3%	0.026	15%	0.153	C	C	.	.	S	Bend	trans	-81.7	132.9	-178.2	-177.6	64.2	0	0	0	110.5	I874 A877 L880 F912 P913 I917	I874-L915 HydrophobicContact CD1-CD2 3.74Å; I874-L915 HydrophobicContact CG1-CD2 3.68Å; A877-L915 HydrophobicContact CB-CD1 3.96Å; L880-L915 HydrophobicContact CB-CD1 4.31Å; L880-L915 HydrophobicContact CB-CD2 3.83Å; L880-L915 HydrophobicContact CB-CG 4.18Å; L880-L915 HydrophobicContact CD2-CD2 4.04Å; F912-L915 HydrophobicContact CB-CB 4.05Å; F912-L915 HydrophobicContact CB-CD2 4.32Å; F912-L915 VanDerWaalsContact O-CB 3.28Å; F912-L915 WeakPolarHBondContact O-CB 3.43Å; F912-L915 PolarHBondContact O-N 2.91Å; F912-L915 VanDerWaalsContact O-N 3.09Å; P913-L915 VanDerWaalsContact C-N 3.29Å; L915-I917 HydrophobicContact CD2-CD1 4.4Å; L915-I917 HydrophobicContact CD2-CG1 4.12Å; L915-I917 HydrophobicContact CG-CG1 4.09Å
916	S	87.3	Confident	86.3	Confident	42 Å²	42	27.5 Å²	27.5	29%	0.294	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	125.5	164.7	-177.8	0	0	0	0	108.4	D878 N879 L880	D878-S916 WeakPolarHBondContact O-CB 3.29Å; D878-S916 PolarHBondContact O-N 2.87Å; D878-S916 VanDerWaalsContact O-N 3.13Å; N879-S916 CarbonylContact C-O 3.57Å; N879-S916 WeakPolarHBondContact CA-O 3.36Å; N879-S916 WeakPolarHBondContact OD1-CB 3.35Å; N879-S916 PolarHBondContact OD1-OG 3.26Å; L880-S916 PolarHBondContact N-O 2.64Å
917	I	91.6	Very high	86.2	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.8	176.5	-46.8	-178.5	0	0	0	108.3	L880 V882 V905 M908 F909 L915 T919 R968	L880-I917 HydrophobicContact CB-CG2 4.49Å; L880-I917 HydrophobicContact CD2-CG2 4.3Å; L880-I917 HydrophobicContact CG-CG2 4.4Å; L880-I917 WeakPolarHBondContact O-CA 3.41Å; V882-I917 HydrophobicContact CG2-CG2 4.31Å; V905-I917 HydrophobicContact CG1-CB 4.5Å; V905-I917 HydrophobicContact CG1-CD1 4.17Å; V905-I917 HydrophobicContact CG1-CG2 3.88Å; V905-I917 HydrophobicContact CG2-CG2 4.27Å; M908-I917 HydrophobicContact CB-CD1 3.74Å; F909-I917 HydrophobicContact CD1-CD1 3.75Å; F909-I917 HydrophobicContact CD1-CG1 4.32Å; F909-I917 HydrophobicContact CD2-CD1 4.47Å; F909-I917 HydrophobicContact CE1-CB 4.02Å; F909-I917 HydrophobicContact CE1-CD1 3.76Å; F909-I917 HydrophobicContact CE1-CG1 3.89Å; F909-I917 HydrophobicContact CE2-CD1 4.5Å; F909-I917 HydrophobicContact CG-CD1 4.1Å; F909-I917 HydrophobicContact CZ-CB 3.94Å; F909-I917 HydrophobicContact CZ-CD1 4.15Å; F909-I917 HydrophobicContact CZ-CG1 4.28Å; L915-I917 HydrophobicContact CD2-CD1 4.4Å; L915-I917 HydrophobicContact CD2-CG1 4.12Å; L915-I917 HydrophobicContact CG-CG1 4.09Å; I917-T919 HydrophobicContact CG2-CG2 3.9Å; I917-R968 WeakPolarHBondContact O-CB 3.4Å
918	I	93.6	Very high	86	Confident	4 Å²	4	28.1 Å²	28.1	2%	0.021	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.4	174.8	-57	155.7	0	0	0	106.5	L514 N517 N879 L880 V881 V882 R968	L514-I918 HydrophobicContact CD2-CG2 3.62Å; N517-I918 HydrophobicContact CB-CD1 3.65Å; N517-I918 HydrophobicContact CB-CG1 4.3Å; N517-I918 HydrophobicContact CB-CG2 4.4Å; N879-I918 HydrophobicContact CB-CD1 4.24Å; L880-I918 PolarHBondContact O-N 3.31Å; V881-I918 WeakPolarHBondContact CA-O 3.4Å; V881-I918 HydrophobicContact CG2-CB 4.43Å; V881-I918 HydrophobicContact CG2-CD1 4.11Å; V882-I918 PolarHBondContact N-O 3.1Å; I918-R968 CarbonylContact C-O 3.58Å; I918-R968 WeakPolarHBondContact CA-O 3.22Å
919	T	92.8	Very high	85.9	Confident	4 Å²	4	31.8 Å²	31.8	3%	0.025	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	134.4	-173.7	54.4	0	0	0	0	111.7	V882 V905 I917 M930 R968 V969 F970	V882-T919 HydrophobicContact CB-CG2 4.26Å; V905-T919 HydrophobicContact CB-CG2 4.25Å; V905-T919 HydrophobicContact CG1-CG2 3.89Å; V905-T919 HydrophobicContact CG2-CG2 3.62Å; I917-T919 HydrophobicContact CG2-CG2 3.9Å; T919-M930 HydrophobicContact CG2-CE 3.71Å; T919-M930 WeakPolarHBondContact OG1-CE 3.38Å; T919-R968 PolarHBondContact N-O 3.42Å; T919-R968 PolarHBondContact OG1-O 3.41Å; T919-V969 CarbonylContact O-C 3.54Å; T919-V969 WeakPolarHBondContact O-CA 3.3Å; T919-V969 WeakPolarHBondContact OG1-CG2 3.43Å; T919-F970 PolarHBondContact O-N 3.09Å
920	E	92	Very high	85.8	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	144.3	161	-179.9	177.1	-160.2	0	0	110.4	K510 V882 V883 D884 F970 I972	K510-E920 VanDerWaalsContact CD-OE1 3.31Å; K510-E920 WeakPolarHBondContact CD-OE1 3.45Å; K510-E920 VanDerWaalsContact CE-CD 3.41Å; K510-E920 WeakPolarHBondContact CE-OE1 3.1Å; K510-E920 WeakPolarHBondContact CE-OE2 3.49Å; K510-E920 IonicContact NZ-OE1 2.74Å; K510-E920 PolarHBondContact NZ-OE1 3.47Å; K510-E920 IonicContact NZ-OE2 3.76Å; K510-E920 PolarHBondContact NZ-OE2 3.16Å; V882-E920 PolarHBondContact O-N 3.41Å; V883-E920 WeakPolarHBondContact CG1-OE2 3.41Å; D884-E920 HydrophobicContact CB-CB 4.44Å; D884-E920 HydrophobicContact CB-CG 4.16Å; D884-E920 PolarHBondContact N-OE2 3.34Å; E920-F970 CarbonylContact C-O 3.19Å; E920-F970 WeakPolarHBondContact CA-O 3.44Å; E920-I972 WeakPolarHBondContact OE1-CD1 3.28Å; E920-I972 WeakPolarHBondContact OE1-CG1 3.47Å
921	L	90.6	Very high	85.2	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	140.7	166.4	-63	-179.8	0	0	0	109.9	D898 I902 H923 N926 M927 M930 V969 F970 S971	D898-L921 HydrophobicContact CB-CD2 3.75Å; D898-L921 WeakPolarHBondContact OD2-CB 3.33Å; I902-L921 HydrophobicContact CD1-CD2 3.97Å; I902-L921 HydrophobicContact CG1-CD2 3.75Å; L921-H923 VanDerWaalsContact C-N 3.31Å; L921-H923 PolarHBondContact O-N 2.85Å; L921-N926 HydrophobicContact CD1-CB 4.31Å; L921-M927 HydrophobicContact CD1-CB 4.45Å; L921-M927 HydrophobicContact CD1-CG 3.7Å; L921-M930 HydrophobicContact CD1-CG 4.17Å; L921-M930 HydrophobicContact CD2-SD 4.45Å; L921-V969 HydrophobicContact CD1-CG1 3.48Å; L921-V969 VanDerWaalsContact CD1-CG1 3.48Å; L921-V969 HydrophobicContact CG-CG1 3.78Å; L921-F970 PolarHBondContact N-O 3.44Å; L921-S971 VanDerWaalsContact O-CA 3.25Å; L921-S971 WeakPolarHBondContact O-CA 3.43Å; L921-S971 WeakPolarHBondContact O-CB 3.42Å; L921-S971 PolarHBondContact O-OG 2.88Å
922	T	86.7	Confident	84.4	Confident	13 Å²	13	33.4 Å²	33.4	8%	0.08	18%	0.175	C	C	.	.	S	Bend	trans	-61.2	-39.4	171	53.1	0	0	0	0	112.4	D884 M889 A897 D898 S971	D884-T922 WeakPolarHBondContact OD2-CG2 3.47Å; M889-T922 HydrophobicContact CB-CG2 4.15Å; M889-T922 HydrophobicContact CE-CG2 3.9Å; M889-T922 HydrophobicContact CG-CG2 3.6Å; M889-T922 HydrophobicContact SD-CG2 3.94Å; A897-T922 HydrophobicContact CB-CG2 4.13Å; A897-T922 WeakPolarHBondContact CB-OG1 3.42Å; D898-T922 WeakPolarHBondContact OD1-CB 3.35Å; D898-T922 PolarHBondContact OD1-N 2.9Å; D898-T922 PolarHBondContact OD1-OG1 3.19Å; D898-T922 PolarHBondContact OD2-N 3.43Å; D898-T922 PolarHBondContact OD2-OG1 3.12Å; T922-S971 PolarHBondContact O-OG 2.96Å
923	H	85.2	Confident	83.5	Confident	25 Å²	25	37.8 Å²	37.8	12%	0.116	19%	0.191	C	C	.	.			trans	-130.9	127.9	-171.1	-70.6	-69.9	0	0	0	113.1	D894 D898 L921 S925 N926	D894-H923 IonicContact OD1-CD2 2.69Å; D894-H923 IonicContact OD1-CE1 3.47Å; D894-H923 IonicContact OD1-NE2 3.39Å; D894-H923 PolarHBondContact OD1-NE2 3.12Å; D898-H923 PolarHBondContact OD2-N 3.09Å; L921-H923 VanDerWaalsContact C-N 3.31Å; L921-H923 PolarHBondContact O-N 2.85Å; H923-S925 PolarHBondContact O-N 3.14Å; H923-S925 VanDerWaalsContact O-N 3.12Å; H923-N926 PolarHBondContact O-N 3.12Å
924	P	85.1	Confident	82.7	Confident	28 Å²	28	40.6 Å²	40.6	18%	0.182	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-65.2	-18.9	-179.1	25.8	-34.4	0	0	0	113.5	N926 M927 F958	P924-N926 PolarHBondContact O-N 3.33Å; P924-M927 HydrophobicContact CB-CE 4.04Å; P924-M927 HydrophobicContact CB-SD 4.21Å; P924-M927 WeakPolarHBondContact O-CB 3.36Å; P924-M927 VanDerWaalsContact O-CG 3.28Å; P924-M927 WeakPolarHBondContact O-CG 3.28Å; P924-M927 PolarHBondContact O-N 2.84Å; P924-F958 HydrophobicContact CB-CD1 4.08Å; P924-F958 HydrophobicContact CB-CE1 4.31Å; P924-F958 HydrophobicContact CB-CG 4.46Å
925	S	82.9	Confident	81.6	Confident	57 Å²	57	46.6 Å²	46.6	40%	0.399	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-58.6	-28.3	171.9	54.8	0	0	0	0	113.3	H923 R928	H923-S925 PolarHBondContact O-N 3.14Å; H923-S925 VanDerWaalsContact O-N 3.12Å; S925-R928 WeakPolarHBondContact O-CD 3.44Å; S925-R928 WeakPolarHBondContact O-CG 3.48Å
926	N	88.1	Confident	80.9	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-83.4	-12.4	-177	-68.4	-31.6	0	0	0	113.8	D894 Y895 D898 I902 L921 H923 P924 R928 F929	D894-N926 PolarHBondContact O-ND2 2.84Å; Y895-N926 WeakPolarHBondContact CD1-OD1 3.42Å; D898-N926 HydrophobicContact CB-CB 4.25Å; D898-N926 WeakPolarHBondContact OD2-CB 3.38Å; D898-N926 PolarHBondContact OD2-ND2 3.11Å; I902-N926 HydrophobicContact CD1-CB 3.85Å; L921-N926 HydrophobicContact CD1-CB 4.31Å; H923-N926 PolarHBondContact O-N 3.12Å; P924-N926 PolarHBondContact O-N 3.33Å; N926-R928 PolarHBondContact O-N 2.77Å; N926-F929 HydrophobicContact CB-CD2 4.34Å; N926-F929 WeakPolarHBondContact O-CD2 3.42Å; N926-F929 PolarHBondContact O-N 3.13Å
927	M	85.9	Confident	80.2	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.01	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-56	-18.4	176	-64.1	-175.5	177.9	0	0	113.7	L921 P924 F929 F964 V969 M974	L921-M927 HydrophobicContact CD1-CB 4.45Å; L921-M927 HydrophobicContact CD1-CG 3.7Å; P924-M927 HydrophobicContact CB-CE 4.04Å; P924-M927 HydrophobicContact CB-SD 4.21Å; P924-M927 WeakPolarHBondContact O-CB 3.36Å; P924-M927 VanDerWaalsContact O-CG 3.28Å; P924-M927 WeakPolarHBondContact O-CG 3.28Å; P924-M927 PolarHBondContact O-N 2.84Å; M927-F929 VanDerWaalsContact C-N 3.29Å; M927-F929 PolarHBondContact O-N 3.37Å; M927-F964 HydrophobicContact SD-CB 4.26Å; M927-V969 HydrophobicContact CE-CG1 3.78Å; M927-V969 HydrophobicContact CG-CG1 3.92Å; M927-V969 HydrophobicContact SD-CG1 4.27Å; M927-M974 HydrophobicContact CE-CE 3.33Å; M927-M974 HydrophobicContact SD-CE 4.09Å
928	R	83	Confident	79.5	Confident	107 Å²	107	53.1 Å²	53.1	40%	0.404	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-65.4	-23.4	173.2	71.8	-172.2	-173.8	-177.9	-2.6	115.2	Y895 S925 N926 R961	Y895-R928 PolarHBondContact OH-NH2 3.24Å; Y895-R928 VanDerWaalsContact OH-NH2 3.08Å; S925-R928 WeakPolarHBondContact O-CD 3.44Å; S925-R928 WeakPolarHBondContact O-CG 3.48Å; N926-R928 PolarHBondContact O-N 2.77Å; R928-R961 VanDerWaalsContact CA-NE 3.33Å; R928-R961 VanDerWaalsContact CB-NH2 3.34Å
929	F	84.9	Confident	78.8	Confident	81 Å²	81	54.8 Å²	54.8	36%	0.355	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-18.6	-176.3	-58.3	-62.6	0	0	0	113.3	Y895 I902 N926 M927 Q931	Y895-F929 HydrophobicContact CD1-CE2 4.12Å; Y895-F929 HydrophobicContact CE1-CE2 4.45Å; I902-F929 HydrophobicContact CD1-CB 4.31Å; I902-F929 HydrophobicContact CD1-CD2 4.33Å; I902-F929 HydrophobicContact CG2-CB 3.68Å; N926-F929 HydrophobicContact CB-CD2 4.34Å; N926-F929 WeakPolarHBondContact O-CD2 3.42Å; N926-F929 PolarHBondContact O-N 3.13Å; M927-F929 VanDerWaalsContact C-N 3.29Å; M927-F929 PolarHBondContact O-N 3.37Å; F929-Q931 PolarHBondContact O-N 3.04Å; F929-Q931 VanDerWaalsContact O-N 3.1Å
930	M	81	Confident	78.3	Confident	10 Å²	10	59.5 Å²	59.5	5%	0.049	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-14.9	-176.7	-71.8	-57.6	-55.9	0	0	115.7	I902 V905 F909 T919 L921 P963 V969	I902-M930 HydrophobicContact CB-SD 4.47Å; I902-M930 HydrophobicContact CG1-SD 3.87Å; I902-M930 HydrophobicContact CG2-SD 4.44Å; V905-M930 HydrophobicContact CB-CE 4.36Å; V905-M930 HydrophobicContact CG1-CE 3.71Å; F909-M930 HydrophobicContact CE2-CE 4.2Å; T919-M930 HydrophobicContact CG2-CE 3.71Å; T919-M930 WeakPolarHBondContact OG1-CE 3.38Å; L921-M930 HydrophobicContact CD1-CG 4.17Å; L921-M930 HydrophobicContact CD2-SD 4.45Å; M930-P963 HydrophobicContact CB-CB 4.09Å; M930-P963 HydrophobicContact CB-CG 4.01Å; M930-V969 HydrophobicContact CB-CG2 4.24Å; M930-V969 HydrophobicContact CE-CG2 4.23Å; M930-V969 HydrophobicContact CG-CG2 3.89Å
931	Q	70.4	Confident	77.9	Confident	65 Å²	65	61.6 Å²	61.6	30%	0.304	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.8	66.7	178.2	-169.1	174.5	-4.7	0	0	110.8	F929 R933 P963	F929-Q931 PolarHBondContact O-N 3.04Å; F929-Q931 VanDerWaalsContact O-N 3.1Å; Q931-R933 PolarHBondContact O-N 3.36Å; Q931-P963 HydrophobicContact CB-CG 4.16Å
932	F	67.5	Low	77.6	Confident	142 Å²	142	62 Å²	62	62%	0.623	33%	0.325	S	S	*	.			trans	-82.8	97.6	174.7	-168.1	-92.3	0	0	0	111.8	Q906	Q906-F932 PolarHBondContact NE2-O 3.49Å
933	R	66.3	Low	77.5	Confident	99 Å²	99	63.3 Å²	63.3	37%	0.374	34%	0.335	S	S	.	.			trans	-104.1	142	164.6	-68.3	-178.2	176.8	-175.3	-0.7	109.8	Q931 D936 Q1188 N1189	Q931-R933 PolarHBondContact O-N 3.36Å; R933-D936 HydrophobicContact CB-CB 4.33Å; R933-Q1188 PolarHBondContact NH2-O 2.94Å; R933-N1189 PolarHBondContact NH1-OD1 3.08Å
934	A	59	Low	77.5	Confident	88 Å²	88	68.9 Å²	68.9	73%	0.727	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	134.5	-180	0	0	0	0	0	111.1	D936	A934-D936 VanDerWaalsContact C-N 3.35Å; A934-D936 PolarHBondContact O-N 3.44Å
935	K	54.6	Low	77.4	Confident	205 Å²	205	68.5 Å²	68.5	89%	0.891	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	34.4	-177.5	-56	-178.8	177.6	178.7	0	115.2	C937	K935-C937 PolarHBondContact O-N 2.95Å
936	D	71.1	Confident	77.4	Confident	39 Å²	39	68 Å²	68	21%	0.209	35%	0.346	C	S	.	.			trans	-71.1	96.6	177.9	-167.6	-26.7	0	0	0	112.6	R933 A934 Y938 S939	R933-D936 HydrophobicContact CB-CB 4.33Å; A934-D936 VanDerWaalsContact C-N 3.35Å; A934-D936 PolarHBondContact O-N 3.44Å; D936-Y938 PolarHBondContact O-N 3.41Å; D936-Y938 WeakPolarHBondContact OD1-CA 3.48Å; D936-Y938 VanDerWaalsContact OD1-CB 3.25Å; D936-Y938 WeakPolarHBondContact OD1-CB 3.5Å; D936-Y938 PolarHBondContact OD1-N 2.91Å; D936-S939 PolarHBondContact OD1-N 3.44Å
937	C	71.3	Confident	77.2	Confident	107 Å²	107	74.4 Å²	74.4	72%	0.723	37%	0.374	S	S	*	.	H	α-helix	trans	-65.4	-24.7	174.4	-66.6	0	0	0	0	113.3	K935 A941	K935-C937 PolarHBondContact O-N 2.95Å; C937-A941 PolarHBondContact O-N 2.97Å; C937-A941 VanDerWaalsContact O-N 3.16Å
938	Y	77.1	Confident	77.1	Confident	38 Å²	38	79.2 Å²	79.2	15%	0.149	40%	0.395	C	S	.	.	H	α-helix	trans	-78.9	-42.3	-176.1	-168.7	-99.1	0	0	0	111.4	E556 W558 Q559 D936 L940 A941 L942 L962 F1048	E556-Y938 WeakPolarHBondContact OE1-CE2 3.31Å; E556-Y938 VanDerWaalsContact OE2-CE2 3.25Å; E556-Y938 WeakPolarHBondContact OE2-CE2 3.48Å; E556-Y938 PolarHBondContact OE2-OH 3.42Å; W558-Y938 VanDerWaalsContact CZ2-OH 3.25Å; W558-Y938 WeakPolarHBondContact CZ2-OH 3.35Å; W558-Y938 PolarHBondContact NE1-OH 3.07Å; Q559-Y938 PolarHBondContact NE2-OH 2.9Å; D936-Y938 PolarHBondContact O-N 3.41Å; D936-Y938 WeakPolarHBondContact OD1-CA 3.48Å; D936-Y938 VanDerWaalsContact OD1-CB 3.25Å; D936-Y938 WeakPolarHBondContact OD1-CB 3.5Å; D936-Y938 PolarHBondContact OD1-N 2.91Å; Y938-L940 PolarHBondContact O-N 3.48Å; Y938-A941 WeakPolarHBondContact O-CA 3.4Å; Y938-A941 WeakPolarHBondContact O-CB 3.47Å; Y938-A941 PolarHBondContact O-N 3.15Å; Y938-L942 HydrophobicContact CD1-CD1 3.91Å; Y938-L942 HydrophobicContact CD1-CG 4.16Å; Y938-L942 HydrophobicContact CE1-CD1 3.63Å; Y938-L942 HydrophobicContact CE1-CD2 4.18Å; Y938-L942 HydrophobicContact CE1-CG 3.88Å; Y938-L942 PolarHBondContact O-N 2.98Å; Y938-L962 HydrophobicContact CD1-CD1 4.11Å; Y938-L962 HydrophobicContact CE1-CD1 3.88Å; Y938-L962 HydrophobicContact CE1-CD2 4.1Å; Y938-L962 HydrophobicContact CE1-CG 4.25Å; Y938-F1048 HydrophobicContact CG-CE1 4.45Å
939	S	79.8	Confident	76.8	Confident	39 Å²	39	74.4 Å²	74.4	27%	0.273	38%	0.377	S	S	.	.	H	α-helix	trans	-56.5	-34.9	170.4	-174.4	0	0	0	0	112.3	D936 S943	D936-S939 PolarHBondContact OD1-N 3.44Å; S939-S943 VanDerWaalsContact O-CB 3.31Å; S939-S943 WeakPolarHBondContact O-CB 3.35Å; S939-S943 PolarHBondContact O-N 3.17Å; S939-S943 PolarHBondContact O-OG 3.28Å
940	L	82.4	Confident	76.5	Confident	102 Å²	102	77.5 Å²	77.5	53%	0.534	39%	0.386	S	S	.	.	H	α-helix	trans	-69.8	-39.7	171.8	179.1	61.7	0	0	0	112.7	Y938 S943 K944	Y938-L940 PolarHBondContact O-N 3.48Å; L940-S943 PolarHBondContact O-N 2.87Å; L940-K944 WeakPolarHBondContact O-CG 3.38Å; L940-K944 PolarHBondContact O-N 3.02Å; L940-K944 VanDerWaalsContact O-N 3.07Å
941	A	83.3	Confident	76.4	Confident	45 Å²	45	82.7 Å²	82.7	37%	0.372	42%	0.415	S	S	.	.	H	α-helix	trans	-64.1	-47.8	176.7	0	0	0	0	0	111.6	C937 Y938 S943 K944 L945	C937-A941 PolarHBondContact O-N 2.97Å; C937-A941 VanDerWaalsContact O-N 3.16Å; Y938-A941 WeakPolarHBondContact O-CA 3.4Å; Y938-A941 WeakPolarHBondContact O-CB 3.47Å; Y938-A941 PolarHBondContact O-N 3.15Å; A941-S943 PolarHBondContact O-N 3.4Å; A941-K944 WeakPolarHBondContact O-CB 3.4Å; A941-K944 PolarHBondContact O-N 3.39Å; A941-L945 PolarHBondContact O-N 2.85Å; A941-L945 VanDerWaalsContact O-N 3.11Å
942	L	83.9	Confident	76.6	Confident	9 Å²	9	83.6 Å²	83.6	5%	0.047	42%	0.417	C	S	.	.	H	α-helix	trans	-59.2	-45	174.3	-67.7	179.5	0	0	0	112	W558 Y938 K944 L945 E946 F960 L962	W558-L942 HydrophobicContact CZ2-CD2 4.47Å; Y938-L942 HydrophobicContact CD1-CD1 3.91Å; Y938-L942 HydrophobicContact CD1-CG 4.16Å; Y938-L942 HydrophobicContact CE1-CD1 3.63Å; Y938-L942 HydrophobicContact CE1-CD2 4.18Å; Y938-L942 HydrophobicContact CE1-CG 3.88Å; Y938-L942 PolarHBondContact O-N 2.98Å; L942-K944 VanDerWaalsContact C-N 3.26Å; L942-K944 PolarHBondContact O-N 2.77Å; L942-L945 WeakPolarHBondContact O-CB 3.32Å; L942-L945 PolarHBondContact O-N 3.45Å; L942-E946 PolarHBondContact O-N 2.84Å; L942-F960 WeakPolarHBondContact CD1-O 3.14Å; L942-F960 HydrophobicContact CD2-CB 4.4Å; L942-L962 HydrophobicContact CD1-CD2 3.92Å; L942-L962 HydrophobicContact CD1-CG 3.75Å
943	S	84.3	Confident	76.6	Confident	41 Å²	41	78.7 Å²	78.7	29%	0.287	41%	0.406	S	S	.	.	H	α-helix	trans	-67.8	-25	-179.4	-55.4	0	0	0	0	113	S939 L940 A941 K947 R961	S939-S943 VanDerWaalsContact O-CB 3.31Å; S939-S943 WeakPolarHBondContact O-CB 3.35Å; S939-S943 PolarHBondContact O-N 3.17Å; S939-S943 PolarHBondContact O-OG 3.28Å; L940-S943 PolarHBondContact O-N 2.87Å; A941-S943 PolarHBondContact O-N 3.4Å; S943-K947 PolarHBondContact O-N 3.49Å; S943-R961 PolarHBondContact OG-NH1 3.44Å; S943-R961 VanDerWaalsContact OG-NH1 3.07Å; S943-R961 PolarHBondContact OG-NH2 2.96Å
944	K	85.9	Confident	76.8	Confident	141 Å²	141	74.7 Å²	74.7	61%	0.613	39%	0.394	S	S	*	.	H	α-helix	trans	-71.5	-38.3	168.4	-73.5	171.9	-179.6	177.9	0	112	L940 A941 L942 K948	L940-K944 WeakPolarHBondContact O-CG 3.38Å; L940-K944 PolarHBondContact O-N 3.02Å; L940-K944 VanDerWaalsContact O-N 3.07Å; A941-K944 WeakPolarHBondContact O-CB 3.4Å; A941-K944 PolarHBondContact O-N 3.39Å; L942-K944 VanDerWaalsContact C-N 3.26Å; L942-K944 PolarHBondContact O-N 2.77Å; K944-K948 WeakPolarHBondContact O-CB 3.29Å; K944-K948 PolarHBondContact O-N 3.14Å; K944-K948 VanDerWaalsContact O-N 3.14Å
945	L	83.3	Confident	77.2	Confident	20 Å²	20	71.4 Å²	71.4	11%	0.105	36%	0.364	C	S	.	.	H	α-helix	trans	-69.1	-49.8	177.3	-173.3	151.2	0	0	0	111.1	A941 L942 K947 K948 E949 F960	A941-L945 PolarHBondContact O-N 2.85Å; A941-L945 VanDerWaalsContact O-N 3.11Å; L942-L945 WeakPolarHBondContact O-CB 3.32Å; L942-L945 PolarHBondContact O-N 3.45Å; L945-K947 VanDerWaalsContact C-N 3.3Å; L945-K947 PolarHBondContact O-N 3.22Å; L945-K948 CarbonylContact O-C 3.55Å; L945-K948 WeakPolarHBondContact O-CA 3.46Å; L945-K948 WeakPolarHBondContact O-CB 3.38Å; L945-K948 PolarHBondContact O-N 3.44Å; L945-E949 HydrophobicContact CD2-CG 3.9Å; L945-E949 PolarHBondContact O-N 3.01Å; L945-F960 HydrophobicContact CD2-CB 4.14Å; L945-F960 HydrophobicContact CD2-CD1 4.04Å; L945-F960 HydrophobicContact CD2-CD2 3.34Å; L945-F960 HydrophobicContact CD2-CE1 4.32Å; L945-F960 HydrophobicContact CD2-CE2 3.68Å; L945-F960 HydrophobicContact CD2-CG 3.55Å; L945-F960 HydrophobicContact CD2-CZ 4.16Å
946	E	82.6	Confident	78	Confident	47 Å²	47	61.7 Å²	61.7	22%	0.22	32%	0.322	C	S	.	.	H	α-helix	trans	-48.5	-50.4	173.5	167.7	177.2	161.9	0	0	111.5	L942 K948 E949 R950 A957 R961	L942-E946 PolarHBondContact O-N 2.84Å; E946-K948 VanDerWaalsContact C-N 3.35Å; E946-K948 PolarHBondContact O-N 3.26Å; E946-E949 PolarHBondContact O-N 3.42Å; E946-R950 WeakPolarHBondContact O-CB 3.42Å; E946-R950 PolarHBondContact O-N 3.3Å; E946-A957 HydrophobicContact CG-CB 4.18Å; E946-A957 WeakPolarHBondContact CG-O 3.47Å; E946-R961 IonicContact OE2-CZ 2.83Å; E946-R961 IonicContact OE2-NH1 2.82Å; E946-R961 PolarHBondContact OE2-NH1 3.05Å
947	K	84.2	Confident	78.1	Confident	136 Å²	136	60.3 Å²	60.3	59%	0.591	32%	0.316	S	S	*	.	H	α-helix	trans	-60.4	-44.6	177	-175.1	177.9	176.6	-177.4	0	111.6	S943 L945 E949 R950 D951	S943-K947 PolarHBondContact O-N 3.49Å; L945-K947 VanDerWaalsContact C-N 3.3Å; L945-K947 PolarHBondContact O-N 3.22Å; K947-E949 VanDerWaalsContact C-N 3.33Å; K947-E949 PolarHBondContact O-N 3.47Å; K947-R950 PolarHBondContact O-N 3.19Å; K947-D951 WeakPolarHBondContact O-CB 3.45Å; K947-D951 PolarHBondContact O-N 3.07Å
948	K	83.4	Confident	78.6	Confident	102 Å²	102	56.5 Å²	56.5	44%	0.443	29%	0.287	S	S	.	.	H	α-helix	trans	-64.8	-33.3	-179.1	-162.4	-171.8	-167.1	-169.9	0	113.1	Q553 K944 L945 E946 K952	Q553-K948 VanDerWaalsContact OE1-CE 3.27Å; K944-K948 WeakPolarHBondContact O-CB 3.29Å; K944-K948 PolarHBondContact O-N 3.14Å; K944-K948 VanDerWaalsContact O-N 3.14Å; L945-K948 CarbonylContact O-C 3.55Å; L945-K948 WeakPolarHBondContact O-CA 3.46Å; L945-K948 WeakPolarHBondContact O-CB 3.38Å; L945-K948 PolarHBondContact O-N 3.44Å; E946-K948 VanDerWaalsContact C-N 3.35Å; E946-K948 PolarHBondContact O-N 3.26Å; K948-K952 WeakPolarHBondContact O-CG 3.19Å; K948-K952 PolarHBondContact O-N 3.02Å
949	E	77.6	Confident	79	Confident	6 Å²	6	54.7 Å²	54.7	3%	0.028	28%	0.28	C	S	.	.	H	α-helix	trans	-76.7	-39.4	173.6	-54.8	-46.6	124.6	0	0	111.1	L945 E946 K947 D951 K952 G953 S954 F960	L945-E949 HydrophobicContact CD2-CG 3.9Å; L945-E949 PolarHBondContact O-N 3.01Å; E946-E949 PolarHBondContact O-N 3.42Å; K947-E949 VanDerWaalsContact C-N 3.33Å; K947-E949 PolarHBondContact O-N 3.47Å; E949-D951 VanDerWaalsContact C-N 3.31Å; E949-D951 PolarHBondContact O-N 2.99Å; E949-K952 WeakPolarHBondContact O-CA 3.07Å; E949-K952 WeakPolarHBondContact O-CB 3.39Å; E949-K952 PolarHBondContact O-N 2.94Å; E949-K952 IonicContact OE1-NZ 3.24Å; E949-K952 PolarHBondContact OE1-NZ 3.14Å; E949-K952 VanDerWaalsContact OE2-CD 3.32Å; E949-K952 WeakPolarHBondContact OE2-CD 3.17Å; E949-K952 IonicContact OE2-NZ 3.55Å; E949-K952 PolarHBondContact OE2-NZ 2.96Å; E949-G953 PolarHBondContact O-N 2.8Å; E949-G953 VanDerWaalsContact O-N 3.16Å; E949-S954 WeakPolarHBondContact CB-OG 3.42Å; E949-S954 WeakPolarHBondContact O-CB 3.33Å; E949-S954 PolarHBondContact O-N 3.08Å; E949-S954 PolarHBondContact O-OG 3.25Å; E949-S954 VanDerWaalsContact O-OG 3.05Å; E949-F960 HydrophobicContact CG-CE2 4.38Å
950	R	78.1	Confident	79.3	Confident	146 Å²	146	52.9 Å²	52.9	55%	0.551	27%	0.267	S	S	*	.	H	α-helix	trans	-59.6	-40.2	172.2	-163.7	170.5	-174.4	150.2	4.3	112	D381 E946 K947 K952 G953 S954 A957	D381-R950 IonicContact OD1-NH2 3.86Å; E946-R950 WeakPolarHBondContact O-CB 3.42Å; E946-R950 PolarHBondContact O-N 3.3Å; K947-R950 PolarHBondContact O-N 3.19Å; R950-K952 VanDerWaalsContact C-N 3.25Å; R950-K952 PolarHBondContact O-N 3.03Å; R950-G953 PolarHBondContact O-N 3.06Å; R950-S954 PolarHBondContact N-OG 3.3Å; R950-A957 HydrophobicContact CB-CB 3.91Å; R950-A957 HydrophobicContact CG-CB 4.36Å
951	D	78.8	Confident	79.5	Confident	120 Å²	120	49.3 Å²	49.3	64%	0.642	25%	0.247	S	C	*	.	H	α-helix	trans	-65.7	-23.4	175	-69.3	-22.2	0	0	0	112.7	K947 E949	K947-D951 WeakPolarHBondContact O-CB 3.45Å; K947-D951 PolarHBondContact O-N 3.07Å; E949-D951 VanDerWaalsContact C-N 3.31Å; E949-D951 PolarHBondContact O-N 2.99Å
952	K	73.9	Confident	79.7	Confident	84 Å²	84	48.4 Å²	48.4	37%	0.365	24%	0.235	S	C	.	.	H	α-helix	trans	-83.8	-12.3	170	-65.6	165.3	-170.2	170.2	0	113.2	R537 K948 E949 R950	R537-K952 PolarHBondContact NH1-O 2.92Å; K948-K952 WeakPolarHBondContact O-CG 3.19Å; K948-K952 PolarHBondContact O-N 3.02Å; E949-K952 WeakPolarHBondContact O-CA 3.07Å; E949-K952 WeakPolarHBondContact O-CB 3.39Å; E949-K952 PolarHBondContact O-N 2.94Å; E949-K952 IonicContact OE1-NZ 3.24Å; E949-K952 PolarHBondContact OE1-NZ 3.14Å; E949-K952 VanDerWaalsContact OE2-CD 3.32Å; E949-K952 WeakPolarHBondContact OE2-CD 3.17Å; E949-K952 IonicContact OE2-NZ 3.55Å; E949-K952 PolarHBondContact OE2-NZ 2.96Å; R950-K952 VanDerWaalsContact C-N 3.25Å; R950-K952 PolarHBondContact O-N 3.03Å
953	G	67.8	Low	79.9	Confident	38 Å²	38	48.6 Å²	48.6	39%	0.392	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	74	47.9	-169.7	0	0	0	0	0	113.4	E949 R950	E949-G953 PolarHBondContact O-N 2.8Å; E949-G953 VanDerWaalsContact O-N 3.16Å; R950-G953 PolarHBondContact O-N 3.06Å
954	S	71.1	Confident	80.3	Confident	16 Å²	16	46.7 Å²	46.7	11%	0.112	22%	0.224	C	C	.	.			trans	-68	143.7	163.3	59.6	0	0	0	0	111.3	E550 E949 R950 L956	E550-S954 VanDerWaalsContact OE1-CB 3.25Å; E550-S954 WeakPolarHBondContact OE1-CB 3.41Å; E949-S954 WeakPolarHBondContact CB-OG 3.42Å; E949-S954 WeakPolarHBondContact O-CB 3.33Å; E949-S954 PolarHBondContact O-N 3.08Å; E949-S954 PolarHBondContact O-OG 3.25Å; E949-S954 VanDerWaalsContact O-OG 3.05Å; R950-S954 PolarHBondContact N-OG 3.3Å; S954-L956 VanDerWaalsContact C-N 3.33Å
955	N	67.4	Low	80.4	Confident	19 Å²	19	40 Å²	40	10%	0.102	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-17.9	179.4	-70.5	9.5	0	0	0	112.9	N388 T533	N388-N955 WeakPolarHBondContact CB-OD1 3.46Å; N388-N955 PolarHBondContact O-ND2 3.06Å; T533-N955 PolarHBondContact O-ND2 3.31Å
956	L	70.4	Confident	80.7	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.8	52.7	-172.6	-81.9	177.2	0	0	0	112.9	L529 H532 S954 F958 M959	L529-L956 HydrophobicContact CD2-CD1 3.6Å; H532-L956 HydrophobicContact CB-CD1 3.64Å; H532-L956 HydrophobicContact CB-CD2 4.11Å; H532-L956 HydrophobicContact CB-CG 3.88Å; H532-L956 WeakPolarHBondContact ND1-CD2 3.49Å; S954-L956 VanDerWaalsContact C-N 3.33Å; L956-F958 HydrophobicContact CD2-CE1 4.21Å; L956-F958 HydrophobicContact CD2-CE2 3.76Å; L956-F958 HydrophobicContact CD2-CZ 3.46Å; L956-F958 VanDerWaalsContact CD2-CZ 3.46Å; L956-F958 PolarHBondContact O-N 2.74Å; L956-F958 VanDerWaalsContact O-N 3.09Å; L956-M959 HydrophobicContact CB-CB 4.06Å; L956-M959 HydrophobicContact CD1-SD 4.42Å; L956-M959 WeakPolarHBondContact O-CB 3.45Å; L956-M959 PolarHBondContact O-N 2.64Å
957	A	73.2	Confident	81.1	Confident	11 Å²	11	37.6 Å²	37.6	9%	0.091	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-54.3	-35.2	-176.2	0	0	0	0	0	114.1	E946 R950 M959	E946-A957 HydrophobicContact CG-CB 4.18Å; E946-A957 WeakPolarHBondContact CG-O 3.47Å; R950-A957 HydrophobicContact CB-CB 3.91Å; R950-A957 HydrophobicContact CG-CB 4.36Å; A957-M959 VanDerWaalsContact C-N 3.28Å; A957-M959 PolarHBondContact O-N 3.38Å
958	F	82	Confident	81.3	Confident	26 Å²	26	33.7 Å²	33.7	11%	0.114	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-75.4	-7.4	178.2	59.8	-104.9	0	0	0	114.5	P924 L956 F960 R961 F964 M974	P924-F958 HydrophobicContact CB-CD1 4.08Å; P924-F958 HydrophobicContact CB-CE1 4.31Å; P924-F958 HydrophobicContact CB-CG 4.46Å; L956-F958 HydrophobicContact CD2-CE1 4.21Å; L956-F958 HydrophobicContact CD2-CE2 3.76Å; L956-F958 HydrophobicContact CD2-CZ 3.46Å; L956-F958 VanDerWaalsContact CD2-CZ 3.46Å; L956-F958 PolarHBondContact O-N 2.74Å; L956-F958 VanDerWaalsContact O-N 3.09Å; F958-F960 VanDerWaalsContact C-N 3.26Å; F958-F960 PolarHBondContact O-N 2.95Å; F958-R961 WeakPolarHBondContact O-CB 3.34Å; F958-R961 PolarHBondContact O-N 2.87Å; F958-F964 HydrophobicContact CD2-CD1 4.25Å; F958-F964 HydrophobicContact CD2-CE1 4.36Å; F958-F964 HydrophobicContact CD2-CG 4.45Å; F958-F964 HydrophobicContact CE2-CD1 4.48Å; F958-F964 HydrophobicContact CE2-CE1 4.19Å; F958-F964 HydrophobicContact CE2-CE2 4.33Å; F958-F964 HydrophobicContact CE2-CZ 4.1Å; F958-M974 HydrophobicContact CD2-CE 4.18Å; F958-M974 HydrophobicContact CE2-CE 3.58Å; F958-M974 HydrophobicContact CZ-CE 4.05Å; F958-M974 HydrophobicContact CZ-CG 4.43Å
959	M	85.9	Confident	81.8	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-56	-38.1	-173.2	170.3	174.4	67.3	0	0	113.8	L529 E550 Y562 S566 L956 A957 R961 F964	L529-M959 HydrophobicContact CD2-CG 4.02Å; L529-M959 HydrophobicContact CD2-SD 3.61Å; E550-M959 HydrophobicContact CB-CE 4.17Å; E550-M959 WeakPolarHBondContact OE2-CE 3.47Å; Y562-M959 HydrophobicContact CD1-CG 4.39Å; Y562-M959 HydrophobicContact CE1-CG 3.54Å; Y562-M959 VanDerWaalsContact CE1-O 3.28Å; Y562-M959 WeakPolarHBondContact CE1-O 3.17Å; Y562-M959 HydrophobicContact CE1-SD 4.45Å; Y562-M959 WeakPolarHBondContact OH-CG 3.34Å; Y562-M959 PolarHBondContact OH-O 3.45Å; Y562-M959 VanDerWaalsContact OH-O 3.06Å; S566-M959 WeakPolarHBondContact CB-SD 3.46Å; S566-M959 WeakPolarHBondContact OG-CE 3.34Å; S566-M959 PolarHBondContact OG-SD 3.3Å; S566-M959 VanDerWaalsContact OG-SD 3.4Å; L956-M959 HydrophobicContact CB-CB 4.06Å; L956-M959 HydrophobicContact CD1-SD 4.42Å; L956-M959 WeakPolarHBondContact O-CB 3.45Å; L956-M959 PolarHBondContact O-N 2.64Å; A957-M959 VanDerWaalsContact C-N 3.28Å; A957-M959 PolarHBondContact O-N 3.38Å; M959-R961 PolarHBondContact O-N 3.3Å; M959-F964 HydrophobicContact CB-CE1 4.33Å; M959-F964 HydrophobicContact CG-CE1 4.38Å
960	F	85.8	Confident	82.4	Confident	2 Å²	2	28.6 Å²	28.6	1%	0.009	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-74	-0.5	-179	-62	-81.6	0	0	0	113.6	E550 Q559 Y562 L942 L945 E949 F958 L962	E550-F960 HydrophobicContact CB-CE2 4.37Å; E550-F960 HydrophobicContact CB-CZ 4.16Å; Q559-F960 HydrophobicContact CB-CD1 4.45Å; Q559-F960 HydrophobicContact CB-CE1 4.42Å; Y562-F960 HydrophobicContact CD1-CD1 4.23Å; Y562-F960 HydrophobicContact CD1-CE1 4.35Å; L942-F960 WeakPolarHBondContact CD1-O 3.14Å; L942-F960 HydrophobicContact CD2-CB 4.4Å; L945-F960 HydrophobicContact CD2-CB 4.14Å; L945-F960 HydrophobicContact CD2-CD1 4.04Å; L945-F960 HydrophobicContact CD2-CD2 3.34Å; L945-F960 HydrophobicContact CD2-CE1 4.32Å; L945-F960 HydrophobicContact CD2-CE2 3.68Å; L945-F960 HydrophobicContact CD2-CG 3.55Å; L945-F960 HydrophobicContact CD2-CZ 4.16Å; E949-F960 HydrophobicContact CG-CE2 4.38Å; F958-F960 VanDerWaalsContact C-N 3.26Å; F958-F960 PolarHBondContact O-N 2.95Å; F960-L962 PolarHBondContact O-N 3.22Å
961	R	87.3	Confident	83	Confident	27 Å²	27	21.6 Å²	21.6	10%	0.102	12%	0.119	C	C	.	.			trans	-81.3	115.5	-176.5	-151.9	147.7	-163	97.3	21.7	109.9	R928 S943 E946 F958 M959 P963 F964 A965	R928-R961 VanDerWaalsContact CA-NE 3.33Å; R928-R961 VanDerWaalsContact CB-NH2 3.34Å; S943-R961 PolarHBondContact OG-NH1 3.44Å; S943-R961 VanDerWaalsContact OG-NH1 3.07Å; S943-R961 PolarHBondContact OG-NH2 2.96Å; E946-R961 IonicContact OE2-CZ 2.83Å; E946-R961 IonicContact OE2-NH1 2.82Å; E946-R961 PolarHBondContact OE2-NH1 3.05Å; F958-R961 WeakPolarHBondContact O-CB 3.34Å; F958-R961 PolarHBondContact O-N 2.87Å; M959-R961 PolarHBondContact O-N 3.3Å; R961-P963 VanDerWaalsContact C-N 3.35Å; R961-P963 VanDerWaalsContact O-N 3.11Å; R961-F964 PolarHBondContact O-N 3.3Å; R961-A965 PolarHBondContact O-N 2.88Å; R961-A965 VanDerWaalsContact O-N 3.16Å
962	L	86.1	Confident	83.4	Confident	25 Å²	25	16.1 Å²	16.1	13%	0.131	9%	0.09	C	C	.	.	H	α-helix	trans	-48.5	-41.8	-169	-58	-170	0	0	0	115.9	W558 Y938 L942 F960 F964 A965 A966 L1191	W558-L962 HydrophobicContact CH2-CD2 3.9Å; W558-L962 HydrophobicContact CZ2-CD2 3.93Å; Y938-L962 HydrophobicContact CD1-CD1 4.11Å; Y938-L962 HydrophobicContact CE1-CD1 3.88Å; Y938-L962 HydrophobicContact CE1-CD2 4.1Å; Y938-L962 HydrophobicContact CE1-CG 4.25Å; L942-L962 HydrophobicContact CD1-CD2 3.92Å; L942-L962 HydrophobicContact CD1-CG 3.75Å; F960-L962 PolarHBondContact O-N 3.22Å; L962-F964 VanDerWaalsContact C-N 3.25Å; L962-F964 PolarHBondContact O-N 3.38Å; L962-A965 PolarHBondContact O-N 3.01Å; L962-A966 VanDerWaalsContact O-CB 3.26Å; L962-A966 WeakPolarHBondContact O-CB 3.21Å; L962-A966 PolarHBondContact O-N 3.05Å; L962-L1191 HydrophobicContact CD1-CD1 4.11Å; L962-L1191 HydrophobicContact CD2-CD1 3.38Å; L962-L1191 HydrophobicContact CG-CD1 4.35Å
963	P	89.1	Confident	84	Confident	13 Å²	13	12.9 Å²	12.9	8%	0.084	8%	0.078	C	C	.	.	H	α-helix	trans	-63.2	-29.8	-179.6	-24.1	36.7	0	0	0	113.7	M930 Q931 R961 R968 V969	M930-P963 HydrophobicContact CB-CB 4.09Å; M930-P963 HydrophobicContact CB-CG 4.01Å; Q931-P963 HydrophobicContact CB-CG 4.16Å; R961-P963 VanDerWaalsContact C-N 3.35Å; R961-P963 VanDerWaalsContact O-N 3.11Å; P963-R968 PolarHBondContact O-N 3.5Å; P963-V969 HydrophobicContact CB-CB 4.33Å; P963-V969 HydrophobicContact CB-CG2 3.31Å; P963-V969 PolarHBondContact O-N 2.95Å; P963-V969 VanDerWaalsContact O-N 3.11Å
964	F	91.5	Very high	84.9	Confident	1 Å²	1	11.1 Å²	11.1	0%	0.004	6%	0.059	C	C	.	.	H	α-helix	trans	-80.4	-45	173.9	169.3	-104.2	0	0	0	111.7	T525 T528 L529 M927 F958 M959 R961 L962 A966 G967 M974	T525-F964 HydrophobicContact CG2-CD1 4.25Å; T525-F964 HydrophobicContact CG2-CD2 4.48Å; T525-F964 HydrophobicContact CG2-CE1 3.85Å; T525-F964 HydrophobicContact CG2-CE2 4.1Å; T525-F964 HydrophobicContact CG2-CZ 3.77Å; T525-F964 WeakPolarHBondContact CG2-O 3.49Å; T525-F964 PolarHBondContact OG1-O 3.27Å; T528-F964 HydrophobicContact CG2-CE2 3.95Å; T528-F964 HydrophobicContact CG2-CZ 3.73Å; L529-F964 HydrophobicContact CD2-CE1 4.26Å; L529-F964 HydrophobicContact CD2-CZ 4.36Å; M927-F964 HydrophobicContact SD-CB 4.26Å; F958-F964 HydrophobicContact CD2-CD1 4.25Å; F958-F964 HydrophobicContact CD2-CE1 4.36Å; F958-F964 HydrophobicContact CD2-CG 4.45Å; F958-F964 HydrophobicContact CE2-CD1 4.48Å; F958-F964 HydrophobicContact CE2-CE1 4.19Å; F958-F964 HydrophobicContact CE2-CE2 4.33Å; F958-F964 HydrophobicContact CE2-CZ 4.1Å; M959-F964 HydrophobicContact CB-CE1 4.33Å; M959-F964 HydrophobicContact CG-CE1 4.38Å; R961-F964 PolarHBondContact O-N 3.3Å; L962-F964 VanDerWaalsContact C-N 3.25Å; L962-F964 PolarHBondContact O-N 3.38Å; F964-A966 PolarHBondContact O-N 3Å; F964-G967 PolarHBondContact O-N 3.36Å; F964-M974 HydrophobicContact CD2-CE 3.4Å; F964-M974 VanDerWaalsContact CD2-CE 3.4Å; F964-M974 HydrophobicContact CD2-SD 4.13Å; F964-M974 HydrophobicContact CE2-CE 3.4Å; F964-M974 VanDerWaalsContact CE2-CE 3.4Å; F964-M974 HydrophobicContact CE2-SD 3.73Å; F964-M974 HydrophobicContact CG-CE 4.33Å; F964-M974 HydrophobicContact CZ-CE 4.34Å
965	A	89.8	Confident	85.6	Confident	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-58.7	-37.8	177.2	0	0	0	0	0	112.2	Y562 R961 L962 G967 S1192 Y1193	Y562-A965 HydrophobicContact CE1-CB 4.09Å; R961-A965 PolarHBondContact O-N 2.88Å; R961-A965 VanDerWaalsContact O-N 3.16Å; L962-A965 PolarHBondContact O-N 3.01Å; A965-G967 VanDerWaalsContact C-N 3.29Å; A965-G967 PolarHBondContact O-N 3.28Å; A965-S1192 CarbonylContact C-O 3.56Å; A965-Y1193 WeakPolarHBondContact O-CA 3.48Å
966	A	89.1	Confident	86.7	Confident	13 Å²	13	9.7 Å²	9.7	11%	0.107	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	1.5	175.9	0	0	0	0	0	114.7	L962 F964 R968 Y1041 S1192	L962-A966 VanDerWaalsContact O-CB 3.26Å; L962-A966 WeakPolarHBondContact O-CB 3.21Å; L962-A966 PolarHBondContact O-N 3.05Å; F964-A966 PolarHBondContact O-N 3Å; A966-R968 HydrophobicContact CB-CG 4.31Å; A966-R968 PolarHBondContact O-N 3.01Å; A966-Y1041 PolarHBondContact O-OH 2.93Å; A966-S1192 PolarHBondContact N-O 3.29Å
967	G	90.1	Very high	87.6	Confident	4 Å²	4	9.8 Å²	9.8	4%	0.041	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.5	10.7	179.6	0	0	0	0	0	116.1	N517 T525 F964 A965 V969	N517-G967 PolarHBondContact ND2-O 3.48Å; T525-G967 WeakPolarHBondContact OG1-CA 3.23Å; F964-G967 PolarHBondContact O-N 3.36Å; A965-G967 VanDerWaalsContact C-N 3.29Å; A965-G967 PolarHBondContact O-N 3.28Å; G967-V969 VanDerWaalsContact C-N 3.27Å
968	R	89.8	Confident	88.5	Confident	55 Å²	55	9.3 Å²	9.3	21%	0.208	5%	0.047	C	C	.	.	S	Bend	trans	-78.1	-13.8	178.3	-64.7	-173.3	-178.2	-162.4	-2.1	112.8	I917 I918 T919 P963 A966	I917-R968 WeakPolarHBondContact O-CB 3.4Å; I918-R968 CarbonylContact C-O 3.58Å; I918-R968 WeakPolarHBondContact CA-O 3.22Å; T919-R968 PolarHBondContact N-O 3.42Å; T919-R968 PolarHBondContact OG1-O 3.41Å; P963-R968 PolarHBondContact O-N 3.5Å; A966-R968 HydrophobicContact CB-CG 4.31Å; A966-R968 PolarHBondContact O-N 3.01Å
969	V	92.1	Very high	89	Confident	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.042	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	135.2	-178.4	-166.2	0	0	0	0	110.8	T919 L921 M927 M930 P963 G967	T919-V969 CarbonylContact O-C 3.54Å; T919-V969 WeakPolarHBondContact O-CA 3.3Å; T919-V969 WeakPolarHBondContact OG1-CG2 3.43Å; L921-V969 HydrophobicContact CD1-CG1 3.48Å; L921-V969 VanDerWaalsContact CD1-CG1 3.48Å; L921-V969 HydrophobicContact CG-CG1 3.78Å; M927-V969 HydrophobicContact CE-CG1 3.78Å; M927-V969 HydrophobicContact CG-CG1 3.92Å; M927-V969 HydrophobicContact SD-CG1 4.27Å; M930-V969 HydrophobicContact CB-CG2 4.24Å; M930-V969 HydrophobicContact CE-CG2 4.23Å; M930-V969 HydrophobicContact CG-CG2 3.89Å; P963-V969 HydrophobicContact CB-CB 4.33Å; P963-V969 HydrophobicContact CB-CG2 3.31Å; P963-V969 PolarHBondContact O-N 2.95Å; P963-V969 VanDerWaalsContact O-N 3.11Å; G967-V969 VanDerWaalsContact C-N 3.27Å
970	F	91.7	Very high	89.3	Confident	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.042	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	152.4	174.5	175.1	-111.4	0	0	0	109.4	K510 M513 T919 E920 L921 M974 L975	K510-F970 HydrophobicContact CB-CE1 4.26Å; K510-F970 HydrophobicContact CG-CE1 4.44Å; M513-F970 HydrophobicContact SD-CD2 4.32Å; M513-F970 HydrophobicContact SD-CE2 3.55Å; M513-F970 VanDerWaalsContact SD-CE2 3.55Å; M513-F970 HydrophobicContact SD-CZ 3.8Å; T919-F970 PolarHBondContact O-N 3.09Å; E920-F970 CarbonylContact C-O 3.19Å; E920-F970 WeakPolarHBondContact CA-O 3.44Å; L921-F970 PolarHBondContact N-O 3.44Å; F970-M974 HydrophobicContact CD2-SD 3.87Å; F970-M974 HydrophobicContact CE2-CB 4.19Å; F970-M974 HydrophobicContact CE2-SD 4.23Å; F970-L975 HydrophobicContact CE2-CD2 4.39Å; F970-L975 HydrophobicContact CZ-CD1 3.97Å; F970-L975 HydrophobicContact CZ-CD2 4.01Å; F970-L975 HydrophobicContact CZ-CG 3.87Å
971	S	90.4	Very high	89.5	Confident	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.042	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	140.1	177	-174.4	0	0	0	0	110.6	L921 T922 S973 M974	L921-S971 VanDerWaalsContact O-CA 3.25Å; L921-S971 WeakPolarHBondContact O-CA 3.43Å; L921-S971 WeakPolarHBondContact O-CB 3.42Å; L921-S971 PolarHBondContact O-OG 2.88Å; T922-S971 PolarHBondContact O-OG 2.96Å; S971-S973 PolarHBondContact O-N 3.26Å; S971-S973 VanDerWaalsContact O-N 3.17Å; S971-M974 PolarHBondContact N-SD 3Å; S971-M974 VanDerWaalsContact O-CB 3.24Å; S971-M974 WeakPolarHBondContact O-CB 3.47Å; S971-M974 WeakPolarHBondContact O-CG 3.23Å; S971-M974 PolarHBondContact O-N 3.31Å
972	I	87.1	Confident	89.8	Confident	5 Å²	5	6.9 Å²	6.9	3%	0.026	4%	0.037	C	C	.	.	G	3₁₀ helix	trans	-61.4	-30.9	-170.9	-46.4	175.7	0	0	0	111.8	R456 E506 M889 E920 M974 L975	R456-I972 PolarHBondContact NH2-O 3.37Å; E506-I972 HydrophobicContact CB-CG2 3.98Å; E506-I972 VanDerWaalsContact CD-CG2 3.45Å; E506-I972 HydrophobicContact CG-CG2 4.14Å; E506-I972 WeakPolarHBondContact OE2-CG2 3.34Å; M889-I972 HydrophobicContact CE-CD1 4.18Å; M889-I972 HydrophobicContact SD-CD1 4.35Å; E920-I972 WeakPolarHBondContact OE1-CD1 3.28Å; E920-I972 WeakPolarHBondContact OE1-CG1 3.47Å; I972-M974 PolarHBondContact O-N 2.95Å; I972-M974 VanDerWaalsContact O-N 3.09Å; I972-L975 HydrophobicContact CG2-CD1 4.38Å; I972-L975 WeakPolarHBondContact O-CB 3.46Å; I972-L975 PolarHBondContact O-N 3.37Å
973	S	85.4	Confident	90.1	Very high	16 Å²	16	7.2 Å²	7.2	11%	0.112	4%	0.038	C	C	.	.	G	3₁₀ helix	trans	-63.6	-16.7	179.1	73.5	0	0	0	0	114.3	S971 L975 D976	S971-S973 PolarHBondContact O-N 3.26Å; S971-S973 VanDerWaalsContact O-N 3.17Å; S973-L975 PolarHBondContact O-N 3.03Å; S973-D976 WeakPolarHBondContact CA-OD2 3.33Å; S973-D976 WeakPolarHBondContact O-CB 3.42Å; S973-D976 PolarHBondContact O-N 3.49Å
974	M	87.3	Confident	90.2	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.047	C	C	.	.	G	3₁₀ helix	trans	-66	-15.5	171.5	-64	166.7	171.4	0	0	113	T528 M927 F958 F964 F970 S971 I972 T977	T528-M974 HydrophobicContact CG2-CB 3.77Å; T528-M974 HydrophobicContact CG2-CG 3.84Å; T528-M974 HydrophobicContact CG2-SD 4.16Å; M927-M974 HydrophobicContact CE-CE 3.33Å; M927-M974 HydrophobicContact SD-CE 4.09Å; F958-M974 HydrophobicContact CD2-CE 4.18Å; F958-M974 HydrophobicContact CE2-CE 3.58Å; F958-M974 HydrophobicContact CZ-CE 4.05Å; F958-M974 HydrophobicContact CZ-CG 4.43Å; F964-M974 HydrophobicContact CD2-CE 3.4Å; F964-M974 VanDerWaalsContact CD2-CE 3.4Å; F964-M974 HydrophobicContact CD2-SD 4.13Å; F964-M974 HydrophobicContact CE2-CE 3.4Å; F964-M974 VanDerWaalsContact CE2-CE 3.4Å; F964-M974 HydrophobicContact CE2-SD 3.73Å; F964-M974 HydrophobicContact CG-CE 4.33Å; F964-M974 HydrophobicContact CZ-CE 4.34Å; F970-M974 HydrophobicContact CD2-SD 3.87Å; F970-M974 HydrophobicContact CE2-CB 4.19Å; F970-M974 HydrophobicContact CE2-SD 4.23Å; S971-M974 PolarHBondContact N-SD 3Å; S971-M974 VanDerWaalsContact O-CB 3.24Å; S971-M974 WeakPolarHBondContact O-CB 3.47Å; S971-M974 WeakPolarHBondContact O-CG 3.23Å; S971-M974 PolarHBondContact O-N 3.31Å; I972-M974 PolarHBondContact O-N 2.95Å; I972-M974 VanDerWaalsContact O-N 3.09Å; M974-T977 PolarHBondContact O-OG1 2.94Å
975	L	86.7	Confident	90.2	Very high	3 Å²	3	8.9 Å²	8.9	2%	0.016	5%	0.047	C	C	.	.	G	3₁₀ helix	trans	-91.8	-13.6	177.9	-56.8	177.1	0	0	0	113.3	F509 M513 F970 I972 S973 T977 L978	F509-L975 HydrophobicContact CB-CD1 3.68Å; F509-L975 HydrophobicContact CB-CD2 4.09Å; M513-L975 HydrophobicContact CE-CD2 3.47Å; M513-L975 VanDerWaalsContact CE-CD2 3.47Å; M513-L975 HydrophobicContact SD-CD2 4Å; F970-L975 HydrophobicContact CE2-CD2 4.39Å; F970-L975 HydrophobicContact CZ-CD1 3.97Å; F970-L975 HydrophobicContact CZ-CD2 4.01Å; F970-L975 HydrophobicContact CZ-CG 3.87Å; I972-L975 HydrophobicContact CG2-CD1 4.38Å; I972-L975 WeakPolarHBondContact O-CB 3.46Å; I972-L975 PolarHBondContact O-N 3.37Å; S973-L975 PolarHBondContact O-N 3.03Å; L975-T977 VanDerWaalsContact C-N 3.29Å; L975-T977 PolarHBondContact O-N 3.28Å; L975-L978 WeakPolarHBondContact O-CB 3.23Å; L975-L978 PolarHBondContact O-N 3.31Å
976	D	89.1	Confident	90.2	Very high	2 Å²	2	13.3 Å²	13.3	1%	0.011	7%	0.071	C	C	.	.	H	α-helix	trans	-59.2	-42.9	-179.2	-75.3	-37.5	0	0	0	111.5	R456 Q487 S973 L978 L979 Y980	R456-D976 IonicContact CZ-OD1 2.7Å; R456-D976 IonicContact CZ-OD2 3.65Å; R456-D976 IonicContact NH1-OD1 3.86Å; R456-D976 PolarHBondContact NH1-OD1 3.1Å; R456-D976 IonicContact NH1-OD2 3.73Å; R456-D976 PolarHBondContact NH1-OD2 2.87Å; R456-D976 IonicContact NH2-OD1 2.88Å; R456-D976 PolarHBondContact NH2-OD1 2.86Å; R456-D976 IonicContact NH2-OD2 2.67Å; R456-D976 PolarHBondContact NH2-OD2 3.23Å; R456-D976 VanDerWaalsContact NH2-OD2 3.15Å; Q487-D976 PolarHBondContact NE2-OD1 3.1Å; S973-D976 WeakPolarHBondContact CA-OD2 3.33Å; S973-D976 WeakPolarHBondContact O-CB 3.42Å; S973-D976 PolarHBondContact O-N 3.49Å; D976-L978 PolarHBondContact O-N 2.89Å; D976-L979 PolarHBondContact O-N 3.4Å; D976-L979 VanDerWaalsContact O-N 3.1Å; D976-Y980 HydrophobicContact CB-CE2 3.73Å; D976-Y980 WeakPolarHBondContact O-CD1 3.11Å; D976-Y980 WeakPolarHBondContact O-CD2 3.44Å; D976-Y980 VanDerWaalsContact O-CG 3.31Å; D976-Y980 PolarHBondContact O-N 2.95Å
977	T	89.8	Confident	90.3	Very high	2 Å²	2	13.5 Å²	13.5	1%	0.012	7%	0.069	C	C	.	.	H	α-helix	trans	-63.7	-26.8	-180	51.5	0	0	0	0	113.3	E389 H532 M974 L975 L979 Y980 Q981	E389-T977 HydrophobicContact CB-CG2 4.13Å; E389-T977 HydrophobicContact CG-CG2 4.12Å; H532-T977 PolarHBondContact CD2-OG1 3.37Å; H532-T977 VanDerWaalsContact CE1-CG2 3.4Å; H532-T977 WeakPolarHBondContact CE1-CG2 3.28Å; H532-T977 PolarHBondContact NE2-OG1 2.94Å; H532-T977 VanDerWaalsContact NE2-OG1 3.16Å; M974-T977 PolarHBondContact O-OG1 2.94Å; L975-T977 VanDerWaalsContact C-N 3.29Å; L975-T977 PolarHBondContact O-N 3.28Å; T977-L979 VanDerWaalsContact C-N 3.32Å; T977-L979 PolarHBondContact O-N 3.43Å; T977-Y980 HydrophobicContact CG2-CD2 4.37Å; T977-Y980 PolarHBondContact O-N 3.48Å; T977-Q981 WeakPolarHBondContact O-CB 3.34Å; T977-Q981 PolarHBondContact O-N 2.86Å
978	L	92.4	Very high	90.4	Very high	1 Å²	1	13.6 Å²	13.6	1%	0.005	7%	0.068	C	C	.	.	H	α-helix	trans	-62.8	-38.2	174.2	-176.7	157.8	0	0	0	111.4	V504 F509 V531 L975 D976 S982 I989 A992	V504-L978 HydrophobicContact CG1-CD2 4.45Å; V504-L978 HydrophobicContact CG2-CD2 3.49Å; V504-L978 VanDerWaalsContact CG2-CD2 3.49Å; F509-L978 HydrophobicContact CD1-CD1 4.16Å; F509-L978 HydrophobicContact CE1-CD1 3.77Å; F509-L978 HydrophobicContact CE2-CD2 4.48Å; F509-L978 HydrophobicContact CZ-CD1 4.09Å; F509-L978 HydrophobicContact CZ-CD2 4.21Å; V531-L978 HydrophobicContact CB-CB 4.38Å; V531-L978 HydrophobicContact CG1-CB 4.25Å; V531-L978 HydrophobicContact CG1-CD1 4.21Å; V531-L978 HydrophobicContact CG1-CG 4.36Å; L975-L978 WeakPolarHBondContact O-CB 3.23Å; L975-L978 PolarHBondContact O-N 3.31Å; D976-L978 PolarHBondContact O-N 2.89Å; L978-S982 PolarHBondContact O-N 3.02Å; L978-I989 HydrophobicContact CD2-CB 4.25Å; L978-I989 HydrophobicContact CD2-CD1 4.14Å; L978-I989 HydrophobicContact CD2-CG1 3.76Å; L978-I989 HydrophobicContact CD2-CG2 4.15Å; L978-A992 HydrophobicContact CD1-CB 3.76Å
979	L	93.6	Very high	90.5	Very high	2 Å²	2	11 Å²	11	1%	0.01	6%	0.059	C	C	.	.	H	α-helix	trans	-70.3	-45.4	173.3	-174.6	67.9	0	0	0	110.8	F451 L453 Q487 V504 D976 T977 Q981 S982	F451-L979 HydrophobicContact CD1-CD2 4.4Å; F451-L979 HydrophobicContact CD1-CG 4.27Å; F451-L979 HydrophobicContact CE1-CG 4.42Å; L453-L979 HydrophobicContact CD2-CD2 3.71Å; Q487-L979 HydrophobicContact CB-CD2 4.01Å; V504-L979 HydrophobicContact CB-CD1 4.43Å; V504-L979 HydrophobicContact CG2-CB 3.98Å; V504-L979 HydrophobicContact CG2-CD1 3.8Å; V504-L979 HydrophobicContact CG2-CG 4.48Å; D976-L979 PolarHBondContact O-N 3.4Å; D976-L979 VanDerWaalsContact O-N 3.1Å; T977-L979 VanDerWaalsContact C-N 3.32Å; T977-L979 PolarHBondContact O-N 3.43Å; L979-Q981 PolarHBondContact O-N 3.16Å; L979-S982 WeakPolarHBondContact O-CB 3.36Å; L979-S982 PolarHBondContact O-N 2.9Å; L979-S982 PolarHBondContact O-OG 3.44Å
980	Y	91.4	Very high	90.5	Very high	2 Å²	2	14.5 Å²	14.5	1%	0.008	8%	0.077	C	C	.	.	H	α-helix	trans	-65.4	-42.9	-175.5	-50.3	-23.2	0	0	0	112.1	L382 F386 E389 L453 D976 T977 S982 F983	L382-Y980 WeakPolarHBondContact CD1-OH 3.49Å; F386-Y980 VanDerWaalsContact CA-CE2 3.46Å; F386-Y980 HydrophobicContact CB-CD2 4.17Å; F386-Y980 HydrophobicContact CB-CE2 3.72Å; F386-Y980 AromaticContact CD2-CD1 3.53Å; F386-Y980 HydrophobicContact CD2-CD1 3.53Å; F386-Y980 AromaticContact CD2-CD2 3.92Å; F386-Y980 HydrophobicContact CD2-CD2 3.92Å; F386-Y980 AromaticContact CD2-CE1 3.62Å; F386-Y980 HydrophobicContact CD2-CE1 3.62Å; F386-Y980 AromaticContact CD2-CE2 3.98Å; F386-Y980 HydrophobicContact CD2-CE2 3.98Å; F386-Y980 AromaticContact CD2-CG 3.69Å; F386-Y980 HydrophobicContact CD2-CG 3.69Å; F386-Y980 AromaticContact CD2-CZ 3.82Å; F386-Y980 AromaticContact CE2-CD1 3.98Å; F386-Y980 HydrophobicContact CE2-CD1 3.98Å; F386-Y980 HydrophobicContact CE2-CE1 4.34Å; F386-Y980 HydrophobicContact CE2-CG 4.27Å; F386-Y980 HydrophobicContact CG-CE2 4.37Å; E389-Y980 HydrophobicContact CB-CD2 4.38Å; E389-Y980 HydrophobicContact CG-CD2 4.47Å; L453-Y980 HydrophobicContact CD1-CE1 4.09Å; L453-Y980 WeakPolarHBondContact CD1-OH 3.32Å; L453-Y980 HydrophobicContact CD2-CE1 3.9Å; D976-Y980 HydrophobicContact CB-CE2 3.73Å; D976-Y980 WeakPolarHBondContact O-CD1 3.11Å; D976-Y980 WeakPolarHBondContact O-CD2 3.44Å; D976-Y980 VanDerWaalsContact O-CG 3.31Å; D976-Y980 PolarHBondContact O-N 2.95Å; T977-Y980 HydrophobicContact CG2-CD2 4.37Å; T977-Y980 PolarHBondContact O-N 3.48Å; Y980-S982 VanDerWaalsContact C-N 3.25Å; Y980-S982 PolarHBondContact O-N 3.46Å; Y980-F983 PolarHBondContact O-N 3.46Å
981	Q	90.8	Very high	90.5	Very high	1 Å²	1	14.6 Å²	14.6	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-67.5	-26.5	177.9	-162.5	-172.8	67.9	0	0	111.9	V531 T977 L979 F983 V984 K985	V531-Q981 VanDerWaalsContact O-CD 3.27Å; V531-Q981 PolarHBondContact O-NE2 3.32Å; T977-Q981 WeakPolarHBondContact O-CB 3.34Å; T977-Q981 PolarHBondContact O-N 2.86Å; L979-Q981 PolarHBondContact O-N 3.16Å; Q981-F983 PolarHBondContact O-N 3.44Å; Q981-V984 PolarHBondContact O-N 3.06Å; Q981-K985 HydrophobicContact CG-CD 3.84Å; Q981-K985 HydrophobicContact CG-CG 4.26Å; Q981-K985 VanDerWaalsContact NE2-NZ 3.18Å; Q981-K985 PolarHBondContact O-N 3.49Å
982	S	92.2	Very high	90.6	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-61.1	-26.6	-179.9	76.5	0	0	0	0	113.7	Y485 L978 L979 Y980 V984 K985 D986	Y485-S982 WeakPolarHBondContact CD1-OG 3.47Å; L978-S982 PolarHBondContact O-N 3.02Å; L979-S982 WeakPolarHBondContact O-CB 3.36Å; L979-S982 PolarHBondContact O-N 2.9Å; L979-S982 PolarHBondContact O-OG 3.44Å; Y980-S982 VanDerWaalsContact C-N 3.25Å; Y980-S982 PolarHBondContact O-N 3.46Å; S982-V984 PolarHBondContact O-N 3.22Å; S982-K985 CarbonylContact O-C 3.58Å; S982-K985 VanDerWaalsContact O-C 3.24Å; S982-K985 PolarHBondContact O-N 2.94Å; S982-D986 PolarHBondContact O-N 2.95Å
983	F	92.7	Very high	90.8	Very high	32 Å²	32	15.3 Å²	15.3	14%	0.14	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-25.9	172.7	175.1	-88.3	0	0	0	113.7	V371 F390 L396 Y399 A449 F451 Y485 Y980 Q981	V371-F983 HydrophobicContact CG2-CE2 4.16Å; V371-F983 HydrophobicContact CG2-CZ 4.19Å; F390-F983 HydrophobicContact CE2-CD1 4.18Å; F390-F983 HydrophobicContact CE2-CE1 4.45Å; L396-F983 HydrophobicContact CD1-CD1 4.22Å; L396-F983 HydrophobicContact CD1-CE1 4.48Å; L396-F983 HydrophobicContact CD2-CD1 4.19Å; L396-F983 HydrophobicContact CD2-CE1 3.65Å; L396-F983 HydrophobicContact CG-CE1 4.49Å; Y399-F983 HydrophobicContact CE1-CE1 4.29Å; Y399-F983 HydrophobicContact CE1-CZ 4.01Å; A449-F983 HydrophobicContact CB-CD2 3.59Å; A449-F983 HydrophobicContact CB-CE2 3.5Å; A449-F983 VanDerWaalsContact CB-CE2 3.5Å; F451-F983 HydrophobicContact CE1-CB 4.5Å; F451-F983 HydrophobicContact CZ-CB 3.8Å; F451-F983 HydrophobicContact CZ-CG 4.43Å; Y485-F983 HydrophobicContact CE1-CB 4.16Å; Y485-F983 HydrophobicContact CE2-CD2 4Å; Y485-F983 AromaticContact CZ-CD2 3.96Å; Y980-F983 PolarHBondContact O-N 3.46Å; Q981-F983 PolarHBondContact O-N 3.44Å
984	V	90.5	Very high	91	Very high	45 Å²	45	15.1 Å²	15.1	27%	0.273	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-17.8	175.3	-167.7	0	0	0	0	111.8	H393 L396 Q981 S982	H393-V984 HydrophobicContact CB-CG2 4.44Å; L396-V984 HydrophobicContact CD1-CG2 3.54Å; L396-V984 HydrophobicContact CG-CG2 4.25Å; Q981-V984 PolarHBondContact O-N 3.06Å; S982-V984 PolarHBondContact O-N 3.22Å
985	K	91.7	Very high	91.2	Very high	3 Å²	3	15.9 Å²	15.9	1%	0.013	8%	0.082	C	C	.	.			trans	-138.5	72	-171.7	-57.2	-173.2	-169.1	175.8	0	110.3	E569 V570 Q981 S982 Y987 M988	E569-K985 IonicContact OE2-NZ 3.77Å; E569-K985 PolarHBondContact OE2-NZ 3.07Å; V570-K985 PolarHBondContact O-NZ 3.18Å; Q981-K985 HydrophobicContact CG-CD 3.84Å; Q981-K985 HydrophobicContact CG-CG 4.26Å; Q981-K985 VanDerWaalsContact NE2-NZ 3.18Å; Q981-K985 PolarHBondContact O-N 3.49Å; S982-K985 CarbonylContact O-C 3.58Å; S982-K985 VanDerWaalsContact O-C 3.24Å; S982-K985 PolarHBondContact O-N 2.94Å; K985-Y987 HydrophobicContact CB-CD1 4.39Å; K985-Y987 HydrophobicContact CB-CE1 3.73Å; K985-Y987 HydrophobicContact CB-CE2 4.32Å; K985-Y987 HydrophobicContact CG-CE1 4.25Å; K985-Y987 WeakPolarHBondContact CG-OH 3.35Å; K985-Y987 PolarHBondContact O-N 3.11Å; K985-M988 HydrophobicContact CB-CB 4.14Å; K985-M988 HydrophobicContact CB-CE 4.48Å; K985-M988 HydrophobicContact CD-CE 3.7Å; K985-M988 VanDerWaalsContact O-CB 3.26Å; K985-M988 WeakPolarHBondContact O-CB 3.32Å; K985-M988 PolarHBondContact O-N 2.86Å
986	D	90.6	Very high	91.4	Very high	94 Å²	94	15.8 Å²	15.8	50%	0.503	8%	0.081	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-29.6	-177.1	-52.1	-58.7	0	0	0	114.6	Q502 S982	Q502-D986 PolarHBondContact NE2-O 2.95Å; S982-D986 PolarHBondContact O-N 2.95Å
987	Y	90.9	Very high	91.2	Very high	17 Å²	17	15.8 Å²	15.8	7%	0.067	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-12.3	-178.5	55.6	-84.7	0	0	0	114	V570 H572 Y632 K985 I989 L990 I991	V570-Y987 HydrophobicContact CG1-CE2 4.26Å; H572-Y987 HydrophobicContact CB-CE1 4.36Å; H572-Y987 AromaticContact CE1-CE1 3.64Å; H572-Y987 AromaticContact CG-CE1 3.87Å; H572-Y987 AromaticContact ND1-CE1 3.09Å; H572-Y987 WeakPolarHBondContact ND1-CE1 3.26Å; H572-Y987 AromaticContact ND1-CZ 3.31Å; H572-Y987 VanDerWaalsContact ND1-CZ 3.31Å; H572-Y987 PolarHBondContact ND1-OH 2.88Å; H572-Y987 VanDerWaalsContact ND1-OH 3.14Å; Y632-Y987 AromaticContact CD1-CD2 3.73Å; Y632-Y987 HydrophobicContact CD1-CD2 3.73Å; Y632-Y987 AromaticContact CD1-CE2 3.93Å; Y632-Y987 HydrophobicContact CD1-CE2 3.93Å; Y632-Y987 HydrophobicContact CD1-CG 4.32Å; Y632-Y987 HydrophobicContact CE1-CD1 4.13Å; Y632-Y987 AromaticContact CE1-CD2 3.4Å; Y632-Y987 HydrophobicContact CE1-CD2 3.4Å; Y632-Y987 VanDerWaalsContact CE1-CD2 3.4Å; Y632-Y987 AromaticContact CE1-CE2 3.91Å; Y632-Y987 HydrophobicContact CE1-CE2 3.91Å; Y632-Y987 AromaticContact CE1-CG 3.52Å; Y632-Y987 HydrophobicContact CE1-CG 3.52Å; K985-Y987 HydrophobicContact CB-CD1 4.39Å; K985-Y987 HydrophobicContact CB-CE1 3.73Å; K985-Y987 HydrophobicContact CB-CE2 4.32Å; K985-Y987 HydrophobicContact CG-CE1 4.25Å; K985-Y987 WeakPolarHBondContact CG-OH 3.35Å; K985-Y987 PolarHBondContact O-N 3.11Å; Y987-I989 PolarHBondContact O-N 2.66Å; Y987-L990 PolarHBondContact O-N 2.85Å; Y987-I991 HydrophobicContact CD2-CD1 3.79Å; Y987-I991 HydrophobicContact CD2-CG1 4.48Å; Y987-I991 PolarHBondContact O-N 3.25Å
988	M	92.1	Very high	91	Very high	5 Å²	5	15.9 Å²	15.9	3%	0.025	8%	0.083	C	C	.	.	H	α-helix	trans	-61.5	-45.1	-173.1	-173.8	56.3	60.5	0	0	112	V531 V570 K985 L990 I991 A992	V531-M988 HydrophobicContact CG1-CG 4.42Å; V531-M988 HydrophobicContact CG1-SD 4.21Å; V570-M988 HydrophobicContact CB-CE 3.75Å; V570-M988 HydrophobicContact CG1-CE 4.45Å; V570-M988 HydrophobicContact CG2-CE 4.36Å; K985-M988 HydrophobicContact CB-CB 4.14Å; K985-M988 HydrophobicContact CB-CE 4.48Å; K985-M988 HydrophobicContact CD-CE 3.7Å; K985-M988 VanDerWaalsContact O-CB 3.26Å; K985-M988 WeakPolarHBondContact O-CB 3.32Å; K985-M988 PolarHBondContact O-N 2.86Å; M988-L990 VanDerWaalsContact C-N 3.28Å; M988-L990 PolarHBondContact O-N 3.47Å; M988-I991 PolarHBondContact O-N 3.05Å; M988-A992 VanDerWaalsContact O-CB 3.3Å; M988-A992 WeakPolarHBondContact O-CB 3.4Å; M988-A992 PolarHBondContact O-N 3.5Å
989	I	92.8	Very high	90.5	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-62.4	-39.2	179.4	-45.2	-161.7	0	0	0	110.8	Q502 V504 F509 L978 Y987 R993	Q502-I989 HydrophobicContact CB-CD1 3.94Å; Q502-I989 HydrophobicContact CG-CD1 4.38Å; V504-I989 HydrophobicContact CG2-CD1 3.74Å; F509-I989 HydrophobicContact CE2-CG2 4.31Å; F509-I989 HydrophobicContact CZ-CG2 3.91Å; L978-I989 HydrophobicContact CD2-CB 4.25Å; L978-I989 HydrophobicContact CD2-CD1 4.14Å; L978-I989 HydrophobicContact CD2-CG1 3.76Å; L978-I989 HydrophobicContact CD2-CG2 4.15Å; Y987-I989 PolarHBondContact O-N 2.66Å; I989-R993 PolarHBondContact O-N 2.88Å
990	L	90.8	Very high	89.9	Confident	74 Å²	74	19.8 Å²	19.8	39%	0.387	11%	0.105	S	C	.	.	H	α-helix	trans	-68.9	-47.4	178.2	-63.6	173.3	0	0	0	111.7	I615 Y987 M988 A992 R993 L994	I615-L990 HydrophobicContact CD1-CB 4.05Å; I615-L990 HydrophobicContact CD1-CD1 4.44Å; Y987-L990 PolarHBondContact O-N 2.85Å; M988-L990 VanDerWaalsContact C-N 3.28Å; M988-L990 PolarHBondContact O-N 3.47Å; L990-A992 VanDerWaalsContact C-N 3.3Å; L990-A992 PolarHBondContact O-N 3.41Å; L990-R993 PolarHBondContact O-N 3.45Å; L990-L994 WeakPolarHBondContact O-CB 3.34Å; L990-L994 WeakPolarHBondContact O-CD1 3.32Å; L990-L994 WeakPolarHBondContact O-CG 3.38Å; L990-L994 PolarHBondContact O-N 2.87Å
991	I	92.2	Very high	89.2	Confident	2 Å²	2	21.6 Å²	21.6	1%	0.01	12%	0.117	C	C	.	.	H	α-helix	trans	-62.3	-39.8	176.7	-68.1	-172.8	0	0	0	110.8	V570 I615 L617 Y632 Y987 M988 L994 L995	V570-I991 HydrophobicContact CG1-CD1 4.23Å; I615-I991 HydrophobicContact CD1-CD1 4.27Å; I615-I991 HydrophobicContact CD1-CG1 3.71Å; I615-I991 HydrophobicContact CG2-CD1 4.47Å; I615-I991 HydrophobicContact CG2-CG1 4.19Å; L617-I991 HydrophobicContact CD2-CG2 4.49Å; Y632-I991 HydrophobicContact CD1-CD1 3.59Å; Y632-I991 HydrophobicContact CD2-CD1 4.13Å; Y632-I991 HydrophobicContact CE1-CD1 4.07Å; Y632-I991 HydrophobicContact CG-CD1 3.62Å; Y987-I991 HydrophobicContact CD2-CD1 3.79Å; Y987-I991 HydrophobicContact CD2-CG1 4.48Å; Y987-I991 PolarHBondContact O-N 3.25Å; M988-I991 PolarHBondContact O-N 3.05Å; I991-L994 PolarHBondContact O-N 2.91Å; I991-L995 HydrophobicContact CG2-CD1 3.79Å; I991-L995 HydrophobicContact CG2-CG 4.23Å; I991-L995 WeakPolarHBondContact O-CB 3.46Å; I991-L995 WeakPolarHBondContact O-CG 3.4Å; I991-L995 PolarHBondContact O-N 2.99Å
992	A	92.3	Very high	88.3	Confident	3 Å²	3	27.4 Å²	27.4	3%	0.025	15%	0.154	C	C	.	.	H	α-helix	trans	-64.5	-45.2	175.6	0	0	0	0	0	112	F509 L978 M988 L990 L994 L995 L996	F509-A992 HydrophobicContact CE1-CB 3.77Å; F509-A992 HydrophobicContact CZ-CB 4.47Å; L978-A992 HydrophobicContact CD1-CB 3.76Å; M988-A992 VanDerWaalsContact O-CB 3.3Å; M988-A992 WeakPolarHBondContact O-CB 3.4Å; M988-A992 PolarHBondContact O-N 3.5Å; L990-A992 VanDerWaalsContact C-N 3.3Å; L990-A992 PolarHBondContact O-N 3.41Å; A992-L994 PolarHBondContact O-N 3.18Å; A992-L995 PolarHBondContact O-N 3.48Å; A992-L996 VanDerWaalsContact O-CB 3.3Å; A992-L996 WeakPolarHBondContact O-CB 3.26Å; A992-L996 WeakPolarHBondContact O-CG 3.47Å; A992-L996 PolarHBondContact O-N 3.41Å
993	R	91.4	Very high	87.2	Confident	17 Å²	17	28.3 Å²	28.3	6%	0.064	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-35.8	175	-76.6	-165.9	170.9	106.8	-2.6	113.1	V503 E508 F509 I989 L990 G997 L998 D999	V503-R993 PolarHBondContact O-NH1 3.43Å; V503-R993 VanDerWaalsContact O-NH1 3.17Å; V503-R993 PolarHBondContact O-NH2 3.03Å; E508-R993 IonicContact OE2-CZ 4Å; E508-R993 IonicContact OE2-NE 3.5Å; E508-R993 PolarHBondContact OE2-NE 3.34Å; E508-R993 IonicContact OE2-NH2 2.65Å; E508-R993 PolarHBondContact OE2-NH2 3.38Å; F509-R993 HydrophobicContact CE1-CG 3.99Å; F509-R993 HydrophobicContact CE2-CG 4.3Å; F509-R993 HydrophobicContact CZ-CG 3.57Å; I989-R993 PolarHBondContact O-N 2.88Å; L990-R993 PolarHBondContact O-N 3.45Å; R993-G997 PolarHBondContact O-N 3.05Å; R993-L998 HydrophobicContact CB-CB 4.16Å; R993-L998 HydrophobicContact CG-CB 4.27Å; R993-L998 HydrophobicContact CG-CD1 4.18Å; R993-L998 PolarHBondContact O-N 3.39Å; R993-D999 HydrophobicContact CB-CB 3.98Å; R993-D999 WeakPolarHBondContact CB-OD2 3.44Å; R993-D999 WeakPolarHBondContact CD-OD2 3.3Å; R993-D999 PolarHBondContact O-N 2.78Å
994	L	90.9	Very high	86.6	Confident	11 Å²	11	27.1 Å²	27.1	6%	0.058	16%	0.159	C	C	.	.	H	α-helix	trans	-66.9	-49.3	174.4	-76.8	156.2	0	0	0	111.8	I615 L617 L990 I991 A992 L996 G997 D999 S1004	I615-L994 HydrophobicContact CB-CD1 3.85Å; I615-L994 HydrophobicContact CG2-CD1 4.3Å; I615-L994 WeakPolarHBondContact O-CD1 3.42Å; L617-L994 HydrophobicContact CD1-CB 3.58Å; L617-L994 HydrophobicContact CG-CB 3.89Å; L617-L994 HydrophobicContact CG-CD1 4.41Å; L990-L994 WeakPolarHBondContact O-CB 3.34Å; L990-L994 WeakPolarHBondContact O-CD1 3.32Å; L990-L994 WeakPolarHBondContact O-CG 3.38Å; L990-L994 PolarHBondContact O-N 2.87Å; I991-L994 PolarHBondContact O-N 2.91Å; A992-L994 PolarHBondContact O-N 3.18Å; L994-L996 PolarHBondContact O-N 3.12Å; L994-G997 PolarHBondContact O-N 3.41Å; L994-D999 WeakPolarHBondContact CD2-O 3.35Å; L994-S1004 WeakPolarHBondContact CD2-OG 3.18Å
995	L	90.1	Very high	86.2	Confident	16 Å²	16	25 Å²	25	8%	0.084	15%	0.147	C	C	.	.	H	α-helix	trans	-60.7	-34.2	177.3	-76.8	171.2	0	0	0	112.4	L617 I991 A992 G997 I1038 I1213	L617-L995 HydrophobicContact CD1-CD2 3.76Å; L617-L995 HydrophobicContact CD1-CG 3.86Å; I991-L995 HydrophobicContact CG2-CD1 3.79Å; I991-L995 HydrophobicContact CG2-CG 4.23Å; I991-L995 WeakPolarHBondContact O-CB 3.46Å; I991-L995 WeakPolarHBondContact O-CG 3.4Å; I991-L995 PolarHBondContact O-N 2.99Å; A992-L995 PolarHBondContact O-N 3.48Å; L995-G997 VanDerWaalsContact C-N 3.32Å; L995-I1038 HydrophobicContact CD2-CD1 4.35Å; L995-I1213 HydrophobicContact CD2-CD1 4.32Å
996	L	90.6	Very high	86	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.005	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-5.6	177.2	-67.3	174.1	0	0	0	114.1	F509 A512 M513 L516 V527 A992 L994 L998	F509-L996 HydrophobicContact CD1-CD1 3.46Å; F509-L996 VanDerWaalsContact CD1-CD1 3.46Å; F509-L996 HydrophobicContact CE1-CD1 3.95Å; A512-L996 HydrophobicContact CB-CB 4.09Å; A512-L996 HydrophobicContact CB-CD1 4.42Å; M513-L996 HydrophobicContact CE-CD1 4.14Å; M513-L996 HydrophobicContact CG-CD1 4.23Å; M513-L996 HydrophobicContact CG-CD2 3.76Å; L516-L996 HydrophobicContact CD1-CB 4.28Å; L516-L996 HydrophobicContact CD1-CD2 3.78Å; L516-L996 WeakPolarHBondContact CD1-O 3.35Å; V527-L996 HydrophobicContact CG2-CD2 4.4Å; A992-L996 VanDerWaalsContact O-CB 3.3Å; A992-L996 WeakPolarHBondContact O-CB 3.26Å; A992-L996 WeakPolarHBondContact O-CG 3.47Å; A992-L996 PolarHBondContact O-N 3.41Å; L994-L996 PolarHBondContact O-N 3.12Å; L996-L998 VanDerWaalsContact C-N 3.26Å; L996-L998 HydrophobicContact CB-CD1 4.35Å; L996-L998 HydrophobicContact CB-CG 4.38Å; L996-L998 HydrophobicContact CD1-CD1 4.49Å; L996-L998 PolarHBondContact O-N 2.97Å
997	G	86.2	Confident	85.9	Confident	3 Å²	3	21.4 Å²	21.4	3%	0.031	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	19.3	-178	0	0	0	0	0	114.7	R993 L994 L995	R993-G997 PolarHBondContact O-N 3.05Å; L994-G997 PolarHBondContact O-N 3.41Å; L995-G997 VanDerWaalsContact C-N 3.32Å
998	L	85.1	Confident	85.8	Confident	3 Å²	3	21.2 Å²	21.2	2%	0.016	13%	0.128	C	C	.	.	S	Bend	trans	-78.4	-54.3	176	-75	169.3	0	0	0	111	E508 A512 S763 N816 R993 L996	E508-L998 HydrophobicContact CB-CD1 4.24Å; A512-L998 HydrophobicContact CB-CD1 3.89Å; A512-L998 HydrophobicContact CB-CD2 3.98Å; A512-L998 HydrophobicContact CB-CG 3.84Å; S763-L998 WeakPolarHBondContact CB-O 3.26Å; S763-L998 PolarHBondContact OG-O 3.31Å; N816-L998 HydrophobicContact CB-CD2 4.39Å; R993-L998 HydrophobicContact CB-CB 4.16Å; R993-L998 HydrophobicContact CG-CB 4.27Å; R993-L998 HydrophobicContact CG-CD1 4.18Å; R993-L998 PolarHBondContact O-N 3.39Å; L996-L998 VanDerWaalsContact C-N 3.26Å; L996-L998 HydrophobicContact CB-CD1 4.35Å; L996-L998 HydrophobicContact CB-CG 4.38Å; L996-L998 HydrophobicContact CD1-CD1 4.49Å; L996-L998 PolarHBondContact O-N 2.97Å
999	D	82.5	Confident	85.6	Confident	44 Å²	44	22.5 Å²	22.5	24%	0.235	14%	0.139	C	C	.	.	S	Bend	trans	-102.3	97.1	175.3	-71.9	-24.8	0	0	0	108.4	S763 R993 L994	S763-D999 WeakPolarHBondContact CB-OD1 3.35Å; R993-D999 HydrophobicContact CB-CB 3.98Å; R993-D999 WeakPolarHBondContact CB-OD2 3.44Å; R993-D999 WeakPolarHBondContact CD-OD2 3.3Å; R993-D999 PolarHBondContact O-N 2.78Å; L994-D999 WeakPolarHBondContact CD2-O 3.35Å
1000	T	79.4	Confident	85.5	Confident	41 Å²	41	24.5 Å²	24.5	25%	0.252	15%	0.149	S	C	.	.			trans	-94.2	110.8	176.3	59	0	0	0	0	110.8	T765 Y825	T765-T1000 HydrophobicContact CG2-CG2 4.1Å; Y825-T1000 HydrophobicContact CE1-CG2 4.32Å
1001	T	76.9	Confident	85.5	Confident	41 Å²	41	26 Å²	26	25%	0.252	15%	0.152	S	C	.	.			trans	-89.3	149.5	171.2	51.9	0	0	0	0	110.8	G1003 S1004	T1001-G1003 PolarHBondContact O-N 3.48Å; T1001-S1004 PolarHBondContact N-OG 3.02Å; T1001-S1004 PolarHBondContact O-N 2.92Å; T1001-S1004 VanDerWaalsContact O-N 3.08Å; T1001-S1004 PolarHBondContact O-OG 3.1Å; T1001-S1004 VanDerWaalsContact OG1-CB 3.27Å; T1001-S1004 WeakPolarHBondContact OG1-CB 3.24Å; T1001-S1004 PolarHBondContact OG1-OG 3.27Å
1002	P	72	Confident	85.5	Confident	123 Å²	123	26 Å²	26	80%	0.799	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	130.3	170.1	-23.6	34.3	0	0	0	110.4
1003	G	69.3	Low	85.4	Confident	18 Å²	18	31.5 Å²	31.5	19%	0.186	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	5.6	-175.7	0	0	0	0	0	115.7	T1001 D1216	T1001-G1003 PolarHBondContact O-N 3.48Å; G1003-D1216 VanDerWaalsContact CA-OD2 3.25Å; G1003-D1216 WeakPolarHBondContact CA-OD2 3.38Å; G1003-D1216 PolarHBondContact N-OD2 2.75Å
1004	S	80.3	Confident	85.2	Confident	7 Å²	7	38.1 Å²	38.1	5%	0.049	21%	0.207	C	C	.	.			trans	-95.4	128.3	171	70.1	0	0	0	0	112.7	L994 T1001	L994-S1004 WeakPolarHBondContact CD2-OG 3.18Å; T1001-S1004 PolarHBondContact N-OG 3.02Å; T1001-S1004 PolarHBondContact O-N 2.92Å; T1001-S1004 VanDerWaalsContact O-N 3.08Å; T1001-S1004 PolarHBondContact O-OG 3.1Å; T1001-S1004 VanDerWaalsContact OG1-CB 3.27Å; T1001-S1004 WeakPolarHBondContact OG1-CB 3.24Å; T1001-S1004 PolarHBondContact OG1-OG 3.27Å
1005	G	82	Confident	84.9	Confident	2 Å²	2	43.6 Å²	43.6	2%	0.021	23%	0.233	C	C	.	.			trans	-67.8	170	172.6	0	0	0	0	0	115.4	L617 R1214	L617-G1005 PolarHBondContact O-N 3.02Å; G1005-R1214 CarbonylContact C-O 3.51Å; G1005-R1214 WeakPolarHBondContact CA-O 3.16Å
1006	F	87.7	Confident	84.7	Confident	14 Å²	14	43.6 Å²	43.6	6%	0.061	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	157.7	-172	65.7	-83	0	0	0	112.5	Y825 C1008 R1214 P1217	Y825-F1006 HydrophobicContact CD1-CB 4.07Å; Y825-F1006 HydrophobicContact CD1-CD1 4.23Å; Y825-F1006 HydrophobicContact CD1-CG 4.05Å; Y825-F1006 HydrophobicContact CD2-CB 4.17Å; Y825-F1006 HydrophobicContact CD2-CD1 4.23Å; Y825-F1006 AromaticContact CD2-CD2 3.38Å; Y825-F1006 HydrophobicContact CD2-CD2 3.38Å; Y825-F1006 AromaticContact CD2-CE2 3.73Å; Y825-F1006 HydrophobicContact CD2-CE2 3.73Å; Y825-F1006 AromaticContact CD2-CG 3.66Å; Y825-F1006 HydrophobicContact CD2-CG 3.66Å; Y825-F1006 HydrophobicContact CD2-CZ 4.3Å; Y825-F1006 HydrophobicContact CE1-CB 4.03Å; Y825-F1006 HydrophobicContact CE1-CG 4.43Å; Y825-F1006 HydrophobicContact CE2-CB 4.15Å; Y825-F1006 AromaticContact CE2-CD2 3.83Å; Y825-F1006 HydrophobicContact CE2-CD2 3.83Å; Y825-F1006 HydrophobicContact CE2-CG 4.1Å; Y825-F1006 HydrophobicContact CG-CB 4.15Å; Y825-F1006 AromaticContact CG-CD1 3.82Å; Y825-F1006 HydrophobicContact CG-CD1 3.82Å; Y825-F1006 AromaticContact CG-CD2 3.85Å; Y825-F1006 HydrophobicContact CG-CD2 3.85Å; Y825-F1006 HydrophobicContact CG-CE1 4.17Å; Y825-F1006 HydrophobicContact CG-CE2 4.18Å; Y825-F1006 AromaticContact CG-CG 3.66Å; Y825-F1006 HydrophobicContact CG-CG 3.66Å; Y825-F1006 HydrophobicContact CG-CZ 4.32Å; F1006-C1008 HydrophobicContact CE2-CB 4.22Å; F1006-R1214 HydrophobicContact CD1-CB 3.83Å; F1006-R1214 HydrophobicContact CD2-CB 4.34Å; F1006-R1214 HydrophobicContact CE1-CB 3.33Å; F1006-R1214 HydrophobicContact CE1-CG 4.12Å; F1006-R1214 HydrophobicContact CE2-CB 3.92Å; F1006-R1214 HydrophobicContact CE2-CG 3.92Å; F1006-R1214 HydrophobicContact CG-CB 4.31Å; F1006-R1214 HydrophobicContact CZ-CB 3.4Å; F1006-R1214 HydrophobicContact CZ-CG 3.64Å; F1006-R1214 PolarHBondContact N-O 2.81Å; F1006-R1214 PolarHBondContact O-N 3.35Å; F1006-P1217 HydrophobicContact CE1-CG 4.03Å
1007	L	88.6	Confident	84.3	Confident	6 Å²	6	47.4 Å²	47.4	3%	0.031	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	133.1	178.8	-168	67.8	0	0	0	112.1	T523 R826 I1038	T523-L1007 HydrophobicContact CG2-CD2 3.6Å; R826-L1007 PolarHBondContact NH1-O 3.41Å; R826-L1007 PolarHBondContact NH2-O 2.94Å; L1007-I1038 HydrophobicContact CD1-CD1 3.59Å
1008	C	88.4	Confident	84.3	Confident	13 Å²	13	55.9 Å²	55.9	9%	0.088	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	162.8	178.5	-159.9	0	0	0	0	110.8	F1006 L1212 R1214	F1006-C1008 HydrophobicContact CE2-CB 4.22Å; C1008-L1212 PolarHBondContact N-O 3.41Å; C1008-L1212 PolarHBondContact O-N 2.87Å; C1008-R1214 HydrophobicContact CB-CG 3.74Å
1009	A	88.9	Confident	84.3	Confident	32 Å²	32	55.9 Å²	55.9	26%	0.264	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	139	175.5	0	0	0	0	0	110.4	C520 I1209 V1210	C520-A1009 HydrophobicContact CB-CB 4.22Å; C520-A1009 PolarHBondContact SG-N 3.22Å; A1009-I1209 HydrophobicContact CB-CG2 3.81Å; A1009-V1210 WeakPolarHBondContact CA-O 3.36Å
1010	M	90.2	Very high	84.5	Confident	43 Å²	43	55.2 Å²	55.2	21%	0.212	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	119.8	167.4	-179.4	-175.7	176.7	0	0	109.2	D1016 L1029 V1210 L1212	M1010-D1016 VanDerWaalsContact CE-OD2 3.24Å; M1010-D1016 WeakPolarHBondContact CE-OD2 3.35Å; M1010-L1029 HydrophobicContact SD-CD2 4.04Å; M1010-V1210 PolarHBondContact N-O 2.67Å; M1010-V1210 PolarHBondContact O-N 2.53Å; M1010-L1212 HydrophobicContact CB-CD1 3.64Å; M1010-L1212 HydrophobicContact CB-CG 4.37Å; M1010-L1212 HydrophobicContact SD-CD1 4.43Å
1011	K	91.2	Very high	85.1	Confident	105 Å²	105	55 Å²	55	46%	0.457	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	124.5	174.7	-174.6	178	179.6	-172.1	0	110.8	K1013 N1207 I1209	K1011-K1013 PolarHBondContact O-N 3.14Å; K1011-N1207 WeakPolarHBondContact CE-OD1 3.3Å; K1011-N1207 PolarHBondContact NZ-OD1 2.79Å; K1011-I1209 HydrophobicContact CB-CG1 4.04Å; K1011-I1209 HydrophobicContact CD-CG1 4.5Å; K1011-I1209 HydrophobicContact CG-CG1 3.92Å
1012	I	91.6	Very high	85.9	Confident	4 Å²	4	53 Å²	53	2%	0.021	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-72.4	121.4	175.2	-64.8	179.2	0	0	0	109.9	D1016 L1017 L1025 L1204 N1207 D1208 V1210	I1012-D1016 HydrophobicContact CG2-CB 4.15Å; I1012-L1017 HydrophobicContact CG2-CD1 3.93Å; I1012-L1025 HydrophobicContact CD1-CD2 4.41Å; I1012-L1204 HydrophobicContact CD1-CB 3.82Å; I1012-L1204 HydrophobicContact CD1-CD1 3.85Å; I1012-L1204 HydrophobicContact CD1-CD2 3.9Å; I1012-L1204 HydrophobicContact CD1-CG 4.05Å; I1012-N1207 WeakPolarHBondContact O-CA 3.25Å; I1012-N1207 PolarHBondContact O-N 2.99Å; I1012-D1208 WeakPolarHBondContact CB-O 3.39Å; I1012-D1208 HydrophobicContact CD1-CB 4.14Å; I1012-D1208 PolarHBondContact N-O 2.72Å; I1012-V1210 HydrophobicContact CD1-CG2 3.75Å; I1012-V1210 HydrophobicContact CG1-CG2 3.99Å
1013	K	90.1	Very high	86.9	Confident	118 Å²	118	47.8 Å²	47.8	51%	0.513	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-101.1	173.6	173.3	-62.5	166	173.8	172.7	0	110.4	K1011 E1015 D1016 L1017	K1011-K1013 PolarHBondContact O-N 3.14Å; K1013-E1015 HydrophobicContact CB-CG 3.84Å; K1013-E1015 HydrophobicContact CD-CG 3.87Å; K1013-E1015 WeakPolarHBondContact CD-OE1 3.4Å; K1013-E1015 WeakPolarHBondContact CE-OE1 3.1Å; K1013-E1015 IonicContact NZ-OE1 3.92Å; K1013-E1015 PolarHBondContact NZ-OE1 3.3Å; K1013-E1015 PolarHBondContact O-N 2.76Å; K1013-D1016 PolarHBondContact O-N 2.85Å; K1013-L1017 PolarHBondContact O-N 2.8Å
1014	E	87.1	Confident	87.9	Confident	155 Å²	155	54.3 Å²	54.3	72%	0.724	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-56.8	-33.9	172	-61.1	-177.2	173.8	0	0	112.8	D1016 L1017 I1206	E1014-D1016 PolarHBondContact O-N 3.27Å; E1014-L1017 PolarHBondContact O-N 2.89Å; E1014-I1206 HydrophobicContact CG-CD1 3.57Å; E1014-I1206 HydrophobicContact CG-CG1 4.34Å
1015	E	85.4	Confident	88.5	Confident	126 Å²	126	54 Å²	54	59%	0.589	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-68.5	-13.8	176.2	61	-178.9	165.1	0	0	114.9	K1013 W1018	K1013-E1015 HydrophobicContact CB-CG 3.84Å; K1013-E1015 HydrophobicContact CD-CG 3.87Å; K1013-E1015 WeakPolarHBondContact CD-OE1 3.4Å; K1013-E1015 WeakPolarHBondContact CE-OE1 3.1Å; K1013-E1015 IonicContact NZ-OE1 3.92Å; K1013-E1015 PolarHBondContact NZ-OE1 3.3Å; K1013-E1015 PolarHBondContact O-N 2.76Å; E1015-W1018 PolarHBondContact O-NE1 3.47Å; E1015-W1018 VanDerWaalsContact O-NE1 3.15Å
1016	D	84.5	Confident	89	Confident	17 Å²	17	54 Å²	54	9%	0.091	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-102.4	-8.4	174.8	-82.8	-62	0	0	0	113.4	M1010 I1012 K1013 E1014 W1018 I1019 K1028	M1010-D1016 VanDerWaalsContact CE-OD2 3.24Å; M1010-D1016 WeakPolarHBondContact CE-OD2 3.35Å; I1012-D1016 HydrophobicContact CG2-CB 4.15Å; K1013-D1016 PolarHBondContact O-N 2.85Å; E1014-D1016 PolarHBondContact O-N 3.27Å; D1016-W1018 PolarHBondContact O-N 3.47Å; D1016-W1018 VanDerWaalsContact O-N 3.09Å; D1016-I1019 HydrophobicContact CB-CD1 4.16Å; D1016-I1019 WeakPolarHBondContact O-CB 3.31Å; D1016-I1019 WeakPolarHBondContact O-CD1 3.37Å; D1016-I1019 VanDerWaalsContact O-CG1 3.23Å; D1016-I1019 WeakPolarHBondContact O-CG1 3.4Å; D1016-I1019 PolarHBondContact O-N 3.17Å; D1016-I1019 VanDerWaalsContact O-N 3.13Å; D1016-K1028 IonicContact OD1-NZ 2.69Å; D1016-K1028 PolarHBondContact OD1-NZ 3.41Å
1017	L	84	Confident	89.2	Confident	81 Å²	81	58.1 Å²	58.1	42%	0.424	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-63	-22.2	-173.2	-120.7	77.8	0	0	0	113.9	I1012 K1013 E1014 I1019 G1020 I1206	I1012-L1017 HydrophobicContact CG2-CD1 3.93Å; K1013-L1017 PolarHBondContact O-N 2.8Å; E1014-L1017 PolarHBondContact O-N 2.89Å; L1017-I1019 PolarHBondContact O-N 3.08Å; L1017-I1019 VanDerWaalsContact O-N 3.15Å; L1017-G1020 PolarHBondContact O-N 3.24Å; L1017-G1020 VanDerWaalsContact O-N 3.11Å; L1017-I1206 HydrophobicContact CD1-CB 4.23Å
1018	W	84.8	Confident	89.4	Confident	180 Å²	180	60.9 Å²	60.9	68%	0.682	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-60.4	-21.2	176.4	66.2	-92.4	0	0	0	113.8	E1015 D1016 K1028	E1015-W1018 PolarHBondContact O-NE1 3.47Å; E1015-W1018 VanDerWaalsContact O-NE1 3.15Å; D1016-W1018 PolarHBondContact O-N 3.47Å; D1016-W1018 VanDerWaalsContact O-N 3.09Å; W1018-K1028 HydrophobicContact CZ2-CD 4.32Å
1019	I	86.5	Confident	89.6	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.021	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-65.4	-42.1	176.2	-59.3	169.7	0	0	0	110	D1016 L1017 T1021 R1024 L1025 K1028 L1204	D1016-I1019 HydrophobicContact CB-CD1 4.16Å; D1016-I1019 WeakPolarHBondContact O-CB 3.31Å; D1016-I1019 WeakPolarHBondContact O-CD1 3.37Å; D1016-I1019 VanDerWaalsContact O-CG1 3.23Å; D1016-I1019 WeakPolarHBondContact O-CG1 3.4Å; D1016-I1019 PolarHBondContact O-N 3.17Å; D1016-I1019 VanDerWaalsContact O-N 3.13Å; L1017-I1019 PolarHBondContact O-N 3.08Å; L1017-I1019 VanDerWaalsContact O-N 3.15Å; I1019-T1021 PolarHBondContact O-N 3.22Å; I1019-R1024 HydrophobicContact CG2-CB 3.69Å; I1019-R1024 WeakPolarHBondContact O-CD 3.38Å; I1019-L1025 HydrophobicContact CD1-CD1 3.79Å; I1019-L1025 HydrophobicContact CG2-CB 3.85Å; I1019-K1028 HydrophobicContact CD1-CD 3.5Å; I1019-K1028 HydrophobicContact CG1-CD 4.23Å; I1019-L1204 HydrophobicContact CG2-CD1 4.38Å
1020	G	85.6	Confident	89.7	Confident	29 Å²	29	59.7 Å²	59.7	30%	0.299	28%	0.279	S	S	.	.			trans	72.9	-39.1	170.9	0	0	0	0	0	117.1	L1017 R1203 L1204	L1017-G1020 PolarHBondContact O-N 3.24Å; L1017-G1020 VanDerWaalsContact O-N 3.11Å; G1020-R1203 WeakPolarHBondContact O-CA 3.48Å; G1020-L1204 PolarHBondContact O-N 3.37Å
1021	T	92.9	Very high	89.7	Confident	37 Å²	37	62.3 Å²	62.3	23%	0.227	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-134	151.4	-178.1	63.8	0	0	0	0	113.9	I1019 G1023 R1024 L1025 T1202	I1019-T1021 PolarHBondContact O-N 3.22Å; T1021-G1023 VanDerWaalsContact C-N 3.32Å; T1021-G1023 PolarHBondContact O-N 2.92Å; T1021-R1024 PolarHBondContact O-N 3.06Å; T1021-L1025 PolarHBondContact O-N 2.97Å; T1021-L1025 VanDerWaalsContact O-N 3.07Å; T1021-T1202 CarbonylContact C-O 3.47Å; T1021-T1202 VanDerWaalsContact CA-O 3.26Å; T1021-T1202 WeakPolarHBondContact CA-O 3.31Å
1022	Y	93.2	Very high	89.6	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-57.7	-40.1	-179.1	-174.2	-99.4	0	0	0	112.8	H597 R1024 L1025 F1026 P1037 G1039 I1040 P1198 T1202 L1204 V1210	H597-Y1022 AromaticContact CE1-CD1 3.68Å; H597-Y1022 AromaticContact CE1-CE1 3.72Å; H597-Y1022 AromaticContact NE2-CE1 3.7Å; Y1022-R1024 VanDerWaalsContact C-N 3.28Å; Y1022-R1024 PolarHBondContact O-N 3.22Å; Y1022-L1025 WeakPolarHBondContact O-CB 3.27Å; Y1022-L1025 PolarHBondContact O-N 3.32Å; Y1022-L1025 VanDerWaalsContact O-N 3.15Å; Y1022-F1026 HydrophobicContact CE1-CD2 4.18Å; Y1022-F1026 PolarHBondContact O-N 3.47Å; Y1022-P1037 HydrophobicContact CE1-CG 4.48Å; Y1022-P1037 HydrophobicContact CE2-CB 3.99Å; Y1022-P1037 HydrophobicContact CE2-CG 4.28Å; Y1022-P1037 VanDerWaalsContact OH-C 3.29Å; Y1022-P1037 WeakPolarHBondContact OH-CB 3.2Å; Y1022-P1037 PolarHBondContact OH-O 3.15Å; Y1022-G1039 PolarHBondContact OH-N 2.82Å; Y1022-I1040 HydrophobicContact CD2-CG2 3.86Å; Y1022-I1040 HydrophobicContact CE2-CG2 3.86Å; Y1022-P1198 HydrophobicContact CD1-CG 3.87Å; Y1022-P1198 HydrophobicContact CD2-CG 3.93Å; Y1022-P1198 HydrophobicContact CE1-CG 3.85Å; Y1022-P1198 HydrophobicContact CE2-CG 3.89Å; Y1022-P1198 HydrophobicContact CG-CG 3.9Å; Y1022-T1202 VanDerWaalsContact CB-OG1 3.3Å; Y1022-T1202 WeakPolarHBondContact CB-OG1 3.33Å; Y1022-T1202 PolarHBondContact N-O 3.09Å; Y1022-L1204 HydrophobicContact CD2-CD2 4.28Å; Y1022-V1210 HydrophobicContact CE2-CG1 4.39Å
1023	G	91.9	Very high	89.4	Confident	13 Å²	13	63.7 Å²	63.7	13%	0.134	33%	0.325	C	S	.	.	H	α-helix	trans	-63.7	-28.5	176.4	0	0	0	0	0	114.4	T1021 Q1027 H1200	T1021-G1023 VanDerWaalsContact C-N 3.32Å; T1021-G1023 PolarHBondContact O-N 2.92Å; G1023-Q1027 PolarHBondContact O-N 3.26Å; G1023-H1200 PolarHBondContact N-O 2.76Å
1024	R	92	Very high	89.4	Confident	154 Å²	154	58.7 Å²	58.7	58%	0.581	31%	0.306	S	S	*	.	H	α-helix	trans	-79.7	-34.3	173.2	-72.4	174.3	170.4	-168.1	0.8	112	I1019 T1021 Y1022 Q1027 K1028	I1019-R1024 HydrophobicContact CG2-CB 3.69Å; I1019-R1024 WeakPolarHBondContact O-CD 3.38Å; T1021-R1024 PolarHBondContact O-N 3.06Å; Y1022-R1024 VanDerWaalsContact C-N 3.28Å; Y1022-R1024 PolarHBondContact O-N 3.22Å; R1024-Q1027 WeakPolarHBondContact O-CB 3.45Å; R1024-Q1027 PolarHBondContact O-N 2.92Å; R1024-K1028 PolarHBondContact O-N 2.89Å
1025	L	92.8	Very high	89.6	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-63.3	-44.7	172.6	-179.4	66.3	0	0	0	110.8	I1012 I1019 T1021 Y1022 Q1027 K1028 L1029 L1204 V1210	I1012-L1025 HydrophobicContact CD1-CD2 4.41Å; I1019-L1025 HydrophobicContact CD1-CD1 3.79Å; I1019-L1025 HydrophobicContact CG2-CB 3.85Å; T1021-L1025 PolarHBondContact O-N 2.97Å; T1021-L1025 VanDerWaalsContact O-N 3.07Å; Y1022-L1025 WeakPolarHBondContact O-CB 3.27Å; Y1022-L1025 PolarHBondContact O-N 3.32Å; Y1022-L1025 VanDerWaalsContact O-N 3.15Å; L1025-Q1027 VanDerWaalsContact C-N 3.27Å; L1025-Q1027 PolarHBondContact O-N 3.46Å; L1025-K1028 PolarHBondContact O-N 3.48Å; L1025-K1028 VanDerWaalsContact O-N 3.14Å; L1025-L1029 HydrophobicContact CD1-CD1 3.92Å; L1025-L1029 HydrophobicContact CD1-CG 3.99Å; L1025-L1029 HydrophobicContact CD2-CD1 4.26Å; L1025-L1029 HydrophobicContact CG-CD1 3.74Å; L1025-L1029 HydrophobicContact CG-CG 4.21Å; L1025-L1029 WeakPolarHBondContact O-CG 3.3Å; L1025-L1029 PolarHBondContact O-N 3.45Å; L1025-L1204 HydrophobicContact CB-CD1 3.85Å; L1025-L1204 HydrophobicContact CD2-CD1 3.98Å; L1025-L1204 HydrophobicContact CG-CD1 4.45Å; L1025-V1210 HydrophobicContact CD2-CB 4.34Å; L1025-V1210 HydrophobicContact CD2-CG1 3.95Å; L1025-V1210 HydrophobicContact CD2-CG2 3.75Å
1026	F	92.5	Very high	90	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-53.6	-46.2	173.2	-153	-57.4	0	0	0	110.6	S593 F594 H597 Y1022 C1030 I1036 P1037	S593-F1026 WeakPolarHBondContact OG-CZ 3.27Å; F594-F1026 HydrophobicContact CB-CD1 4.14Å; F594-F1026 HydrophobicContact CB-CE1 4.16Å; F594-F1026 HydrophobicContact CD2-CB 4.47Å; F594-F1026 AromaticContact CD2-CD1 3.93Å; F594-F1026 HydrophobicContact CD2-CD1 3.93Å; F594-F1026 HydrophobicContact CD2-CG 4.46Å; H597-F1026 HydrophobicContact CB-CD2 4.14Å; H597-F1026 HydrophobicContact CB-CE2 3.79Å; H597-F1026 HydrophobicContact CB-CZ 4.11Å; H597-F1026 AromaticContact CG-CD2 3.84Å; H597-F1026 AromaticContact CG-CE2 3.76Å; H597-F1026 AromaticContact ND1-CD2 3.93Å; Y1022-F1026 HydrophobicContact CE1-CD2 4.18Å; Y1022-F1026 PolarHBondContact O-N 3.47Å; F1026-C1030 HydrophobicContact CD1-CB 4.23Å; F1026-C1030 HydrophobicContact CE1-CB 4.48Å; F1026-C1030 WeakPolarHBondContact O-CB 3.36Å; F1026-C1030 PolarHBondContact O-N 3.31Å; F1026-I1036 HydrophobicContact CE2-CG2 4.49Å; F1026-I1036 HydrophobicContact CZ-CG2 3.93Å; F1026-P1037 HydrophobicContact CB-CG 4.2Å; F1026-P1037 HydrophobicContact CD2-CG 3.45Å; F1026-P1037 VanDerWaalsContact CD2-CG 3.45Å; F1026-P1037 HydrophobicContact CE2-CG 3.89Å; F1026-P1037 HydrophobicContact CG-CG 3.84Å
1027	Q	91.8	Very high	90.5	Very high	101 Å²	101	45 Å²	45	47%	0.472	24%	0.241	S	C	.	.	H	α-helix	trans	-61	-47.4	176.3	-166.9	177.5	-23.2	0	0	112.4	F594 G1023 R1024 L1025 S1031	F594-Q1027 HydrophobicContact CD2-CB 4.28Å; F594-Q1027 HydrophobicContact CE1-CG 4.22Å; F594-Q1027 HydrophobicContact CE2-CB 3.57Å; F594-Q1027 HydrophobicContact CE2-CG 4Å; F594-Q1027 HydrophobicContact CZ-CB 3.78Å; F594-Q1027 HydrophobicContact CZ-CG 3.69Å; G1023-Q1027 PolarHBondContact O-N 3.26Å; R1024-Q1027 WeakPolarHBondContact O-CB 3.45Å; R1024-Q1027 PolarHBondContact O-N 2.92Å; L1025-Q1027 VanDerWaalsContact C-N 3.27Å; L1025-Q1027 PolarHBondContact O-N 3.46Å; Q1027-S1031 VanDerWaalsContact O-CB 3.29Å; Q1027-S1031 WeakPolarHBondContact O-CB 3.48Å; Q1027-S1031 PolarHBondContact O-N 3.06Å; Q1027-S1031 VanDerWaalsContact O-N 3.13Å; Q1027-S1031 PolarHBondContact O-OG 3.44Å
1028	K	92.9	Very high	90.8	Very high	64 Å²	64	41.4 Å²	41.4	28%	0.278	22%	0.222	S	C	.	.	H	α-helix	trans	-55.6	-62.6	178	-178.6	-178.4	175.6	178.2	0	110.1	D1016 W1018 I1019 R1024 L1025 C1030 S1031 S1032	D1016-K1028 IonicContact OD1-NZ 2.69Å; D1016-K1028 PolarHBondContact OD1-NZ 3.41Å; W1018-K1028 HydrophobicContact CZ2-CD 4.32Å; I1019-K1028 HydrophobicContact CD1-CD 3.5Å; I1019-K1028 HydrophobicContact CG1-CD 4.23Å; R1024-K1028 PolarHBondContact O-N 2.89Å; L1025-K1028 PolarHBondContact O-N 3.48Å; L1025-K1028 VanDerWaalsContact O-N 3.14Å; K1028-C1030 PolarHBondContact O-N 2.91Å; K1028-S1031 PolarHBondContact O-N 3.28Å; K1028-S1031 VanDerWaalsContact O-N 3.16Å; K1028-S1031 PolarHBondContact O-OG 3.04Å; K1028-S1032 PolarHBondContact O-N 3.42Å; K1028-S1032 PolarHBondContact O-OG 3.43Å
1029	L	91.9	Very high	91.2	Very high	6 Å²	6	32.9 Å²	32.9	3%	0.031	19%	0.19	C	C	.	.	H	α-helix	trans	-58.9	-45.6	-174.4	-67.1	176.2	0	0	0	113.2	M1010 L1025 S1031 S1033 A1034 E1035 P1037 L1212	M1010-L1029 HydrophobicContact SD-CD2 4.04Å; L1025-L1029 HydrophobicContact CD1-CD1 3.92Å; L1025-L1029 HydrophobicContact CD1-CG 3.99Å; L1025-L1029 HydrophobicContact CD2-CD1 4.26Å; L1025-L1029 HydrophobicContact CG-CD1 3.74Å; L1025-L1029 HydrophobicContact CG-CG 4.21Å; L1025-L1029 WeakPolarHBondContact O-CG 3.3Å; L1025-L1029 PolarHBondContact O-N 3.45Å; L1029-S1031 VanDerWaalsContact C-N 3.3Å; L1029-S1031 PolarHBondContact O-N 3.26Å; L1029-S1033 PolarHBondContact O-N 3.14Å; L1029-S1033 VanDerWaalsContact O-N 3.13Å; L1029-S1033 PolarHBondContact O-OG 3.4Å; L1029-A1034 PolarHBondContact O-N 3.33Å; L1029-A1034 VanDerWaalsContact O-N 3.15Å; L1029-E1035 CarbonylContact C-O 3.52Å; L1029-E1035 HydrophobicContact CB-CB 4.12Å; L1029-E1035 PolarHBondContact O-N 3.19Å; L1029-P1037 HydrophobicContact CD1-CB 4.47Å; L1029-L1212 HydrophobicContact CD1-CD1 4.01Å; L1029-L1212 HydrophobicContact CD1-CD2 3.51Å; L1029-L1212 HydrophobicContact CD1-CG 4.45Å; L1029-L1212 HydrophobicContact CD2-CD1 4.24Å
1030	C	90.8	Very high	91.5	Very high	15 Å²	15	32.7 Å²	32.7	10%	0.101	19%	0.189	C	C	.	.	H	α-helix	trans	-66.3	-32.8	-179.6	-174.4	0	0	0	0	112.2	T590 F1026 K1028 E1035	T590-C1030 VanDerWaalsContact C-SG 3.6Å; T590-C1030 PolarHBondContact O-SG 3.45Å; F1026-C1030 HydrophobicContact CD1-CB 4.23Å; F1026-C1030 HydrophobicContact CE1-CB 4.48Å; F1026-C1030 WeakPolarHBondContact O-CB 3.36Å; F1026-C1030 PolarHBondContact O-N 3.31Å; K1028-C1030 PolarHBondContact O-N 2.91Å; C1030-E1035 PolarHBondContact N-O 3.18Å
1031	S	89.6	Confident	92	Very high	97 Å²	97	32.2 Å²	32.2	68%	0.678	18%	0.178	S	C	*	.	H	α-helix	trans	-85.9	-30.1	178.6	69.9	0	0	0	0	115.3	Q1027 K1028 L1029	Q1027-S1031 VanDerWaalsContact O-CB 3.29Å; Q1027-S1031 WeakPolarHBondContact O-CB 3.48Å; Q1027-S1031 PolarHBondContact O-N 3.06Å; Q1027-S1031 VanDerWaalsContact O-N 3.13Å; Q1027-S1031 PolarHBondContact O-OG 3.44Å; K1028-S1031 PolarHBondContact O-N 3.28Å; K1028-S1031 VanDerWaalsContact O-N 3.16Å; K1028-S1031 PolarHBondContact O-OG 3.04Å; L1029-S1031 VanDerWaalsContact C-N 3.3Å; L1029-S1031 PolarHBondContact O-N 3.26Å
1032	S	89.9	Confident	91.9	Very high	87 Å²	87	31.5 Å²	31.5	61%	0.608	17%	0.171	S	C	*	.	H	α-helix	trans	-92.2	-40	-175	60.7	0	0	0	0	113.8	K1028	K1028-S1032 PolarHBondContact O-N 3.42Å; K1028-S1032 PolarHBondContact O-OG 3.43Å
1033	S	86.7	Confident	91.6	Very high	51 Å²	51	33.9 Å²	33.9	36%	0.357	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-135.4	9.8	-170.5	48.4	0	0	0	0	113.3	L1029 E1035	L1029-S1033 PolarHBondContact O-N 3.14Å; L1029-S1033 VanDerWaalsContact O-N 3.13Å; L1029-S1033 PolarHBondContact O-OG 3.4Å; S1033-E1035 WeakPolarHBondContact CB-OE1 3.35Å; S1033-E1035 PolarHBondContact O-N 3.4Å; S1033-E1035 VanDerWaalsContact O-N 3.15Å; S1033-E1035 PolarHBondContact OG-OE1 2.9Å
1034	A	90.3	Very high	91.1	Very high	13 Å²	13	34.9 Å²	34.9	11%	0.107	19%	0.187	C	C	.	.			trans	55.5	24	-176.6	0	0	0	0	0	114.3	T590 N618 P621 L1029	T590-A1034 HydrophobicContact CG2-CB 3.83Å; N618-A1034 PolarHBondContact ND2-O 3.38Å; P621-A1034 HydrophobicContact CG-CB 4.42Å; L1029-A1034 PolarHBondContact O-N 3.33Å; L1029-A1034 VanDerWaalsContact O-N 3.15Å
1035	E	92.1	Very high	89.9	Confident	10 Å²	10	32.3 Å²	32.3	5%	0.047	19%	0.193	C	C	.	.			trans	-84.3	140	-179.2	-70.8	174.3	-106.9	0	0	111.5	L1029 C1030 S1033 L1212 R1214	L1029-E1035 CarbonylContact C-O 3.52Å; L1029-E1035 HydrophobicContact CB-CB 4.12Å; L1029-E1035 PolarHBondContact O-N 3.19Å; C1030-E1035 PolarHBondContact N-O 3.18Å; S1033-E1035 WeakPolarHBondContact CB-OE1 3.35Å; S1033-E1035 PolarHBondContact O-N 3.4Å; S1033-E1035 VanDerWaalsContact O-N 3.15Å; S1033-E1035 PolarHBondContact OG-OE1 2.9Å; E1035-L1212 WeakPolarHBondContact OE2-CD1 3.24Å; E1035-R1214 VanDerWaalsContact CD-CZ 3.49Å; E1035-R1214 HydrophobicContact CG-CG 4.44Å; E1035-R1214 IonicContact OE1-CZ 3.68Å; E1035-R1214 IonicContact OE1-NE 2.64Å; E1035-R1214 IonicContact OE1-NH2 3.17Å; E1035-R1214 PolarHBondContact OE1-NH2 3.32Å; E1035-R1214 IonicContact OE2-CZ 2.65Å; E1035-R1214 IonicContact OE2-NE 2.94Å; E1035-R1214 PolarHBondContact OE2-NE 3.04Å; E1035-R1214 IonicContact OE2-NH2 2.77Å; E1035-R1214 PolarHBondContact OE2-NH2 3.44Å
1036	I	93.6	Very high	88.3	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	122.3	178.2	-65.3	173.4	0	0	0	109.8	F589 C603 N618 F1026 L1212 I1213	F589-I1036 HydrophobicContact CD1-CD1 4.08Å; F589-I1036 HydrophobicContact CE1-CD1 3.27Å; F589-I1036 HydrophobicContact CZ-CD1 3.84Å; C603-I1036 VanDerWaalsContact SG-CG2 3.55Å; N618-I1036 HydrophobicContact CB-CD1 4.49Å; F1026-I1036 HydrophobicContact CE2-CG2 4.49Å; F1026-I1036 HydrophobicContact CZ-CG2 3.93Å; I1036-L1212 WeakPolarHBondContact O-CA 3.32Å; I1036-I1213 PolarHBondContact N-O 3.02Å; I1036-I1213 PolarHBondContact O-N 3.05Å
1037	P	94.1	Very high	86.1	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	133.4	175	33.8	-34.9	0	0	0	111.9	C603 Y1022 F1026 L1029 V1210 Y1211 L1212	C603-P1037 PolarHBondContact SG-O 2.91Å; C603-P1037 VanDerWaalsContact SG-O 3.41Å; Y1022-P1037 HydrophobicContact CE1-CG 4.48Å; Y1022-P1037 HydrophobicContact CE2-CB 3.99Å; Y1022-P1037 HydrophobicContact CE2-CG 4.28Å; Y1022-P1037 VanDerWaalsContact OH-C 3.29Å; Y1022-P1037 WeakPolarHBondContact OH-CB 3.2Å; Y1022-P1037 PolarHBondContact OH-O 3.15Å; F1026-P1037 HydrophobicContact CB-CG 4.2Å; F1026-P1037 HydrophobicContact CD2-CG 3.45Å; F1026-P1037 VanDerWaalsContact CD2-CG 3.45Å; F1026-P1037 HydrophobicContact CE2-CG 3.89Å; F1026-P1037 HydrophobicContact CG-CG 3.84Å; L1029-P1037 HydrophobicContact CD1-CB 4.47Å; P1037-V1210 HydrophobicContact CB-CG1 3.82Å; P1037-Y1211 CarbonylContact C-O 3.52Å; P1037-Y1211 WeakPolarHBondContact CA-O 3.39Å; P1037-L1212 HydrophobicContact CB-CD2 3.6Å
1038	I	91.3	Very high	83.8	Confident	6 Å²	6	42.5 Å²	42.5	3%	0.031	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-38.6	174.6	-50	-178.8	0	0	0	110.8	L526 I634 L995 L1007 N1197 Y1211 I1213	L526-I1038 HydrophobicContact CD1-CG2 4.14Å; I634-I1038 HydrophobicContact CD1-CG2 3.71Å; L995-I1038 HydrophobicContact CD2-CD1 4.35Å; L1007-I1038 HydrophobicContact CD1-CD1 3.59Å; I1038-N1197 WeakPolarHBondContact O-CA 3.36Å; I1038-N1197 PolarHBondContact O-N 2.92Å; I1038-Y1211 PolarHBondContact N-O 2.61Å; I1038-I1213 HydrophobicContact CD1-CD1 3.93Å; I1038-I1213 HydrophobicContact CD1-CG1 3.64Å; I1038-I1213 HydrophobicContact CG1-CD1 3.98Å; I1038-I1213 HydrophobicContact CG1-CG1 3.71Å
1039	G	92.6	Very high	80.9	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.7	-170.2	-173.1	0	0	0	0	0	112.6	Y1022 L1195 V1210 Y1211	Y1022-G1039 PolarHBondContact OH-N 2.82Å; G1039-L1195 CarbonylContact C-O 3.53Å; G1039-L1195 WeakPolarHBondContact CA-O 3.25Å; G1039-V1210 WeakPolarHBondContact O-CG1 3.42Å; G1039-Y1211 PolarHBondContact O-N 2.94Å
1040	I	94.3	Very high	77.7	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	142.5	-178.4	63.2	178.4	0	0	0	111.8	Y1022 V1194 L1195 L1204 I1209 V1210	Y1022-I1040 HydrophobicContact CD2-CG2 3.86Å; Y1022-I1040 HydrophobicContact CE2-CG2 3.86Å; I1040-V1194 CarbonylContact O-C 3.59Å; I1040-V1194 WeakPolarHBondContact O-CA 3.47Å; I1040-L1195 HydrophobicContact CD1-CD1 4.27Å; I1040-L1195 HydrophobicContact CG1-CB 3.94Å; I1040-L1195 HydrophobicContact CG1-CD1 4.34Å; I1040-L1195 PolarHBondContact N-O 3.25Å; I1040-L1195 PolarHBondContact O-N 3.19Å; I1040-L1204 HydrophobicContact CD1-CD2 4.48Å; I1040-L1204 HydrophobicContact CG2-CD2 4.15Å; I1040-I1209 CarbonylContact C-O 3.53Å; I1040-V1210 HydrophobicContact CG2-CB 4.46Å; I1040-V1210 HydrophobicContact CG2-CG1 4.16Å; I1040-V1210 HydrophobicContact CG2-CG2 4.01Å
1041	Y	95.1	Very high	74.8	Confident	20 Å²	20	57.4 Å²	57.4	8%	0.078	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	124.3	167.2	174	-93.9	0	0	0	108.3	P521 A522 A966 T1043 S1192 I1209	P521-Y1041 HydrophobicContact CB-CD1 4.27Å; P521-Y1041 HydrophobicContact CB-CE1 4.15Å; P521-Y1041 HydrophobicContact CG-CD1 3.83Å; P521-Y1041 HydrophobicContact CG-CE1 4.14Å; P521-Y1041 HydrophobicContact CG-CG 4.16Å; A522-Y1041 HydrophobicContact CB-CD2 3.69Å; A522-Y1041 HydrophobicContact CB-CE2 3.68Å; A966-Y1041 PolarHBondContact O-OH 2.93Å; Y1041-T1043 HydrophobicContact CD1-CG2 4.43Å; Y1041-T1043 HydrophobicContact CE1-CG2 3.74Å; Y1041-S1192 WeakPolarHBondContact OH-CB 3.46Å; Y1041-I1209 HydrophobicContact CD1-CB 4.39Å; Y1041-I1209 HydrophobicContact CD1-CD1 4.4Å; Y1041-I1209 PolarHBondContact N-O 3.4Å; Y1041-I1209 PolarHBondContact O-N 3.47Å
1042	R	91.3	Very high	71.8	Confident	21 Å²	21	60.1 Å²	60.1	8%	0.079	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	149	-173	178	171.4	-65.1	-162.4	-14.1	112.1	E1044 S1192 Y1193 R1203 E1205 D1208	R1042-E1044 WeakPolarHBondContact CD-OE1 3.47Å; R1042-E1044 HydrophobicContact CG-CG 3.64Å; R1042-E1044 IonicContact CZ-OE1 2.71Å; R1042-E1044 IonicContact NE-OE1 2.74Å; R1042-E1044 IonicContact NH1-OE1 2.87Å; R1042-E1044 PolarHBondContact NH1-OE1 2.91Å; R1042-S1192 WeakPolarHBondContact O-CA 3.41Å; R1042-S1192 WeakPolarHBondContact O-CB 3.49Å; R1042-Y1193 HydrophobicContact CB-CE2 4.47Å; R1042-Y1193 PolarHBondContact N-O 2.7Å; R1042-Y1193 PolarHBondContact O-N 3.08Å; R1042-R1203 PolarHBondContact NH2-O 3.32Å; R1042-E1205 IonicContact CZ-OE1 2.63Å; R1042-E1205 IonicContact CZ-OE2 2.6Å; R1042-E1205 IonicContact NE-OE2 3.34Å; R1042-E1205 IonicContact NH1-OE1 2.74Å; R1042-E1205 PolarHBondContact NH1-OE1 2.98Å; R1042-E1205 IonicContact NH1-OE2 3.07Å; R1042-E1205 PolarHBondContact NH1-OE2 3.32Å; R1042-E1205 VanDerWaalsContact NH2-CD 3.27Å; R1042-E1205 IonicContact NH2-OE1 2.86Å; R1042-E1205 PolarHBondContact NH2-OE1 3.38Å; R1042-E1205 IonicContact NH2-OE2 2.66Å; R1042-D1208 WeakPolarHBondContact CA-OD1 3.41Å; R1042-D1208 VanDerWaalsContact CB-OD1 3.25Å; R1042-D1208 WeakPolarHBondContact CB-OD1 3.32Å; R1042-D1208 WeakPolarHBondContact CG-OD1 3.2Å; R1042-D1208 IonicContact CZ-OD2 2.85Å; R1042-D1208 IonicContact NE-OD1 3.91Å; R1042-D1208 PolarHBondContact NE-OD1 3.02Å; R1042-D1208 IonicContact NE-OD2 2.75Å; R1042-D1208 IonicContact NH2-OD2 2.69Å; R1042-D1208 PolarHBondContact NH2-OD2 3.25Å
1043	T	87.3	Confident	68.8	Low	50 Å²	50	65 Å²	65	31%	0.307	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	93.7	171.6	61	0	0	0	0	111.6	Y1041 L1191	Y1041-T1043 HydrophobicContact CD1-CG2 4.43Å; Y1041-T1043 HydrophobicContact CE1-CG2 3.74Å; T1043-L1191 CarbonylContact C-O 3.57Å; T1043-L1191 WeakPolarHBondContact CA-O 3.29Å
1044	E	79.8	Confident	66.1	Low	35 Å²	35	69.2 Å²	69.2	16%	0.164	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	127.9	-178.5	-60.1	-172.1	156.2	0	0	111.6	R1042 H1046 T1190 L1191 Y1193	R1042-E1044 WeakPolarHBondContact CD-OE1 3.47Å; R1042-E1044 HydrophobicContact CG-CG 3.64Å; R1042-E1044 IonicContact CZ-OE1 2.71Å; R1042-E1044 IonicContact NE-OE1 2.74Å; R1042-E1044 IonicContact NH1-OE1 2.87Å; R1042-E1044 PolarHBondContact NH1-OE1 2.91Å; E1044-H1046 PolarHBondContact O-N 3.16Å; E1044-H1046 VanDerWaalsContact O-N 3.09Å; E1044-H1046 IonicContact OE2-NE2 3.97Å; E1044-T1190 CarbonylContact O-C 3.55Å; E1044-T1190 WeakPolarHBondContact O-CA 3.44Å; E1044-L1191 HydrophobicContact CB-CB 4.38Å; E1044-L1191 PolarHBondContact N-O 2.99Å; E1044-L1191 PolarHBondContact O-N 3.42Å; E1044-Y1193 HydrophobicContact CG-CE1 4.2Å; E1044-Y1193 PolarHBondContact OE1-OH 3.23Å
1045	S	68.4	Low	63	Low	100 Å²	100	74.4 Å²	74.4	70%	0.699	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	87.8	173.2	59.3	0	0	0	0	110.7	I1047	S1045-I1047 PolarHBondContact O-N 3.09Å
1046	H	58.8	Low	59.9	Low	70 Å²	70	82 Å²	82	32%	0.324	44%	0.437	S	S	.	.			trans	-78.4	112	-178.8	-110.9	-79.8	0	0	0	111.1	E1044 N1189	E1044-H1046 PolarHBondContact O-N 3.16Å; E1044-H1046 VanDerWaalsContact O-N 3.09Å; E1044-H1046 IonicContact OE2-NE2 3.97Å; H1046-N1189 PolarHBondContact N-O 3.21Å; H1046-N1189 PolarHBondContact O-ND2 3.26Å
1047	I	45.4	Very low	56.7	Low	137 Å²	137	87.8 Å²	87.8	70%	0.703	47%	0.473	S	S	*	.			trans	-80.6	125	166.1	-60.2	174.8	0	0	0	107.5	S1045 T1049	S1045-I1047 PolarHBondContact O-N 3.09Å; I1047-T1049 PolarHBondContact O-N 3.47Å; I1047-T1049 VanDerWaalsContact O-N 3.14Å
1048	F	44.5	Very low	53.5	Low	110 Å²	110	93.9 Å²	93.9	48%	0.482	51%	0.512	S	S	.	.			trans	-76.4	99	176.2	-69.5	-62.4	0	0	0	110.1	Y938 T1050 N1189	Y938-F1048 HydrophobicContact CG-CE1 4.45Å; F1048-T1050 VanDerWaalsContact C-N 3.28Å; F1048-T1050 PolarHBondContact O-N 3.29Å; F1048-N1189 WeakPolarHBondContact CD2-ND2 3.25Å; F1048-N1189 WeakPolarHBondContact CE2-ND2 3.41Å; F1048-N1189 WeakPolarHBondContact CE2-OD1 3.29Å
1049	T	30.8	Very low	50.3	Low	121 Å²	121	100 Å²	100	74%	0.742	55%	0.549	S	S	*	.			trans	-71.2	85	167.9	38.8	0	0	0	0	110.6	I1047 L1051	I1047-T1049 PolarHBondContact O-N 3.47Å; I1047-T1049 VanDerWaalsContact O-N 3.14Å; T1049-L1051 VanDerWaalsContact C-N 3.32Å; T1049-L1051 PolarHBondContact O-N 3.16Å
1050	T	26.1	Very low	47	Very low	122 Å²	122	107.9 Å²	107.9	75%	0.748	59%	0.588	S	S	*	*			trans	-62.8	95.5	160.7	46.1	0	0	0	0	108.7	F1048 E1052	F1048-T1050 VanDerWaalsContact C-N 3.28Å; F1048-T1050 PolarHBondContact O-N 3.29Å; T1050-E1052 VanDerWaalsContact C-N 3.28Å; T1050-E1052 PolarHBondContact O-N 3.09Å
1051	L	29.8	Very low	43.7	Very low	154 Å²	154	115.5 Å²	115.5	81%	0.806	63%	0.627	S	S	*	*			trans	-68.3	85.8	172.6	-81.6	161.8	0	0	0	109.9	T1049	T1049-L1051 VanDerWaalsContact C-N 3.32Å; T1049-L1051 PolarHBondContact O-N 3.16Å
1052	E	26.8	Very low	40.3	Very low	155 Å²	155	122.5 Å²	122.5	72%	0.724	66%	0.658	S	S	*	*			trans	-67.5	121.3	151.5	-67	-163	149.1	0	0	108.1	T1050 N1054	T1050-E1052 VanDerWaalsContact C-N 3.28Å; T1050-E1052 PolarHBondContact O-N 3.09Å; E1052-N1054 PolarHBondContact O-N 3.12Å
1053	E	26.9	Very low	37.1	Very low	189 Å²	189	126.9 Å²	126.9	88%	0.883	69%	0.692	S	S	*	*			trans	-73.8	69.6	-175.5	-65.5	-173.9	129.2	0	0	112.5	T1055	E1053-T1055 PolarHBondContact O-N 3.24Å
1054	N	28.3	Very low	34.1	Very low	140 Å²	140	133 Å²	133	75%	0.749	72%	0.717	S	S	*	*			trans	-94.4	58.2	176.9	-93.9	-50.2	0	0	0	112.7	E1052	E1052-N1054 PolarHBondContact O-N 3.12Å
1055	T	26.5	Very low	31.4	Very low	122 Å²	122	137.5 Å²	137.5	75%	0.748	75%	0.747	S	S	*	*			trans	-129.4	92.8	171.4	53.5	0	0	0	0	112.6	E1053 T1057	E1053-T1055 PolarHBondContact O-N 3.24Å; T1055-T1057 PolarHBondContact O-N 2.91Å
1056	N	26.9	Very low	29.2	Very low	168 Å²	168	138.4 Å²	138.4	90%	0.898	75%	0.753	S	S	*	*			trans	-69.8	87.9	165	-84.8	-44.4	0	0	0	110.9
1057	T	25.8	Very low	27.5	Very low	124 Å²	124	143.2 Å²	143.2	76%	0.761	78%	0.778	S	S	*	*			trans	-173.1	136.5	147.3	10.8	0	0	0	0	111.5	T1055	T1055-T1057 PolarHBondContact O-N 2.91Å
1058	P	26.7	Very low	26.4	Very low	127 Å²	127	141.4 Å²	141.4	83%	0.825	78%	0.778	S	S	*	*			trans	-89.8	123	-178.4	33.3	-32.4	0	0	0	112.6
1059	V	24.6	Very low	25.7	Very low	134 Å²	134	143 Å²	143	81%	0.812	80%	0.796	S	S	*	*			trans	-127.9	123.4	163.2	-179.9	0	0	0	0	108.5	I1061	V1059-I1061 PolarHBondContact O-N 3.29Å
1060	M	23.1	Very low	25.4	Very low	167 Å²	167	144 Å²	144	82%	0.823	80%	0.797	S	S	*	*			trans	-71.5	126.9	-178.4	-64.4	-173.4	-168.4	0	0	111.8
1061	I	25	Very low	25.4	Very low	160 Å²	160	145.9 Å²	145.9	82%	0.821	80%	0.802	S	S	*	*			trans	-123.8	115.6	148.1	-61.8	-178	0	0	0	107	V1059	V1059-I1061 PolarHBondContact O-N 3.29Å
1062	K	23	Very low	25.2	Very low	167 Å²	167	144.7 Å²	144.7	73%	0.726	81%	0.805	S	S	*	*			trans	-82.7	121.1	179.2	-71	178.5	176.5	178.2	0	110.5
1063	S	25.5	Very low	25.2	Very low	113 Å²	113	146 Å²	146	79%	0.79	81%	0.811	S	S	*	*			trans	-123.7	92.7	162.2	45.5	0	0	0	0	109.8	V1065	S1063-V1065 PolarHBondContact O-N 2.92Å
1064	Q	23.6	Very low	25.1	Very low	177 Å²	177	144.1 Å²	144.1	83%	0.827	81%	0.808	S	S	*	*			trans	-80.5	96.6	179.4	-67.5	174.5	-89.5	0	0	111.5
1065	V	23.8	Very low	25.1	Very low	131 Å²	131	143 Å²	143	79%	0.794	81%	0.806	S	S	*	*			trans	-141.3	88.7	148	-175.6	0	0	0	0	108.7	S1063 M1067	S1063-V1065 PolarHBondContact O-N 2.92Å; V1065-M1067 HydrophobicContact CG1-CG 4.47Å
1066	S	22	Very low	25.2	Very low	119 Å²	119	146 Å²	146	83%	0.832	81%	0.808	S	S	*	*			trans	-93.9	109.2	165.6	52.6	0	0	0	0	108.8
1067	M	21.9	Very low	25.2	Very low	170 Å²	170	144.9 Å²	144.9	84%	0.837	80%	0.802	S	S	*	*			trans	-89.6	124	163.5	-75.1	-165.9	69.2	0	0	108.9	V1065	V1065-M1067 HydrophobicContact CG1-CG 4.47Å
1068	S	21.9	Very low	25.2	Very low	100 Å²	100	151.1 Å²	151.1	70%	0.699	81%	0.812	S	S	*	*			trans	-66.7	149.3	173.7	43.9	0	0	0	0	111.3
1069	V	29.6	Very low	25.2	Very low	144 Å²	144	148.5 Å²	148.5	87%	0.873	81%	0.809	S	S	*	*			trans	-123.5	90.7	166.4	-179.1	0	0	0	0	106.4
1070	D	25.3	Very low	25.3	Very low	141 Å²	141	152 Å²	152	75%	0.754	82%	0.816	S	S	*	*			trans	-137.3	168.5	172.9	-78.3	-60.2	0	0	0	108.2
1071	D	25.8	Very low	25.4	Very low	161 Å²	161	152.4 Å²	152.4	86%	0.861	82%	0.816	S	S	*	*			trans	63.7	83.6	178.3	-64.4	-15.8	0	0	0	117.5
1072	C	25.6	Very low	26.2	Very low	129 Å²	129	149 Å²	149	87%	0.872	80%	0.804	S	S	*	*				-153.6	93.6	115.6	-162	0	0	0	0	110.8
1073	E	26.2	Very low	26.2	Very low	182 Å²	182	152 Å²	152	85%	0.85	81%	0.811	S	S	*	*			trans	-76.6	157.6	162	-65.9	-165.2	133.4	0	0	111
1074	D	25.1	Very low	26.2	Very low	151 Å²	151	151.5 Å²	151.5	81%	0.807	81%	0.807	S	S	*	*			trans	-153.6	83.5	150.4	-132.2	-6.8	0	0	0	113.1
1075	T	28.6	Very low	26.3	Very low	115 Å²	115	151 Å²	151	71%	0.706	81%	0.81	S	S	*	*			trans	51	102.9	149.9	65	0	0	0	0	123.6
1076	K	29.4	Very low	26.4	Very low	185 Å²	185	154.5 Å²	154.5	80%	0.804	82%	0.818	S	S	*	*				58.3	110.1	121	-80.2	178.6	172.6	164.6	0	124.5
1077	D	25.8	Very low	26.7	Very low	145 Å²	145	157.9 Å²	157.9	78%	0.775	82%	0.821	S	S	*	*				44.2	119.2	109.1	-56.2	-32.1	0	0	0	123.6
1078	R	27.5	Very low	26.9	Very low	255 Å²	255	155.6 Å²	155.6	96%	0.962	82%	0.821	S	S	*	*				179.7	134.1	114.5	-99.6	175	174.6	-166.6	-2.2	109.8
1079	G	25.6	Very low	27.1	Very low	73 Å²	73	158 Å²	158	75%	0.753	83%	0.827	S	S	*	*			cis	150.6	132.1	-10.4	0	0	0	0	0	111.6
1080	E	26.3	Very low	27	Very low	206 Å²	206	158.6 Å²	158.6	96%	0.963	82%	0.819	S	S	*	*			trans	-164.9	157.2	164.9	-118.6	169.6	-149	0	0	111.5
1081	E	25.4	Very low	27.3	Very low	177 Å²	177	157.7 Å²	157.7	83%	0.827	82%	0.821	S	S	*	*			trans	-136.8	173.1	-171.7	-119.3	-163.8	-140	0	0	109.5
1082	P	41.3	Very low	27.8	Very low	88 Å²	88	155.6 Å²	155.6	57%	0.571	81%	0.81	S	S	*	*			cis	-134.8	176	-18.9	28.7	-8.1	0	0	0	113.9
1083	R	24.7	Very low	28.5	Very low	229 Å²	229	156.7 Å²	156.7	86%	0.864	81%	0.806	S	S	*	*				168.7	134.3	116.6	-91.8	169	-177.7	-173.2	1.5	116.7
1084	S	24.6	Very low	28.9	Very low	103 Å²	103	159.3 Å²	159.3	72%	0.72	81%	0.808	S	S	*	*			trans	55.7	109.6	147.2	61.2	0	0	0	0	121.6
1085	N	26.6	Very low	29.5	Very low	167 Å²	167	159.5 Å²	159.5	89%	0.893	80%	0.802	S	S	*	*			trans	39.5	99.1	142.3	-62.9	11	0	0	0	119
1086	E	25.7	Very low	29.8	Very low	204 Å²	204	161.9 Å²	161.9	95%	0.953	80%	0.802	S	S	*	*			trans	-107.1	142.3	146.6	-72.5	-161.8	133.1	0	0	110.9
1087	Q	27.7	Very low	30.1	Very low	190 Å²	190	157.7 Å²	157.7	89%	0.888	80%	0.796	S	S	*	*			trans	-106.2	124.1	178.1	-165.9	168.9	5.3	0	0	107	D1089	Q1087-D1089 PolarHBondContact O-N 3.37Å
1088	S	25.4	Very low	30.7	Very low	122 Å²	122	155.6 Å²	155.6	85%	0.853	78%	0.783	S	S	*	*			trans	-63.9	105.9	-164.1	59.6	0	0	0	0	113.7
1089	D	26.6	Very low	31	Very low	151 Å²	151	149.4 Å²	149.4	81%	0.807	77%	0.765	S	S	*	*			trans	-94	144.1	-178.8	-147.6	-8.3	0	0	0	111.9	Q1087	Q1087-D1089 PolarHBondContact O-N 3.37Å
1090	H	28.1	Very low	31.3	Very low	156 Å²	156	155.9 Å²	155.9	72%	0.722	77%	0.767	S	S	*	*			trans	-83	138	-173.9	-71.5	-85.3	0	0	0	112.7	L1092	H1090-L1092 PolarHBondContact O-N 2.97Å
1091	P	32.2	Very low	31.6	Very low	122 Å²	122	148.8 Å²	148.8	79%	0.792	74%	0.743	S	S	*	*			trans	-72.4	81.6	174.6	26.6	-31.4	0	0	0	113.2	L1093	P1091-L1093 PolarHBondContact O-N 3.14Å; P1091-L1093 VanDerWaalsContact O-N 3.08Å
1092	L	35.8	Very low	32.4	Very low	118 Å²	118	149.6 Å²	149.6	62%	0.618	74%	0.739	S	S	*	*			trans	-76.4	84	179.3	-78.7	169.7	0	0	0	113.7	H1090	H1090-L1092 PolarHBondContact O-N 2.97Å
1093	L	39.2	Very low	32.2	Very low	151 Å²	151	154.2 Å²	154.2	79%	0.791	75%	0.745	S	S	*	*			trans	-111.8	36.2	179.7	-73	178.3	0	0	0	116.8	P1091	P1091-L1093 PolarHBondContact O-N 3.14Å; P1091-L1093 VanDerWaalsContact O-N 3.08Å
1094	R	36.2	Very low	32.7	Very low	237 Å²	237	150.1 Å²	150.1	89%	0.894	74%	0.739	S	S	*	*	S	Bend	trans	-138.3	28.7	159.2	-148.9	177.5	178.4	-173.7	-2	115.3
1095	K	37	Very low	33.5	Very low	156 Å²	156	150.2 Å²	150.2	68%	0.678	74%	0.74	S	S	*	*	S	Bend	trans	-123.8	9	179.5	-94.6	179.3	177.9	171.7	0	116.7
1096	K	35.1	Very low	34.2	Very low	165 Å²	165	151.3 Å²	151.3	72%	0.717	74%	0.737	S	S	*	*	S	Bend	trans	-88.2	-15.2	-176.7	-73.9	-175.7	176.7	175.8	0	116.2
1097	S	35.9	Very low	34.8	Very low	96 Å²	96	150.5 Å²	150.5	67%	0.671	73%	0.73	S	S	*	*	S	Bend	trans	-74.8	-41.8	178.3	52.9	0	0	0	0	114	Q1099 W1100	S1097-Q1099 PolarHBondContact O-N 3.39Å; S1097-Q1099 VanDerWaalsContact O-N 3.14Å; S1097-W1100 PolarHBondContact O-N 2.87Å
1098	M	37.4	Very low	34.9	Very low	102 Å²	102	147.2 Å²	147.2	50%	0.502	73%	0.728	S	S	.	*	H	α-helix	trans	-63.8	-21	-176.1	-71.7	-166.5	-178.3	0	0	114.7
1099	Q	35	Very low	35.4	Very low	124 Å²	124	147.1 Å²	147.1	58%	0.579	72%	0.722	S	S	*	*	H	α-helix	trans	-82.6	-22.7	-174.9	-65.4	-164.6	2.9	0	0	114.2	S1097 R1103	S1097-Q1099 PolarHBondContact O-N 3.39Å; S1097-Q1099 VanDerWaalsContact O-N 3.14Å; Q1099-R1103 WeakPolarHBondContact O-CG 3.3Å
1100	W	31.6	Very low	35.9	Very low	210 Å²	210	150.6 Å²	150.6	80%	0.795	72%	0.724	S	S	*	*	H	α-helix	trans	-74.5	-48.2	173.5	-96.3	43.4	0	0	0	111.6	S1097 R1102 R1103 L1104	S1097-W1100 PolarHBondContact O-N 2.87Å; W1100-R1102 VanDerWaalsContact C-N 3.31Å; W1100-R1102 PolarHBondContact O-N 3.45Å; W1100-R1103 PolarHBondContact O-N 3.35Å; W1100-L1104 PolarHBondContact O-N 3.5Å
1101	A	32.7	Very low	36	Very low	57 Å²	57	155.4 Å²	155.4	47%	0.471	74%	0.736	S	S	.	*	H	α-helix	trans	-56.8	-41.4	-179.9	0	0	0	0	0	112.8	R1103 L1104 S1105	A1101-R1103 PolarHBondContact O-N 3.29Å; A1101-L1104 PolarHBondContact O-N 3.09Å; A1101-S1105 PolarHBondContact O-N 3.03Å
1102	R	41.5	Very low	36.1	Very low	194 Å²	194	158.5 Å²	158.5	73%	0.732	74%	0.74	S	S	*	*	H	α-helix	trans	-66.6	-17.5	177.7	-72.3	-175.7	178.1	-171.1	0.6	114.4	W1100	W1100-R1102 VanDerWaalsContact C-N 3.31Å; W1100-R1102 PolarHBondContact O-N 3.45Å
1103	R	36.7	Very low	36	Very low	184 Å²	184	156.7 Å²	156.7	69%	0.694	75%	0.75	S	S	*	*	H	α-helix	trans	-86.9	-36.1	176.7	-68.5	-179.7	-172.8	-161.7	2.4	112.6	Q1099 W1100 A1101 S1105 K1106	Q1099-R1103 WeakPolarHBondContact O-CG 3.3Å; W1100-R1103 PolarHBondContact O-N 3.35Å; A1101-R1103 PolarHBondContact O-N 3.29Å; R1103-S1105 VanDerWaalsContact C-N 3.28Å; R1103-S1105 PolarHBondContact O-N 3.4Å; R1103-K1106 PolarHBondContact O-N 2.86Å
1104	L	36.5	Very low	35.9	Very low	144 Å²	144	153.3 Å²	153.3	75%	0.754	75%	0.752	S	S	*	*	H	α-helix	trans	-64.4	-33.1	174.4	-73.6	166.3	0	0	0	112.3	W1100 A1101 K1106 K1107	W1100-L1104 PolarHBondContact O-N 3.5Å; A1101-L1104 PolarHBondContact O-N 3.09Å; L1104-K1106 PolarHBondContact O-N 3.25Å; L1104-K1107 PolarHBondContact O-N 2.95Å
1105	S	40.4	Very low	36.2	Very low	105 Å²	105	147.5 Å²	147.5	73%	0.734	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-10.3	176.6	-172	0	0	0	0	115.3	A1101 R1103	A1101-S1105 PolarHBondContact O-N 3.03Å; R1103-S1105 VanDerWaalsContact C-N 3.28Å; R1103-S1105 PolarHBondContact O-N 3.4Å
1106	K	40.7	Very low	36.4	Very low	190 Å²	190	149.8 Å²	149.8	83%	0.826	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	14.6	-177.2	-74.3	-164.5	172.6	-171.4	0	115.5	R1103 L1104	R1103-K1106 PolarHBondContact O-N 2.86Å; L1104-K1106 PolarHBondContact O-N 3.25Å
1107	K	39.1	Very low	37	Very low	186 Å²	186	147.6 Å²	147.6	81%	0.809	75%	0.748	S	S	*	*			trans	-139.1	61	-175.5	-150.4	179.7	-176.1	-176.1	0	116.4	L1104	L1104-K1107 PolarHBondContact O-N 2.95Å
1108	S	30.1	Very low	37.5	Very low	121 Å²	121	147.8 Å²	147.8	85%	0.846	75%	0.749	S	S	*	*			trans	-130.4	110.4	152.2	59.8	0	0	0	0	109.3
1109	V	36.1	Very low	38	Very low	120 Å²	120	146.5 Å²	146.5	73%	0.727	75%	0.75	S	S	*	*			trans	-91.2	147.9	-173.5	171.2	0	0	0	0	111
1110	R	37	Very low	38.7	Very low	224 Å²	224	147.1 Å²	147.1	85%	0.845	75%	0.75	S	S	*	*			trans	-0.3	116.9	165.4	-62.2	174.1	177.7	164.7	-2.2	116.4
1111	W	29.9	Very low	39.7	Very low	258 Å²	258	141.2 Å²	141.2	98%	0.977	74%	0.735	S	S	*	*			trans	-118.2	144.1	142	-80.4	85.6	0	0	0	108.6
1112	Q	33.7	Very low	40.6	Very low	186 Å²	186	144.2 Å²	144.2	87%	0.869	74%	0.739	S	S	*	*			trans	-133.5	125.9	-165.3	179.6	177	-6.1	0	0	110.1
1113	G	33.5	Very low	41.2	Very low	81 Å²	81	137.7 Å²	137.7	84%	0.835	73%	0.727	S	S	*	*			trans	108.8	143.6	173.4	0	0	0	0	0	115
1114	G	37.3	Very low	42.1	Very low	80 Å²	80	135.2 Å²	135.2	83%	0.825	72%	0.723	S	S	*	*			trans	95.1	89.3	163.9	0	0	0	0	0	117.5
1115	S	43.3	Very low	43.1	Very low	114 Å²	114	135.3 Å²	135.3	80%	0.797	71%	0.713	S	S	*	*			trans	23.5	112.7	149.8	-168.1	0	0	0	0	120.4
1116	R	41.2	Very low	44.4	Very low	205 Å²	205	133.2 Å²	133.2	77%	0.774	69%	0.693	S	S	*	*			trans	171.5	101.3	142.5	-100.9	164.4	163.8	-178.6	-5.7	112	S1118 S1119	R1116-S1118 VanDerWaalsContact C-N 3.3Å; R1116-S1118 PolarHBondContact O-N 3.45Å; R1116-S1119 VanDerWaalsContact O-CB 3.29Å; R1116-S1119 WeakPolarHBondContact O-CB 3.11Å; R1116-S1119 PolarHBondContact O-N 3.25Å
1117	D	46.6	Very low	45.7	Very low	119 Å²	119	126.9 Å²	126.9	64%	0.636	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-25.9	175.4	-73.3	-63.4	0	0	0	113.8	S1119 K1120	D1117-S1119 PolarHBondContact O-N 2.88Å; D1117-K1120 PolarHBondContact O-N 3.39Å; D1117-K1120 VanDerWaalsContact O-N 3.16Å; D1117-K1120 IonicContact OD1-NZ 2.83Å; D1117-K1120 PolarHBondContact OD1-NZ 3.04Å
1118	S	47	Very low	47	Very low	100 Å²	100	123.4 Å²	123.4	70%	0.699	66%	0.663	S	S	*	*	H	α-helix	trans	-52.1	-25.2	168.4	173.9	0	0	0	0	113.8	R1116 H1122	R1116-S1118 VanDerWaalsContact C-N 3.3Å; R1116-S1118 PolarHBondContact O-N 3.45Å; S1118-H1122 PolarHBondContact O-N 3.42Å
1119	S	48.3	Very low	48.7	Very low	74 Å²	74	123.5 Å²	123.5	52%	0.517	65%	0.65	S	S	.	*	H	α-helix	trans	-72.7	-34.3	-179.2	-167.3	0	0	0	0	113.6	R1116 D1117 H1122 A1123	R1116-S1119 VanDerWaalsContact O-CB 3.29Å; R1116-S1119 WeakPolarHBondContact O-CB 3.11Å; R1116-S1119 PolarHBondContact O-N 3.25Å; D1117-S1119 PolarHBondContact O-N 2.88Å; S1119-H1122 PolarHBondContact O-N 2.89Å; S1119-A1123 WeakPolarHBondContact O-CB 3.28Å; S1119-A1123 PolarHBondContact O-N 3.46Å
1120	K	50.3	Low	50.4	Low	137 Å²	137	126.5 Å²	126.5	60%	0.596	65%	0.648	S	S	*	*	H	α-helix	trans	-67.5	-48.4	-177	-68.4	172.3	-173.7	149.8	0	111.2	D1117 H1122 A1123 Q1124	D1117-K1120 PolarHBondContact O-N 3.39Å; D1117-K1120 VanDerWaalsContact O-N 3.16Å; D1117-K1120 IonicContact OD1-NZ 2.83Å; D1117-K1120 PolarHBondContact OD1-NZ 3.04Å; K1120-H1122 VanDerWaalsContact C-N 3.28Å; K1120-H1122 PolarHBondContact O-N 2.89Å; K1120-A1123 PolarHBondContact O-N 3.42Å; K1120-Q1124 VanDerWaalsContact O-CB 3.31Å; K1120-Q1124 WeakPolarHBondContact O-CB 3.36Å; K1120-Q1124 PolarHBondContact O-N 2.93Å
1121	D	51.7	Low	52	Low	86 Å²	86	120.4 Å²	120.4	46%	0.46	63%	0.632	S	S	.	*	H	α-helix	trans	-54.5	-44.3	174.3	-106.8	48.1	0	0	0	112	Q1124 R1125	D1121-Q1124 PolarHBondContact O-N 3.09Å; D1121-R1125 WeakPolarHBondContact O-CB 3.41Å; D1121-R1125 WeakPolarHBondContact O-CG 3.49Å; D1121-R1125 PolarHBondContact O-N 3.5Å; D1121-R1125 IonicContact OD2-CZ 2.83Å; D1121-R1125 IonicContact OD2-NE 3.43Å; D1121-R1125 IonicContact OD2-NH2 3.13Å; D1121-R1125 PolarHBondContact OD2-NH2 3.37Å
1122	H	51	Low	54	Low	120 Å²	120	112.1 Å²	112.1	56%	0.556	61%	0.607	S	S	*	*	H	α-helix	trans	-69	-43.8	-179.5	-157.6	66.2	0	0	0	111.7	S1118 S1119 K1120 Q1124 R1125 I1126	S1118-H1122 PolarHBondContact O-N 3.42Å; S1119-H1122 PolarHBondContact O-N 2.89Å; K1120-H1122 VanDerWaalsContact C-N 3.28Å; K1120-H1122 PolarHBondContact O-N 2.89Å; H1122-Q1124 VanDerWaalsContact C-N 3.34Å; H1122-Q1124 PolarHBondContact O-N 3.19Å; H1122-R1125 PolarHBondContact O-N 3.41Å; H1122-I1126 WeakPolarHBondContact O-CB 3.34Å; H1122-I1126 WeakPolarHBondContact O-CD1 3.37Å; H1122-I1126 VanDerWaalsContact O-CG1 3.25Å; H1122-I1126 WeakPolarHBondContact O-CG1 3.3Å; H1122-I1126 PolarHBondContact O-N 3.07Å
1123	A	53.9	Low	55.7	Low	58 Å²	58	107.8 Å²	107.8	48%	0.479	59%	0.589	S	S	.	*	H	α-helix	trans	-62.5	-38.5	174.3	0	0	0	0	0	112.5	S1119 K1120 I1126 A1127	S1119-A1123 WeakPolarHBondContact O-CB 3.28Å; S1119-A1123 PolarHBondContact O-N 3.46Å; K1120-A1123 PolarHBondContact O-N 3.42Å; A1123-I1126 PolarHBondContact O-N 3.12Å; A1123-A1127 WeakPolarHBondContact O-CB 3.42Å; A1123-A1127 PolarHBondContact O-N 3.07Å
1124	Q	57.7	Low	57.4	Low	131 Å²	131	111.5 Å²	111.5	61%	0.612	58%	0.579	S	S	*	*	H	α-helix	trans	-70.6	-41.2	177.6	-172.5	164	-28.3	0	0	111.8	K1120 D1121 H1122 A1127 Q1128	K1120-Q1124 VanDerWaalsContact O-CB 3.31Å; K1120-Q1124 WeakPolarHBondContact O-CB 3.36Å; K1120-Q1124 PolarHBondContact O-N 2.93Å; D1121-Q1124 PolarHBondContact O-N 3.09Å; H1122-Q1124 VanDerWaalsContact C-N 3.34Å; H1122-Q1124 PolarHBondContact O-N 3.19Å; Q1124-A1127 PolarHBondContact O-N 3.1Å; Q1124-Q1128 VanDerWaalsContact O-CB 3.31Å; Q1124-Q1128 WeakPolarHBondContact O-CB 3.22Å; Q1124-Q1128 PolarHBondContact O-N 3.17Å
1125	R	56.5	Low	59.2	Low	147 Å²	147	116.9 Å²	116.9	56%	0.555	57%	0.574	S	S	*	*	H	α-helix	trans	-60.6	-43.2	170.7	-71.2	172.1	-151	-166.8	7.3	111.7	D1121 H1122 Q1128 Q1129	D1121-R1125 WeakPolarHBondContact O-CB 3.41Å; D1121-R1125 WeakPolarHBondContact O-CG 3.49Å; D1121-R1125 PolarHBondContact O-N 3.5Å; D1121-R1125 IonicContact OD2-CZ 2.83Å; D1121-R1125 IonicContact OD2-NE 3.43Å; D1121-R1125 IonicContact OD2-NH2 3.13Å; D1121-R1125 PolarHBondContact OD2-NH2 3.37Å; H1122-R1125 PolarHBondContact O-N 3.41Å; R1125-Q1128 PolarHBondContact O-N 3.16Å; R1125-Q1129 WeakPolarHBondContact O-CB 3.48Å; R1125-Q1129 WeakPolarHBondContact O-CG 3.47Å; R1125-Q1129 PolarHBondContact O-N 3.1Å
1126	I	67.6	Low	60.7	Low	60 Å²	60	115 Å²	115	31%	0.308	55%	0.55	S	S	.	.	H	α-helix	trans	-63.4	-41.6	175.7	-70.8	164	0	0	0	111.3	H1122 A1123 R1130	H1122-I1126 WeakPolarHBondContact O-CB 3.34Å; H1122-I1126 WeakPolarHBondContact O-CD1 3.37Å; H1122-I1126 VanDerWaalsContact O-CG1 3.25Å; H1122-I1126 WeakPolarHBondContact O-CG1 3.3Å; H1122-I1126 PolarHBondContact O-N 3.07Å; A1123-I1126 PolarHBondContact O-N 3.12Å; I1126-R1130 WeakPolarHBondContact O-CB 3.32Å; I1126-R1130 VanDerWaalsContact O-CG 3.29Å; I1126-R1130 WeakPolarHBondContact O-CG 3.49Å; I1126-R1130 PolarHBondContact O-N 2.71Å
1127	A	67.3	Low	62.6	Low	58 Å²	58	108 Å²	108	48%	0.479	53%	0.532	S	S	.	.	H	α-helix	trans	-64.3	-43.1	176	0	0	0	0	0	111.8	A1123 Q1124 R1130 L1131	A1123-A1127 WeakPolarHBondContact O-CB 3.42Å; A1123-A1127 PolarHBondContact O-N 3.07Å; Q1124-A1127 PolarHBondContact O-N 3.1Å; A1127-R1130 PolarHBondContact O-N 2.9Å; A1127-L1131 WeakPolarHBondContact O-CB 3.25Å; A1127-L1131 PolarHBondContact O-N 3.03Å
1128	Q	67.6	Low	64.1	Low	113 Å²	113	109.4 Å²	109.4	53%	0.528	54%	0.535	S	S	.	.	H	α-helix	trans	-69.9	-40.9	179.2	-166.8	169	2.1	0	0	112	Q1124 R1125 L1131 N1132	Q1124-Q1128 VanDerWaalsContact O-CB 3.31Å; Q1124-Q1128 WeakPolarHBondContact O-CB 3.22Å; Q1124-Q1128 PolarHBondContact O-N 3.17Å; R1125-Q1128 PolarHBondContact O-N 3.16Å; Q1128-L1131 PolarHBondContact O-N 3.2Å; Q1128-N1132 WeakPolarHBondContact O-CB 3.41Å; Q1128-N1132 PolarHBondContact O-N 3.14Å; Q1128-N1132 PolarHBondContact O-OD1 3.06Å
1129	Q	65.9	Low	65.5	Low	123 Å²	123	109.2 Å²	109.2	58%	0.575	52%	0.519	S	S	*	.	H	α-helix	trans	-59.2	-46.3	170.7	-78.6	178	-41.2	0	0	111.6	R1125 L1131 N1132 L1133	R1125-Q1129 WeakPolarHBondContact O-CB 3.48Å; R1125-Q1129 WeakPolarHBondContact O-CG 3.47Å; R1125-Q1129 PolarHBondContact O-N 3.1Å; Q1129-L1131 VanDerWaalsContact C-N 3.32Å; Q1129-L1131 PolarHBondContact O-N 3.46Å; Q1129-N1132 PolarHBondContact O-N 2.81Å; Q1129-L1133 WeakPolarHBondContact O-CB 3.36Å; Q1129-L1133 VanDerWaalsContact O-CG 3.28Å; Q1129-L1133 WeakPolarHBondContact O-CG 3.42Å; Q1129-L1133 PolarHBondContact O-N 3Å
1130	R	71.6	Confident	67	Low	182 Å²	182	110.2 Å²	110.2	69%	0.687	52%	0.515	S	S	*	.	H	α-helix	trans	-63.2	-36.6	175.9	-75	175.2	177.3	-172.1	-0.6	112.6	I1126 A1127 Y1134	I1126-R1130 WeakPolarHBondContact O-CB 3.32Å; I1126-R1130 VanDerWaalsContact O-CG 3.29Å; I1126-R1130 WeakPolarHBondContact O-CG 3.49Å; I1126-R1130 PolarHBondContact O-N 2.71Å; A1127-R1130 PolarHBondContact O-N 2.9Å; R1130-Y1134 WeakPolarHBondContact O-CB 3.41Å; R1130-Y1134 PolarHBondContact O-N 3.05Å; R1130-Y1134 VanDerWaalsContact O-N 3.07Å
1131	L	70.9	Confident	68.6	Low	97 Å²	97	108.7 Å²	108.7	51%	0.508	51%	0.51	S	S	.	.	H	α-helix	trans	-69.9	-38.7	176.6	-151	82.7	0	0	0	112	A1127 Q1128 Q1129 R1135	A1127-L1131 WeakPolarHBondContact O-CB 3.25Å; A1127-L1131 PolarHBondContact O-N 3.03Å; Q1128-L1131 PolarHBondContact O-N 3.2Å; Q1129-L1131 VanDerWaalsContact C-N 3.32Å; Q1129-L1131 PolarHBondContact O-N 3.46Å; L1131-R1135 WeakPolarHBondContact O-CB 3.41Å; L1131-R1135 WeakPolarHBondContact O-CG 3.39Å; L1131-R1135 PolarHBondContact O-N 3.42Å; L1131-R1135 VanDerWaalsContact O-N 3.11Å
1132	N	70.6	Confident	70.2	Confident	83 Å²	83	106.9 Å²	106.9	44%	0.444	50%	0.501	S	S	.	.	H	α-helix	trans	-67.3	-48.7	176.4	-70.3	4.1	0	0	0	110.9	Q1128 Q1129 Y1134 R1135 R1136	Q1128-N1132 WeakPolarHBondContact O-CB 3.41Å; Q1128-N1132 PolarHBondContact O-N 3.14Å; Q1128-N1132 PolarHBondContact O-OD1 3.06Å; Q1129-N1132 PolarHBondContact O-N 2.81Å; N1132-Y1134 VanDerWaalsContact C-N 3.28Å; N1132-Y1134 PolarHBondContact O-N 2.9Å; N1132-R1135 PolarHBondContact O-N 3.14Å; N1132-R1136 PolarHBondContact O-N 2.91Å
1133	L	71.1	Confident	71.8	Confident	96 Å²	96	102.1 Å²	102.1	50%	0.503	48%	0.481	S	S	.	.	H	α-helix	trans	-57.2	-39.7	175.3	-72	167.4	0	0	0	112	Q1129 R1135	Q1129-L1133 WeakPolarHBondContact O-CB 3.36Å; Q1129-L1133 VanDerWaalsContact O-CG 3.28Å; Q1129-L1133 WeakPolarHBondContact O-CG 3.42Å; Q1129-L1133 PolarHBondContact O-N 3Å; L1133-R1135 VanDerWaalsContact C-N 3.3Å; L1133-R1135 PolarHBondContact O-N 3.42Å
1134	Y	69.1	Low	73.3	Confident	159 Å²	159	102.3 Å²	102.3	62%	0.624	47%	0.472	S	S	*	.	H	α-helix	trans	-75.2	-14.7	176.4	-174.2	-93.8	0	0	0	114.2	R1130 N1132	R1130-Y1134 WeakPolarHBondContact O-CB 3.41Å; R1130-Y1134 PolarHBondContact O-N 3.05Å; R1130-Y1134 VanDerWaalsContact O-N 3.07Å; N1132-Y1134 VanDerWaalsContact C-N 3.28Å; N1132-Y1134 PolarHBondContact O-N 2.9Å
1135	R	73.4	Confident	74.8	Confident	193 Å²	193	100.1 Å²	100.1	73%	0.728	46%	0.464	S	S	*	.	H	α-helix	trans	-96.8	-11.1	-180	-85.7	-176.6	170.7	-164.3	-2.7	114.4	L1131 N1132 L1133	L1131-R1135 WeakPolarHBondContact O-CB 3.41Å; L1131-R1135 WeakPolarHBondContact O-CG 3.39Å; L1131-R1135 PolarHBondContact O-N 3.42Å; L1131-R1135 VanDerWaalsContact O-N 3.11Å; N1132-R1135 PolarHBondContact O-N 3.14Å; L1133-R1135 VanDerWaalsContact C-N 3.3Å; L1133-R1135 PolarHBondContact O-N 3.42Å
1136	R	75.1	Confident	76.2	Confident	74 Å²	74	93.1 Å²	93.1	28%	0.279	44%	0.437	S	S	.	.			trans	-63.3	141.6	-176.5	-79.1	177.8	-174.1	179.8	-2	112.3	N1132 E1140 E1141 E1144	N1132-R1136 PolarHBondContact O-N 2.91Å; R1136-E1140 WeakPolarHBondContact CA-OE2 3.33Å; R1136-E1140 HydrophobicContact CB-CB 4.18Å; R1136-E1140 HydrophobicContact CG-CB 4Å; R1136-E1141 HydrophobicContact CB-CG 3.88Å; R1136-E1144 IonicContact CZ-OE1 3.15Å; R1136-E1144 IonicContact CZ-OE2 3.94Å; R1136-E1144 IonicContact NH1-OE1 2.74Å; R1136-E1144 IonicContact NH1-OE2 3.39Å; R1136-E1144 PolarHBondContact NH1-OE2 2.85Å; R1136-E1144 IonicContact NH2-OE1 2.73Å; R1136-E1144 PolarHBondContact NH2-OE1 3.35Å; R1136-E1144 IonicContact NH2-OE2 3.69Å; R1136-E1144 PolarHBondContact NH2-OE2 3.33Å
1137	S	81.9	Confident	77.1	Confident	57 Å²	57	92.6 Å²	92.6	40%	0.399	43%	0.431	S	S	.	.			trans	-72.7	154.7	158.2	61.8	0	0	0	0	110.7	R1139 E1140 E1141	S1137-R1139 PolarHBondContact O-N 2.97Å; S1137-R1139 VanDerWaalsContact O-N 3.08Å; S1137-E1140 PolarHBondContact N-OE2 3.34Å; S1137-E1140 PolarHBondContact O-N 2.85Å; S1137-E1140 WeakPolarHBondContact OG-CG 3.24Å; S1137-E1140 PolarHBondContact OG-N 3.39Å; S1137-E1140 PolarHBondContact OG-OE2 3.42Å; S1137-E1141 PolarHBondContact O-N 2.97Å; S1137-E1141 VanDerWaalsContact O-N 3.13Å
1138	E	77.3	Confident	78.2	Confident	149 Å²	149	93.7 Å²	93.7	70%	0.696	43%	0.429	S	S	*	.	H	α-helix	trans	-54.4	-30.3	173.9	-61.7	179.6	-178.3	0	0	111.6	E1141 L1142	E1138-E1141 PolarHBondContact O-N 3.37Å; E1138-L1142 VanDerWaalsContact O-CG 3.25Å; E1138-L1142 WeakPolarHBondContact O-CG 3.27Å; E1138-L1142 PolarHBondContact O-N 2.92Å
1139	R	77.5	Confident	79.2	Confident	96 Å²	96	92.6 Å²	92.6	36%	0.362	42%	0.42	S	S	.	.	H	α-helix	trans	-75.2	-33.4	178.3	-171.2	156.3	-179.9	66.3	10.4	113.6	R910 S1137 S1143	R910-R1139 PolarHBondContact O-NH1 3.1Å; S1137-R1139 PolarHBondContact O-N 2.97Å; S1137-R1139 VanDerWaalsContact O-N 3.08Å; R1139-S1143 PolarHBondContact O-N 3.28Å; R1139-S1143 PolarHBondContact O-OG 3.48Å
1140	E	79.1	Confident	80.2	Confident	96 Å²	96	86.9 Å²	86.9	45%	0.449	39%	0.394	S	S	.	.	H	α-helix	trans	-68	-38.8	170	-74.2	164.3	120.6	0	0	111.4	R1136 S1137 S1143 E1144	R1136-E1140 WeakPolarHBondContact CA-OE2 3.33Å; R1136-E1140 HydrophobicContact CB-CB 4.18Å; R1136-E1140 HydrophobicContact CG-CB 4Å; S1137-E1140 PolarHBondContact N-OE2 3.34Å; S1137-E1140 PolarHBondContact O-N 2.85Å; S1137-E1140 WeakPolarHBondContact OG-CG 3.24Å; S1137-E1140 PolarHBondContact OG-N 3.39Å; S1137-E1140 PolarHBondContact OG-OE2 3.42Å; E1140-S1143 WeakPolarHBondContact CA-OG 3.44Å; E1140-S1143 PolarHBondContact O-N 2.88Å; E1140-S1143 PolarHBondContact O-OG 3.33Å; E1140-E1144 PolarHBondContact O-N 2.83Å; E1140-E1144 VanDerWaalsContact O-N 3.09Å
1141	E	84.8	Confident	80.9	Confident	105 Å²	105	85.4 Å²	85.4	49%	0.491	39%	0.388	S	S	.	.	H	α-helix	trans	-62.9	-45.1	174.5	-62.7	-167	142.2	0	0	112.1	R1136 S1137 E1138 E1144 L1145	R1136-E1141 HydrophobicContact CB-CG 3.88Å; S1137-E1141 PolarHBondContact O-N 2.97Å; S1137-E1141 VanDerWaalsContact O-N 3.13Å; E1138-E1141 PolarHBondContact O-N 3.37Å; E1141-E1144 PolarHBondContact O-N 3.44Å; E1141-L1145 WeakPolarHBondContact O-CB 3.47Å; E1141-L1145 PolarHBondContact O-N 3.36Å
1142	L	85.1	Confident	81.8	Confident	48 Å²	48	87.5 Å²	87.5	25%	0.251	40%	0.395	S	S	.	.	H	α-helix	trans	-63.1	-42.8	177	-71.4	167.9	0	0	0	112.7	R910 L911 E1138 L1145 V1146	R910-L1142 HydrophobicContact CB-CD1 3.97Å; L911-L1142 HydrophobicContact CD2-CB 4.35Å; L911-L1142 HydrophobicContact CD2-CD2 3.72Å; L911-L1142 HydrophobicContact CG-CD2 4.31Å; E1138-L1142 VanDerWaalsContact O-CG 3.25Å; E1138-L1142 WeakPolarHBondContact O-CG 3.27Å; E1138-L1142 PolarHBondContact O-N 2.92Å; L1142-L1145 WeakPolarHBondContact O-CB 3.46Å; L1142-L1145 PolarHBondContact O-N 3.49Å; L1142-V1146 PolarHBondContact O-N 2.99Å; L1142-V1146 VanDerWaalsContact O-N 3.14Å
1143	S	83.8	Confident	82.5	Confident	20 Å²	20	85.7 Å²	85.7	14%	0.14	39%	0.385	C	S	.	.	H	α-helix	trans	-66.4	-36.5	178	60.3	0	0	0	0	112.9	R1139 E1140 R1147 Y1160	R1139-S1143 PolarHBondContact O-N 3.28Å; R1139-S1143 PolarHBondContact O-OG 3.48Å; E1140-S1143 WeakPolarHBondContact CA-OG 3.44Å; E1140-S1143 PolarHBondContact O-N 2.88Å; E1140-S1143 PolarHBondContact O-OG 3.33Å; S1143-R1147 WeakPolarHBondContact O-CB 3.47Å; S1143-R1147 PolarHBondContact O-N 3.49Å; S1143-Y1160 WeakPolarHBondContact CA-OH 3.49Å; S1143-Y1160 WeakPolarHBondContact CB-OH 3.47Å
1144	E	84.8	Confident	83	Confident	62 Å²	62	84.2 Å²	84.2	29%	0.29	39%	0.392	S	S	.	.	H	α-helix	trans	-74.7	-29.9	172.8	-83.5	-167.3	-155.6	0	0	113.9	R1136 E1140 E1141 R1147 N1148	R1136-E1144 IonicContact CZ-OE1 3.15Å; R1136-E1144 IonicContact CZ-OE2 3.94Å; R1136-E1144 IonicContact NH1-OE1 2.74Å; R1136-E1144 IonicContact NH1-OE2 3.39Å; R1136-E1144 PolarHBondContact NH1-OE2 2.85Å; R1136-E1144 IonicContact NH2-OE1 2.73Å; R1136-E1144 PolarHBondContact NH2-OE1 3.35Å; R1136-E1144 IonicContact NH2-OE2 3.69Å; R1136-E1144 PolarHBondContact NH2-OE2 3.33Å; E1140-E1144 PolarHBondContact O-N 2.83Å; E1140-E1144 VanDerWaalsContact O-N 3.09Å; E1141-E1144 PolarHBondContact O-N 3.44Å; E1144-R1147 PolarHBondContact O-N 3.05Å; E1144-N1148 VanDerWaalsContact O-CB 3.25Å; E1144-N1148 WeakPolarHBondContact O-CB 3.39Å; E1144-N1148 PolarHBondContact O-N 3.18Å; E1144-N1148 PolarHBondContact O-ND2 3.07Å
1145	L	89.1	Confident	83.6	Confident	84 Å²	84	77.1 Å²	77.1	44%	0.44	37%	0.365	S	S	.	.	H	α-helix	trans	-57.8	-50.7	170.7	178.5	63.1	0	0	0	110.4	L866 E1141 L1142 N1148 R1149	L866-L1145 HydrophobicContact CD2-CD2 4.38Å; L866-L1145 HydrophobicContact CD2-CG 4.26Å; E1141-L1145 WeakPolarHBondContact O-CB 3.47Å; E1141-L1145 PolarHBondContact O-N 3.36Å; L1142-L1145 WeakPolarHBondContact O-CB 3.46Å; L1142-L1145 PolarHBondContact O-N 3.49Å; L1145-N1148 PolarHBondContact O-N 3.08Å; L1145-R1149 WeakPolarHBondContact O-CG 3.49Å; L1145-R1149 PolarHBondContact O-N 3.39Å
1146	V	87.3	Confident	84	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-60.3	-51.8	175.4	174.4	0	0	0	0	110.9	L870 I875 L911 F912 L1142 N1148 R1149 M1150 Y1160	L870-V1146 HydrophobicContact CD2-CG1 4.21Å; I875-V1146 HydrophobicContact CD1-CG1 4.31Å; L911-V1146 HydrophobicContact CD2-CG2 3.85Å; F912-V1146 HydrophobicContact CE1-CG1 4.21Å; F912-V1146 HydrophobicContact CE1-CG2 4.16Å; F912-V1146 HydrophobicContact CZ-CG1 4.49Å; F912-V1146 HydrophobicContact CZ-CG2 4.07Å; L1142-V1146 PolarHBondContact O-N 2.99Å; L1142-V1146 VanDerWaalsContact O-N 3.14Å; V1146-N1148 VanDerWaalsContact C-N 3.27Å; V1146-N1148 PolarHBondContact O-N 3.07Å; V1146-R1149 PolarHBondContact O-N 3.43Å; V1146-R1149 VanDerWaalsContact O-N 3.13Å; V1146-M1150 HydrophobicContact CG1-CG 4.31Å; V1146-M1150 HydrophobicContact CG1-SD 4.23Å; V1146-M1150 WeakPolarHBondContact O-CG 3.41Å; V1146-M1150 PolarHBondContact O-N 2.88Å; V1146-Y1160 HydrophobicContact CB-CE2 4.24Å; V1146-Y1160 HydrophobicContact CG1-CD2 3.88Å; V1146-Y1160 HydrophobicContact CG1-CE2 3.83Å
1147	R	85.7	Confident	84	Confident	50 Å²	50	69.4 Å²	69.4	19%	0.189	35%	0.349	C	S	.	.	H	α-helix	trans	-59.8	-34.9	-177.7	-164.7	-175.9	-71.6	112.7	-5.3	112.8	S1143 E1144 R1151 T1157 D1161	S1143-R1147 WeakPolarHBondContact O-CB 3.47Å; S1143-R1147 PolarHBondContact O-N 3.49Å; E1144-R1147 PolarHBondContact O-N 3.05Å; R1147-R1151 WeakPolarHBondContact O-CG 3.18Å; R1147-R1151 PolarHBondContact O-N 3.13Å; R1147-T1157 HydrophobicContact CG-CG2 3.85Å; R1147-D1161 IonicContact CZ-OD1 2.71Å; R1147-D1161 IonicContact NE-OD1 3.8Å; R1147-D1161 PolarHBondContact NE-OD1 3.07Å; R1147-D1161 IonicContact NH2-OD1 3.07Å; R1147-D1161 PolarHBondContact NH2-OD1 3.44Å
1148	N	90	Very high	83.3	Confident	80 Å²	80	70.3 Å²	70.3	43%	0.428	36%	0.355	S	S	.	.	H	α-helix	trans	-77.2	-35.9	176.6	-70.1	-37.3	0	0	0	112.6	E1144 L1145 V1146 R1151 H1152	E1144-N1148 VanDerWaalsContact O-CB 3.25Å; E1144-N1148 WeakPolarHBondContact O-CB 3.39Å; E1144-N1148 PolarHBondContact O-N 3.18Å; E1144-N1148 PolarHBondContact O-ND2 3.07Å; L1145-N1148 PolarHBondContact O-N 3.08Å; V1146-N1148 VanDerWaalsContact C-N 3.27Å; V1146-N1148 PolarHBondContact O-N 3.07Å; N1148-R1151 PolarHBondContact O-N 2.75Å; N1148-H1152 PolarHBondContact O-N 3.26Å; N1148-H1152 VanDerWaalsContact O-N 3.11Å
1149	R	89.1	Confident	82.5	Confident	91 Å²	91	64.5 Å²	64.5	34%	0.343	34%	0.336	S	S	.	.	H	α-helix	trans	-69	-40.7	173.9	-72	-51.3	-162.6	129.3	-2.9	113	L866 D867 L870 L1145 V1146 R1151 H1152 L1153	L866-R1149 HydrophobicContact CD2-CG 4.41Å; D867-R1149 WeakPolarHBondContact OD1-CD 3.43Å; D867-R1149 IonicContact OD1-CZ 3.48Å; D867-R1149 IonicContact OD1-NE 3.34Å; D867-R1149 IonicContact OD1-NH1 3.85Å; D867-R1149 PolarHBondContact OD1-NH1 3.3Å; D867-R1149 IonicContact OD2-CZ 3.06Å; D867-R1149 IonicContact OD2-NH1 2.7Å; D867-R1149 PolarHBondContact OD2-NH1 2.83Å; D867-R1149 IonicContact OD2-NH2 3.44Å; L870-R1149 HydrophobicContact CD1-CB 3.59Å; L1145-R1149 WeakPolarHBondContact O-CG 3.49Å; L1145-R1149 PolarHBondContact O-N 3.39Å; V1146-R1149 PolarHBondContact O-N 3.43Å; V1146-R1149 VanDerWaalsContact O-N 3.13Å; R1149-R1151 VanDerWaalsContact C-N 3.29Å; R1149-R1151 PolarHBondContact O-N 3.31Å; R1149-H1152 WeakPolarHBondContact O-CB 3.35Å; R1149-H1152 PolarHBondContact O-N 3.2Å; R1149-L1153 PolarHBondContact O-N 3.19Å; R1149-L1153 VanDerWaalsContact O-N 3.08Å
1150	M	86.5	Confident	82	Confident	3 Å²	3	60.7 Å²	60.7	2%	0.015	32%	0.322	C	S	.	.	H	α-helix	trans	-54.3	-46.1	170.9	-71.1	-174.8	79.7	0	0	111.9	L870 I875 V1146 H1152 L1153 G1154 L1155 P1156 T1157	L870-M1150 HydrophobicContact CD1-CG 4.26Å; L870-M1150 HydrophobicContact CD2-CG 4.07Å; I875-M1150 HydrophobicContact CD1-CE 3.56Å; I875-M1150 HydrophobicContact CD1-CG 4.13Å; I875-M1150 HydrophobicContact CD1-SD 3.33Å; I875-M1150 WeakPolarHBondContact CD1-SD 3.36Å; V1146-M1150 HydrophobicContact CG1-CG 4.31Å; V1146-M1150 HydrophobicContact CG1-SD 4.23Å; V1146-M1150 WeakPolarHBondContact O-CG 3.41Å; V1146-M1150 PolarHBondContact O-N 2.88Å; M1150-H1152 VanDerWaalsContact C-N 3.3Å; M1150-H1152 PolarHBondContact O-N 3.08Å; M1150-L1153 CarbonylContact O-C 3.58Å; M1150-L1153 PolarHBondContact O-N 2.72Å; M1150-G1154 PolarHBondContact O-N 2.95Å; M1150-G1154 VanDerWaalsContact O-N 3.09Å; M1150-L1155 HydrophobicContact CB-CB 4.14Å; M1150-L1155 HydrophobicContact CE-CB 4.03Å; M1150-L1155 PolarHBondContact O-N 3.4Å; M1150-P1156 VanDerWaalsContact CE-O 3.26Å; M1150-P1156 WeakPolarHBondContact CE-O 3.11Å; M1150-T1157 HydrophobicContact CB-CG2 3.86Å; M1150-T1157 HydrophobicContact CE-CG2 4.43Å; M1150-T1157 HydrophobicContact SD-CG2 4.02Å
1151	R	87.6	Confident	80.5	Confident	151 Å²	151	58.2 Å²	58.2	57%	0.57	31%	0.311	S	S	*	.	H	α-helix	trans	-64.2	-32	176.7	-72.1	169.9	178.3	171.6	-2.6	113.5	R1147 N1148 R1149 L1153 G1154 T1157	R1147-R1151 WeakPolarHBondContact O-CG 3.18Å; R1147-R1151 PolarHBondContact O-N 3.13Å; N1148-R1151 PolarHBondContact O-N 2.75Å; R1149-R1151 VanDerWaalsContact C-N 3.29Å; R1149-R1151 PolarHBondContact O-N 3.31Å; R1151-L1153 VanDerWaalsContact C-N 3.34Å; R1151-G1154 PolarHBondContact O-N 2.94Å; R1151-T1157 HydrophobicContact CG-CG2 4.27Å
1152	H	89.5	Confident	78.8	Confident	141 Å²	141	57.8 Å²	57.8	65%	0.653	31%	0.313	S	S	*	.	H	α-helix	trans	-66.7	-38.1	174.7	-176.1	16.1	0	0	0	111.8	N1148 R1149 M1150 G1154	N1148-H1152 PolarHBondContact O-N 3.26Å; N1148-H1152 VanDerWaalsContact O-N 3.11Å; R1149-H1152 WeakPolarHBondContact O-CB 3.35Å; R1149-H1152 PolarHBondContact O-N 3.2Å; M1150-H1152 VanDerWaalsContact C-N 3.3Å; M1150-H1152 PolarHBondContact O-N 3.08Å; H1152-G1154 VanDerWaalsContact C-N 3.31Å
1153	L	84.4	Confident	77.1	Confident	45 Å²	45	58.4 Å²	58.4	24%	0.236	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	1.2	176.3	-62	168.8	0	0	0	113.6	D867 L870 Q871 R1149 M1150 R1151 L1155	D867-L1153 HydrophobicContact CB-CD1 4.38Å; L870-L1153 HydrophobicContact CB-CD1 3.6Å; L870-L1153 HydrophobicContact CD1-CD1 4.14Å; Q871-L1153 HydrophobicContact CG-CD1 4.15Å; Q871-L1153 HydrophobicContact CG-CD2 4.1Å; R1149-L1153 PolarHBondContact O-N 3.19Å; R1149-L1153 VanDerWaalsContact O-N 3.08Å; M1150-L1153 CarbonylContact O-C 3.58Å; M1150-L1153 PolarHBondContact O-N 2.72Å; R1151-L1153 VanDerWaalsContact C-N 3.34Å; L1153-L1155 HydrophobicContact CB-CD1 4.04Å; L1153-L1155 HydrophobicContact CB-CG 4.19Å; L1153-L1155 HydrophobicContact CD1-CD1 4.1Å; L1153-L1155 PolarHBondContact O-N 3.3Å
1154	G	81.9	Confident	75.2	Confident	64 Å²	64	59.3 Å²	59.3	66%	0.66	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	-0.2	-175.8	0	0	0	0	0	115.7	M1150 R1151 H1152	M1150-G1154 PolarHBondContact O-N 2.95Å; M1150-G1154 VanDerWaalsContact O-N 3.09Å; R1151-G1154 PolarHBondContact O-N 2.94Å; H1152-G1154 VanDerWaalsContact C-N 3.31Å
1155	L	82.2	Confident	73	Confident	11 Å²	11	60.7 Å²	60.7	6%	0.058	33%	0.332	C	S	.	.			trans	-71.4	131.1	-175.4	-72.8	167.9	0	0	0	112.9	D792 K794 L870 M1150 L1153 T1157	D792-L1155 HydrophobicContact CB-CD2 4.14Å; D792-L1155 VanDerWaalsContact OD2-CD2 3.28Å; D792-L1155 WeakPolarHBondContact OD2-CD2 3.33Å; K794-L1155 HydrophobicContact CB-CD2 3.99Å; K794-L1155 HydrophobicContact CD-CD2 4.13Å; L870-L1155 HydrophobicContact CB-CD1 4.15Å; L870-L1155 WeakPolarHBondContact O-CD1 3.26Å; M1150-L1155 HydrophobicContact CB-CB 4.14Å; M1150-L1155 HydrophobicContact CE-CB 4.03Å; M1150-L1155 PolarHBondContact O-N 3.4Å; L1153-L1155 HydrophobicContact CB-CD1 4.04Å; L1153-L1155 HydrophobicContact CB-CG 4.19Å; L1153-L1155 HydrophobicContact CD1-CD1 4.1Å; L1153-L1155 PolarHBondContact O-N 3.3Å; L1155-T1157 PolarHBondContact O-N 3.2Å
1156	P	81	Confident	70.6	Confident	77 Å²	77	62.1 Å²	62.1	50%	0.5	34%	0.34	S	S	.	.			trans	-73	128.7	179.3	26.5	-32.3	0	0	0	112	K794 M1150	K794-P1156 HydrophobicContact CD-CG 4.37Å; K794-P1156 PolarHBondContact NZ-O 3.01Å; M1150-P1156 VanDerWaalsContact CE-O 3.26Å; M1150-P1156 WeakPolarHBondContact CE-O 3.11Å
1157	T	75.9	Confident	68.3	Low	28 Å²	28	65 Å²	65	17%	0.172	36%	0.357	C	S	.	.			trans	-84.6	-9.5	-167.8	62.1	0	0	0	0	115.7	R1147 M1150 R1151 L1155 G1159 Y1160	R1147-T1157 HydrophobicContact CG-CG2 3.85Å; M1150-T1157 HydrophobicContact CB-CG2 3.86Å; M1150-T1157 HydrophobicContact CE-CG2 4.43Å; M1150-T1157 HydrophobicContact SD-CG2 4.02Å; R1151-T1157 HydrophobicContact CG-CG2 4.27Å; L1155-T1157 PolarHBondContact O-N 3.2Å; T1157-G1159 PolarHBondContact O-N 3.42Å; T1157-Y1160 WeakPolarHBondContact O-CB 3.35Å; T1157-Y1160 PolarHBondContact O-N 2.86Å
1158	S	67	Low	65.9	Low	75 Å²	75	64.8 Å²	64.8	52%	0.524	37%	0.366	S	S	.	.	H	α-helix	trans	-49.1	-49.7	-170.5	46.6	0	0	0	0	114.3	Y1160 D1161 D1162	S1158-Y1160 PolarHBondContact O-N 2.72Å; S1158-Y1160 VanDerWaalsContact O-N 3.11Å; S1158-D1161 PolarHBondContact O-N 2.95Å; S1158-D1162 PolarHBondContact O-N 2.93Å
1159	G	61.4	Low	63.2	Low	28 Å²	28	63.8 Å²	63.8	29%	0.289	37%	0.366	S	S	.	.	H	α-helix	trans	-66.6	-9.5	-179	0	0	0	0	0	115.8	T1157 V1163	T1157-G1159 PolarHBondContact O-N 3.42Å; G1159-V1163 WeakPolarHBondContact O-CG2 3.37Å
1160	Y	66.1	Low	60.7	Low	16 Å²	16	65.2 Å²	65.2	6%	0.063	38%	0.38	C	S	.	.	H	α-helix	trans	-78.6	-40.2	168.6	-172.6	-83.6	0	0	0	110.9	I875 F912 S1143 V1146 T1157 S1158 V1163 T1164	I875-Y1160 HydrophobicContact CD1-CD2 4.49Å; F912-Y1160 HydrophobicContact CE1-CE2 4.42Å; S1143-Y1160 WeakPolarHBondContact CA-OH 3.49Å; S1143-Y1160 WeakPolarHBondContact CB-OH 3.47Å; V1146-Y1160 HydrophobicContact CB-CE2 4.24Å; V1146-Y1160 HydrophobicContact CG1-CD2 3.88Å; V1146-Y1160 HydrophobicContact CG1-CE2 3.83Å; T1157-Y1160 WeakPolarHBondContact O-CB 3.35Å; T1157-Y1160 PolarHBondContact O-N 2.86Å; S1158-Y1160 PolarHBondContact O-N 2.72Å; S1158-Y1160 VanDerWaalsContact O-N 3.11Å; Y1160-V1163 PolarHBondContact O-N 3.38Å; Y1160-T1164 HydrophobicContact CD1-CG2 4.37Å; Y1160-T1164 HydrophobicContact CE1-CG2 3.92Å; Y1160-T1164 PolarHBondContact O-N 2.98Å
1161	D	47.3	Very low	58.4	Low	43 Å²	43	68.6 Å²	68.6	23%	0.23	40%	0.401	C	S	.	.	H	α-helix	trans	-70.2	-38.2	-174.9	-62.3	-44.7	0	0	0	110.7	R1147 S1158 V1163 T1164 N1165	R1147-D1161 IonicContact CZ-OD1 2.71Å; R1147-D1161 IonicContact NE-OD1 3.8Å; R1147-D1161 PolarHBondContact NE-OD1 3.07Å; R1147-D1161 IonicContact NH2-OD1 3.07Å; R1147-D1161 PolarHBondContact NH2-OD1 3.44Å; S1158-D1161 PolarHBondContact O-N 2.95Å; D1161-V1163 PolarHBondContact O-N 3.14Å; D1161-T1164 CarbonylContact O-C 3.31Å; D1161-T1164 PolarHBondContact O-N 2.88Å; D1161-T1164 VanDerWaalsContact O-N 3.08Å; D1161-T1164 PolarHBondContact O-OG1 2.99Å; D1161-N1165 WeakPolarHBondContact O-CB 3.46Å; D1161-N1165 PolarHBondContact O-N 3.4Å; D1161-N1165 PolarHBondContact O-ND2 3.1Å; D1161-N1165 VanDerWaalsContact O-ND2 3.15Å
1162	D	48.9	Very low	55.8	Low	97 Å²	97	68.6 Å²	68.6	52%	0.519	41%	0.409	S	S	.	.	H	α-helix	trans	-61	-41.2	174.9	-69	-34.5	0	0	0	113.3	S1158 T1164 N1165 L1166	S1158-D1162 PolarHBondContact O-N 2.93Å; D1162-T1164 PolarHBondContact O-N 3.18Å; D1162-N1165 PolarHBondContact O-N 3.3Å; D1162-N1165 VanDerWaalsContact O-N 3.15Å; D1162-L1166 PolarHBondContact O-N 3.5Å
1163	V	48.8	Very low	53.1	Low	60 Å²	60	68.8 Å²	68.8	36%	0.364	42%	0.415	S	S	.	.	H	α-helix	trans	-63.5	-28.7	175.7	174.3	0	0	0	0	111.4	G1159 Y1160 D1161	G1159-V1163 WeakPolarHBondContact O-CG2 3.37Å; Y1160-V1163 PolarHBondContact O-N 3.38Å; D1161-V1163 PolarHBondContact O-N 3.14Å
1164	T	45.2	Very low	50.7	Low	39 Å²	39	77.7 Å²	77.7	24%	0.239	45%	0.445	C	S	.	.	H	α-helix	trans	-82.9	-35.1	171	58.4	0	0	0	0	113.5	Y1160 D1161 D1162 T1167 A1168	Y1160-T1164 HydrophobicContact CD1-CG2 4.37Å; Y1160-T1164 HydrophobicContact CE1-CG2 3.92Å; Y1160-T1164 PolarHBondContact O-N 2.98Å; D1161-T1164 CarbonylContact O-C 3.31Å; D1161-T1164 PolarHBondContact O-N 2.88Å; D1161-T1164 VanDerWaalsContact O-N 3.08Å; D1161-T1164 PolarHBondContact O-OG1 2.99Å; D1162-T1164 PolarHBondContact O-N 3.18Å; T1164-T1167 PolarHBondContact O-N 3.47Å; T1164-T1167 PolarHBondContact O-OG1 3.15Å; T1164-A1168 PolarHBondContact O-N 3.08Å
1165	N	37.5	Very low	48.3	Very low	91 Å²	91	79.6 Å²	79.6	49%	0.487	44%	0.444	S	S	.	.	H	α-helix	trans	-77.1	-33.3	-174.1	-70.2	-28	0	0	0	113.2	D1161 D1162 T1167 A1168 S1169	D1161-N1165 WeakPolarHBondContact O-CB 3.46Å; D1161-N1165 PolarHBondContact O-N 3.4Å; D1161-N1165 PolarHBondContact O-ND2 3.1Å; D1161-N1165 VanDerWaalsContact O-ND2 3.15Å; D1162-N1165 PolarHBondContact O-N 3.3Å; D1162-N1165 VanDerWaalsContact O-N 3.15Å; N1165-T1167 PolarHBondContact O-N 2.9Å; N1165-A1168 WeakPolarHBondContact O-CA 3.47Å; N1165-A1168 WeakPolarHBondContact O-CB 3.26Å; N1165-A1168 PolarHBondContact O-N 3.07Å; N1165-S1169 PolarHBondContact O-N 2.97Å
1166	L	39.7	Very low	45.7	Very low	114 Å²	114	86.3 Å²	86.3	60%	0.597	48%	0.48	S	S	*	.	H	α-helix	trans	-56.8	-39.6	168.9	-79.5	162.1	0	0	0	111.2	D1162 A1168 S1169	D1162-L1166 PolarHBondContact O-N 3.5Å; L1166-A1168 PolarHBondContact O-N 2.94Å; L1166-S1169 PolarHBondContact O-N 3.38Å; L1166-S1169 PolarHBondContact O-OG 3.3Å; L1166-S1169 VanDerWaalsContact O-OG 3.04Å
1167	T	39.3	Very low	43.2	Very low	61 Å²	61	90.9 Å²	90.9	37%	0.374	50%	0.499	S	S	.	.	H	α-helix	trans	-73.7	-4.4	175	70.6	0	0	0	0	114.3	T1164 N1165 V1171 N1187	T1164-T1167 PolarHBondContact O-N 3.47Å; T1164-T1167 PolarHBondContact O-OG1 3.15Å; N1165-T1167 PolarHBondContact O-N 2.9Å; T1167-V1171 WeakPolarHBondContact O-CG2 3.49Å; T1167-N1187 VanDerWaalsContact CB-ND2 3.26Å; T1167-N1187 WeakPolarHBondContact CB-ND2 3.13Å; T1167-N1187 PolarHBondContact OG1-ND2 2.93Å; T1167-N1187 VanDerWaalsContact OG1-ND2 3.08Å
1168	A	33.7	Very low	40.8	Very low	45 Å²	45	92.6 Å²	92.6	37%	0.372	52%	0.523	S	S	.	.	H	α-helix	trans	-102.4	-32.2	174.3	0	0	0	0	0	112.9	T1164 N1165 L1166 V1171 M1172	T1164-A1168 PolarHBondContact O-N 3.08Å; N1165-A1168 WeakPolarHBondContact O-CA 3.47Å; N1165-A1168 WeakPolarHBondContact O-CB 3.26Å; N1165-A1168 PolarHBondContact O-N 3.07Å; L1166-A1168 PolarHBondContact O-N 2.94Å; A1168-V1171 PolarHBondContact O-N 3.04Å; A1168-M1172 PolarHBondContact O-N 3.2Å; A1168-M1172 VanDerWaalsContact O-N 3.1Å
1169	S	34.3	Very low	38.8	Very low	60 Å²	60	100.2 Å²	100.2	42%	0.42	54%	0.542	S	S	.	.	H	α-helix	trans	-65.7	-41.6	177.4	51.2	0	0	0	0	112.5	N1165 L1166 V1171 M1172	N1165-S1169 PolarHBondContact O-N 2.97Å; L1166-S1169 PolarHBondContact O-N 3.38Å; L1166-S1169 PolarHBondContact O-OG 3.3Å; L1166-S1169 VanDerWaalsContact O-OG 3.04Å; S1169-V1171 VanDerWaalsContact C-N 3.32Å; S1169-V1171 PolarHBondContact O-N 2.98Å; S1169-M1172 PolarHBondContact O-N 2.91Å
1170	D	36	Very low	37.2	Very low	120 Å²	120	107.5 Å²	107.5	64%	0.642	57%	0.573	S	S	*	*	H	α-helix	trans	-68	-34.1	-179.4	-70	-4	0	0	0	112
1171	V	38.6	Very low	35.3	Very low	74 Å²	74	115.5 Å²	115.5	45%	0.448	61%	0.611	S	S	.	*	H	α-helix	trans	-66.3	-41.1	172.6	174	0	0	0	0	111	T1167 A1168 S1169 N1173 R1174 V1175	T1167-V1171 WeakPolarHBondContact O-CG2 3.49Å; A1168-V1171 PolarHBondContact O-N 3.04Å; S1169-V1171 VanDerWaalsContact C-N 3.32Å; S1169-V1171 PolarHBondContact O-N 2.98Å; V1171-N1173 PolarHBondContact O-N 3.14Å; V1171-N1173 VanDerWaalsContact O-N 3.15Å; V1171-R1174 PolarHBondContact O-N 2.78Å; V1171-V1175 HydrophobicContact CG1-CG2 4.11Å
1172	M	32.2	Very low	34.5	Very low	151 Å²	151	121.4 Å²	121.4	74%	0.744	64%	0.642	S	S	*	*	H	α-helix	trans	-65.8	-20.6	-173.8	-159.2	150	-69.9	0	0	113.7	A1168 S1169 R1174	A1168-M1172 PolarHBondContact O-N 3.2Å; A1168-M1172 VanDerWaalsContact O-N 3.1Å; S1169-M1172 PolarHBondContact O-N 2.91Å; M1172-R1174 VanDerWaalsContact C-N 3.28Å; M1172-R1174 PolarHBondContact O-N 2.95Å
1173	N	32.8	Very low	33.5	Very low	146 Å²	146	125.3 Å²	125.3	78%	0.781	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-0.3	172.6	-84.3	-33	0	0	0	114.8	V1171	V1171-N1173 PolarHBondContact O-N 3.14Å; V1171-N1173 VanDerWaalsContact O-N 3.15Å
1174	R	35.8	Very low	32.6	Very low	231 Å²	231	131 Å²	131	87%	0.872	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.8	-6.8	-178.2	-73	-174.6	176.4	161.7	2.2	116.3	V1171 M1172 N1176	V1171-R1174 PolarHBondContact O-N 2.78Å; M1172-R1174 VanDerWaalsContact C-N 3.28Å; M1172-R1174 PolarHBondContact O-N 2.95Å; R1174-N1176 PolarHBondContact O-N 2.91Å; R1174-N1176 VanDerWaalsContact O-N 3.13Å
1175	V	30.6	Very low	32	Very low	105 Å²	105	135.7 Å²	135.7	64%	0.636	70%	0.704	S	S	*	*			trans	-82.2	95.5	-175.9	-176.6	0	0	0	0	111.6	V1171	V1171-V1175 HydrophobicContact CG1-CG2 4.11Å
1176	N	27.3	Very low	32	Very low	152 Å²	152	138.2 Å²	138.2	81%	0.813	71%	0.713	S	S	*	*			trans	-149.9	48.7	161.6	-147.6	2.6	0	0	0	115	R1174	R1174-N1176 PolarHBondContact O-N 2.91Å; R1174-N1176 VanDerWaalsContact O-N 3.13Å
1177	L	28.8	Very low	32.2	Very low	172 Å²	172	136.7 Å²	136.7	90%	0.901	71%	0.705	S	S	*	*	S	Bend	trans	-156.8	165.3	145.9	-130.1	69.4	0	0	0	108.8
1178	G	24.6	Very low	32.7	Very low	64 Å²	64	136.3 Å²	136.3	66%	0.66	70%	0.699	S	S	*	*			trans	-116.2	162.2	-159.3	0	0	0	0	0	117.6
1179	Y	26.2	Very low	34	Very low	236 Å²	236	136 Å²	136	93%	0.925	69%	0.691	S	S	*	*			trans	60.9	93.4	161.7	-69.6	-87.8	0	0	0	119
1180	L	27.1	Very low	35.8	Very low	181 Å²	181	136.1 Å²	136.1	95%	0.948	69%	0.69	S	S	*	*				-155.1	162.4	115.3	-105.3	164.8	0	0	0	109.6
1181	Q	27.2	Very low	38.1	Very low	184 Å²	184	131 Å²	131	86%	0.86	66%	0.662	S	S	*	*			trans	-130.2	65.9	-159.3	-164.3	174.4	9.1	0	0	113.7
1182	D	28.8	Very low	40.5	Very low	166 Å²	166	127.9 Å²	127.9	89%	0.888	64%	0.643	S	S	*	*			trans	-144.1	-6.9	166.1	-94.4	-47.2	0	0	0	113.7	Q1184	D1182-Q1184 PolarHBondContact O-N 3.21Å
1183	E	29.2	Very low	43.4	Very low	179 Å²	179	120.9 Å²	120.9	84%	0.836	61%	0.609	S	S	*	*			trans	-96.1	73.5	-174.5	-62.5	-170	135.4	0	0	113.6
1184	Q	30	Very low	46.3	Very low	181 Å²	181	114 Å²	114	85%	0.846	57%	0.572	S	S	*	*			trans	-132.9	48.9	170.9	-71.6	-158.8	-41.9	0	0	113.3	D1182	D1182-Q1184 PolarHBondContact O-N 3.21Å
1185	N	32.9	Very low	49.1	Very low	137 Å²	137	103.3 Å²	103.3	73%	0.733	53%	0.532	S	S	*	.			trans	-127.6	18.6	175.8	-103.4	-31.7	0	0	0	113.3	N1187	N1185-N1187 VanDerWaalsContact C-N 3.29Å; N1185-N1187 PolarHBondContact O-N 3.5Å
1186	E	36.3	Very low	52	Low	144 Å²	144	98.3 Å²	98.3	67%	0.673	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-65.8	-27.3	-177.4	-64.5	-160.4	112.7	0	0	114	Q1188 N1189	E1186-Q1188 PolarHBondContact O-N 3.45Å; E1186-N1189 PolarHBondContact O-N 3.43Å; E1186-N1189 VanDerWaalsContact O-N 3.08Å
1187	N	44.4	Very low	55.2	Low	82 Å²	82	91.6 Å²	91.6	44%	0.439	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-58.2	-9.5	-166.4	-60.5	44.5	0	0	0	116.1	T1167 N1185	T1167-N1187 VanDerWaalsContact CB-ND2 3.26Å; T1167-N1187 WeakPolarHBondContact CB-ND2 3.13Å; T1167-N1187 PolarHBondContact OG1-ND2 2.93Å; T1167-N1187 VanDerWaalsContact OG1-ND2 3.08Å; N1185-N1187 VanDerWaalsContact C-N 3.29Å; N1185-N1187 PolarHBondContact O-N 3.5Å
1188	Q	49.5	Very low	58.2	Low	52 Å²	52	83.4 Å²	83.4	24%	0.243	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-153.6	69.8	158.1	-155.7	172.6	89.4	0	0	111.7	P913 R933 E1186	P913-Q1188 PolarHBondContact O-NE2 2.9Å; R933-Q1188 PolarHBondContact NH2-O 2.94Å; E1186-Q1188 PolarHBondContact O-N 3.45Å
1189	N	61.1	Low	61.2	Low	38 Å²	38	83.2 Å²	83.2	20%	0.203	41%	0.412	C	S	.	.			trans	-99.2	32.5	169.5	-142.3	58.5	0	0	0	113.7	R933 H1046 F1048 E1186	R933-N1189 PolarHBondContact NH1-OD1 3.08Å; H1046-N1189 PolarHBondContact N-O 3.21Å; H1046-N1189 PolarHBondContact O-ND2 3.26Å; F1048-N1189 WeakPolarHBondContact CD2-ND2 3.25Å; F1048-N1189 WeakPolarHBondContact CE2-ND2 3.41Å; F1048-N1189 WeakPolarHBondContact CE2-OD1 3.29Å; E1186-N1189 PolarHBondContact O-N 3.43Å; E1186-N1189 VanDerWaalsContact O-N 3.08Å
1190	T	71.8	Confident	64.2	Low	64 Å²	64	75 Å²	75	39%	0.393	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	117.5	173.1	51.3	0	0	0	0	110.8	E1044	E1044-T1190 CarbonylContact O-C 3.55Å; E1044-T1190 WeakPolarHBondContact O-CA 3.44Å
1191	L	84.5	Confident	67.2	Low	12 Å²	12	72.1 Å²	72.1	6%	0.063	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	148.1	159.2	177.2	68.1	0	0	0	108.6	W558 L962 T1043 E1044 Y1193	W558-L1191 VanDerWaalsContact CD1-CD2 3.49Å; W558-L1191 HydrophobicContact CD2-CD2 3.84Å; W558-L1191 HydrophobicContact CG-CD2 3.76Å; W558-L1191 HydrophobicContact CZ2-CD1 4.05Å; W558-L1191 HydrophobicContact CZ2-CD2 4.42Å; L962-L1191 HydrophobicContact CD1-CD1 4.11Å; L962-L1191 HydrophobicContact CD2-CD1 3.38Å; L962-L1191 HydrophobicContact CG-CD1 4.35Å; T1043-L1191 CarbonylContact C-O 3.57Å; T1043-L1191 WeakPolarHBondContact CA-O 3.29Å; E1044-L1191 HydrophobicContact CB-CB 4.38Å; E1044-L1191 PolarHBondContact N-O 2.99Å; E1044-L1191 PolarHBondContact O-N 3.42Å; L1191-Y1193 HydrophobicContact CD2-CD1 4.16Å; L1191-Y1193 HydrophobicContact CD2-CE1 4.11Å; L1191-Y1193 HydrophobicContact CG-CD1 4.18Å
1192	S	89.6	Confident	70.2	Confident	8 Å²	8	64.3 Å²	64.3	6%	0.056	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	140.8	173.2	-47.4	0	0	0	0	112.6	A965 A966 Y1041 R1042	A965-S1192 CarbonylContact C-O 3.56Å; A966-S1192 PolarHBondContact N-O 3.29Å; Y1041-S1192 WeakPolarHBondContact OH-CB 3.46Å; R1042-S1192 WeakPolarHBondContact O-CA 3.41Å; R1042-S1192 WeakPolarHBondContact O-CB 3.49Å
1193	Y	92.4	Very high	73.1	Confident	5 Å²	5	65.4 Å²	65.4	2%	0.02	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	163.7	-176.6	61.5	-92	0	0	0	112	W558 A965 R1042 E1044 L1191 L1195	W558-Y1193 HydrophobicContact CB-CD1 4.3Å; W558-Y1193 HydrophobicContact CB-CE1 3.52Å; W558-Y1193 HydrophobicContact CB-CE2 4.33Å; W558-Y1193 WeakPolarHBondContact CB-OH 3.25Å; W558-Y1193 HydrophobicContact CD2-CD1 4.08Å; W558-Y1193 HydrophobicContact CD2-CE1 4.18Å; W558-Y1193 AromaticContact CE3-CD1 3.64Å; W558-Y1193 HydrophobicContact CE3-CD1 3.64Å; W558-Y1193 HydrophobicContact CE3-CD2 4.31Å; W558-Y1193 HydrophobicContact CE3-CE1 4.08Å; W558-Y1193 AromaticContact CE3-CG 3.77Å; W558-Y1193 HydrophobicContact CE3-CG 3.77Å; W558-Y1193 HydrophobicContact CG-CD1 4.39Å; W558-Y1193 AromaticContact CG-CE1 4Å; W558-Y1193 HydrophobicContact CG-CE1 4Å; W558-Y1193 HydrophobicContact CZ3-CD1 4.31Å; W558-Y1193 HydrophobicContact CZ3-CG 4.23Å; A965-Y1193 WeakPolarHBondContact O-CA 3.48Å; R1042-Y1193 HydrophobicContact CB-CE2 4.47Å; R1042-Y1193 PolarHBondContact N-O 2.7Å; R1042-Y1193 PolarHBondContact O-N 3.08Å; E1044-Y1193 HydrophobicContact CG-CE1 4.2Å; E1044-Y1193 PolarHBondContact OE1-OH 3.23Å; L1191-Y1193 HydrophobicContact CD2-CD1 4.16Å; L1191-Y1193 HydrophobicContact CD2-CE1 4.11Å; L1191-Y1193 HydrophobicContact CG-CD1 4.18Å; Y1193-L1195 HydrophobicContact CD2-CD2 4.01Å; Y1193-L1195 HydrophobicContact CD2-CG 4.01Å; Y1193-L1195 HydrophobicContact CE2-CD1 3.94Å; Y1193-L1195 HydrophobicContact CE2-CD2 3.81Å; Y1193-L1195 HydrophobicContact CE2-CG 3.68Å
1194	V	94.4	Very high	76.1	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.006	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	131.6	178.8	51	0	0	0	0	112	T525 L529 Y562 I1040 I1196 Y1211	T525-V1194 HydrophobicContact CG2-CG1 3.63Å; L529-V1194 HydrophobicContact CD1-CG1 4.31Å; Y562-V1194 WeakPolarHBondContact CD2-O 3.35Å; Y562-V1194 HydrophobicContact CE2-CG1 4.31Å; Y562-V1194 WeakPolarHBondContact CE2-O 3.24Å; I1040-V1194 CarbonylContact O-C 3.59Å; I1040-V1194 WeakPolarHBondContact O-CA 3.47Å; V1194-I1196 HydrophobicContact CG2-CG1 4.18Å; V1194-Y1211 HydrophobicContact CB-CE2 4.45Å; V1194-Y1211 HydrophobicContact CG2-CE2 3.61Å
1195	L	93.7	Very high	78.9	Confident	6 Å²	6	53 Å²	53	3%	0.031	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	110.2	170.9	-62.7	179.3	0	0	0	110.2	M561 C565 G1039 I1040 Y1193	M561-L1195 HydrophobicContact CB-CD2 4.11Å; C565-L1195 HydrophobicContact CB-CB 4.46Å; C565-L1195 HydrophobicContact CB-CD2 4.08Å; G1039-L1195 CarbonylContact C-O 3.53Å; G1039-L1195 WeakPolarHBondContact CA-O 3.25Å; I1040-L1195 HydrophobicContact CD1-CD1 4.27Å; I1040-L1195 HydrophobicContact CG1-CB 3.94Å; I1040-L1195 HydrophobicContact CG1-CD1 4.34Å; I1040-L1195 PolarHBondContact N-O 3.25Å; I1040-L1195 PolarHBondContact O-N 3.19Å; Y1193-L1195 HydrophobicContact CD2-CD2 4.01Å; Y1193-L1195 HydrophobicContact CD2-CG 4.01Å; Y1193-L1195 HydrophobicContact CE2-CD1 3.94Å; Y1193-L1195 HydrophobicContact CE2-CD2 3.81Å; Y1193-L1195 HydrophobicContact CE2-CG 3.68Å
1196	I	93.1	Very high	81.5	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	135.5	177.3	-49.9	-179.1	0	0	0	109.3	L526 L529 L530 C565 N568 I634 V1194	L526-I1196 HydrophobicContact CD1-CB 4.49Å; L526-I1196 HydrophobicContact CD1-CD1 3.79Å; L526-I1196 HydrophobicContact CD1-CG1 3.69Å; L526-I1196 HydrophobicContact CD1-CG2 4.23Å; L529-I1196 HydrophobicContact CB-CD1 3.53Å; L529-I1196 HydrophobicContact CD1-CD1 4Å; L529-I1196 HydrophobicContact CG-CD1 4.39Å; L530-I1196 HydrophobicContact CD2-CG2 3.97Å; L530-I1196 HydrophobicContact CG-CD1 4.28Å; C565-I1196 WeakPolarHBondContact CB-O 3.27Å; C565-I1196 PolarHBondContact SG-O 2.91Å; C565-I1196 VanDerWaalsContact SG-O 3.4Å; N568-I1196 HydrophobicContact CB-CB 4.47Å; N568-I1196 HydrophobicContact CB-CG2 4.02Å; N568-I1196 PolarHBondContact ND2-O 3.22Å; I634-I1196 HydrophobicContact CG2-CG2 4.35Å; V1194-I1196 HydrophobicContact CG2-CG1 4.18Å
1197	N	92.6	Very high	84	Confident	11 Å²	11	46.3 Å²	46.3	6%	0.059	23%	0.234	C	C	.	.	S	Bend	trans	35.7	62.8	-180	-174.9	43	0	0	0	113.8	N568 H597 G601 C603 I634 I1038	N568-N1197 PolarHBondContact OD1-ND2 3.05Å; H597-N1197 PolarHBondContact CD2-OD1 3.18Å; H597-N1197 PolarHBondContact NE2-OD1 2.87Å; G601-N1197 PolarHBondContact O-ND2 2.94Å; C603-N1197 WeakPolarHBondContact CB-OD1 3.37Å; I634-N1197 HydrophobicContact CB-CB 4.43Å; I634-N1197 HydrophobicContact CG2-CB 3.82Å; I634-N1197 PolarHBondContact O-ND2 2.92Å; I1038-N1197 WeakPolarHBondContact O-CA 3.36Å; I1038-N1197 PolarHBondContact O-N 2.92Å
1198	P	92	Very high	86.3	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.006	21%	0.214	C	C	.	.			trans	-68.3	158.5	178.4	29.7	-34.8	0	0	0	111.6	H597 Y1022 T1202	H597-P1198 PolarHBondContact CE1-O 3.18Å; H597-P1198 PolarHBondContact NE2-O 3.1Å; Y1022-P1198 HydrophobicContact CD1-CG 3.87Å; Y1022-P1198 HydrophobicContact CD2-CG 3.93Å; Y1022-P1198 HydrophobicContact CE1-CG 3.85Å; Y1022-P1198 HydrophobicContact CE2-CG 3.89Å; Y1022-P1198 HydrophobicContact CG-CG 3.9Å; P1198-T1202 HydrophobicContact CB-CG2 3.83Å
1199	S	88.7	Confident	88.4	Confident	60 Å²	60	41.5 Å²	41.5	42%	0.42	21%	0.21	S	C	.	.			trans	-65.1	154.3	175.9	62	0	0	0	0	112	D1201 T1202	S1199-D1201 PolarHBondContact O-N 2.7Å; S1199-D1201 VanDerWaalsContact O-N 3.07Å; S1199-T1202 PolarHBondContact O-N 3.01Å; S1199-T1202 VanDerWaalsContact O-N 3.09Å; S1199-T1202 PolarHBondContact O-OG1 2.83Å; S1199-T1202 VanDerWaalsContact O-OG1 3.07Å
1200	H	88.4	Confident	90	Very high	64 Å²	64	39.7 Å²	39.7	30%	0.296	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-20.3	-176.7	49.6	-111.7	0	0	0	114.7	K598 G1023	K598-H1200 PolarHBondContact O-CE1 3.03Å; G1023-H1200 PolarHBondContact N-O 2.76Å
1201	D	89.6	Confident	91.1	Very high	120 Å²	120	36.7 Å²	36.7	64%	0.642	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-10	178.2	-71	-33.9	0	0	0	114.4	S1199 R1203	S1199-D1201 PolarHBondContact O-N 2.7Å; S1199-D1201 VanDerWaalsContact O-N 3.07Å; D1201-R1203 PolarHBondContact O-N 3.01Å
1202	T	90.6	Very high	91.5	Very high	19 Å²	19	36.1 Å²	36.1	12%	0.117	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-63.1	133.4	-179.8	58.1	0	0	0	0	110.8	M561 T1021 Y1022 P1198 S1199	M561-T1202 HydrophobicContact CE-CG2 4.17Å; T1021-T1202 CarbonylContact C-O 3.47Å; T1021-T1202 VanDerWaalsContact CA-O 3.26Å; T1021-T1202 WeakPolarHBondContact CA-O 3.31Å; Y1022-T1202 VanDerWaalsContact CB-OG1 3.3Å; Y1022-T1202 WeakPolarHBondContact CB-OG1 3.33Å; Y1022-T1202 PolarHBondContact N-O 3.09Å; P1198-T1202 HydrophobicContact CB-CG2 3.83Å; S1199-T1202 PolarHBondContact O-N 3.01Å; S1199-T1202 VanDerWaalsContact O-N 3.09Å; S1199-T1202 PolarHBondContact O-OG1 2.83Å; S1199-T1202 VanDerWaalsContact O-OG1 3.07Å
1203	R	91.3	Very high	91.7	Very high	190 Å²	190	35.9 Å²	35.9	72%	0.717	18%	0.177	S	C	*	.	B	Isolated β-bridge	trans	-81	142.7	176.4	-67.7	-174.5	-179.1	-173	0	110.3	G1020 R1042 D1201	G1020-R1203 WeakPolarHBondContact O-CA 3.48Å; R1042-R1203 PolarHBondContact NH2-O 3.32Å; D1201-R1203 PolarHBondContact O-N 3.01Å
1204	L	91.1	Very high	91.5	Very high	19 Å²	19	40.3 Å²	40.3	10%	0.099	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-93.4	138.8	176.2	-59.4	168.3	0	0	0	109.1	I1012 I1019 G1020 Y1022 L1025 I1040	I1012-L1204 HydrophobicContact CD1-CB 3.82Å; I1012-L1204 HydrophobicContact CD1-CD1 3.85Å; I1012-L1204 HydrophobicContact CD1-CD2 3.9Å; I1012-L1204 HydrophobicContact CD1-CG 4.05Å; I1019-L1204 HydrophobicContact CG2-CD1 4.38Å; G1020-L1204 PolarHBondContact O-N 3.37Å; Y1022-L1204 HydrophobicContact CD2-CD2 4.28Å; L1025-L1204 HydrophobicContact CB-CD1 3.85Å; L1025-L1204 HydrophobicContact CD2-CD1 3.98Å; L1025-L1204 HydrophobicContact CG-CD1 4.45Å; I1040-L1204 HydrophobicContact CD1-CD2 4.48Å; I1040-L1204 HydrophobicContact CG2-CD2 4.15Å
1205	E	89.2	Confident	91.1	Very high	81 Å²	81	41.1 Å²	41.1	38%	0.379	20%	0.199	S	C	.	.			trans	-113	162.6	-178.6	-77.5	164.5	-143.8	0	0	111.7	R1042 N1207 D1208	R1042-E1205 IonicContact CZ-OE1 2.63Å; R1042-E1205 IonicContact CZ-OE2 2.6Å; R1042-E1205 IonicContact NE-OE2 3.34Å; R1042-E1205 IonicContact NH1-OE1 2.74Å; R1042-E1205 PolarHBondContact NH1-OE1 2.98Å; R1042-E1205 IonicContact NH1-OE2 3.07Å; R1042-E1205 PolarHBondContact NH1-OE2 3.32Å; R1042-E1205 VanDerWaalsContact NH2-CD 3.27Å; R1042-E1205 IonicContact NH2-OE1 2.86Å; R1042-E1205 PolarHBondContact NH2-OE1 3.38Å; R1042-E1205 IonicContact NH2-OE2 2.66Å; E1205-N1207 PolarHBondContact O-N 3.06Å; E1205-D1208 PolarHBondContact N-OD2 3Å; E1205-D1208 WeakPolarHBondContact O-CB 3.34Å; E1205-D1208 PolarHBondContact O-N 3.48Å; E1205-D1208 VanDerWaalsContact O-N 3.13Å
1206	I	87.6	Confident	90.5	Very high	77 Å²	77	41.1 Å²	41.1	40%	0.395	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	132.7	-177.8	-167.4	179.3	0	0	0	110	E1014 L1017 D1208	E1014-I1206 HydrophobicContact CG-CD1 3.57Å; E1014-I1206 HydrophobicContact CG-CG1 4.34Å; L1017-I1206 HydrophobicContact CD1-CB 4.23Å; I1206-D1208 VanDerWaalsContact C-N 3.3Å
1207	N	89	Confident	89.7	Confident	63 Å²	63	44.1 Å²	44.1	34%	0.337	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	4.5	-171.3	-47.8	-85.8	0	0	0	116.3	K1011 I1012 E1205 I1209	K1011-N1207 WeakPolarHBondContact CE-OD1 3.3Å; K1011-N1207 PolarHBondContact NZ-OD1 2.79Å; I1012-N1207 WeakPolarHBondContact O-CA 3.25Å; I1012-N1207 PolarHBondContact O-N 2.99Å; E1205-N1207 PolarHBondContact O-N 3.06Å; N1207-I1209 PolarHBondContact O-N 3.12Å
1208	D	92.9	Very high	88.6	Confident	1 Å²	1	47 Å²	47	1%	0.005	23%	0.234	C	C	.	.			trans	-54.9	132.4	167.8	-85.9	-13.6	0	0	0	109.5	I1012 R1042 E1205 I1206	I1012-D1208 WeakPolarHBondContact CB-O 3.39Å; I1012-D1208 HydrophobicContact CD1-CB 4.14Å; I1012-D1208 PolarHBondContact N-O 2.72Å; R1042-D1208 WeakPolarHBondContact CA-OD1 3.41Å; R1042-D1208 VanDerWaalsContact CB-OD1 3.25Å; R1042-D1208 WeakPolarHBondContact CB-OD1 3.32Å; R1042-D1208 WeakPolarHBondContact CG-OD1 3.2Å; R1042-D1208 IonicContact CZ-OD2 2.85Å; R1042-D1208 IonicContact NE-OD1 3.91Å; R1042-D1208 PolarHBondContact NE-OD1 3.02Å; R1042-D1208 IonicContact NE-OD2 2.75Å; R1042-D1208 IonicContact NH2-OD2 2.69Å; R1042-D1208 PolarHBondContact NH2-OD2 3.25Å; E1205-D1208 PolarHBondContact N-OD2 3Å; E1205-D1208 WeakPolarHBondContact O-CB 3.34Å; E1205-D1208 PolarHBondContact O-N 3.48Å; E1205-D1208 VanDerWaalsContact O-N 3.13Å; I1206-D1208 VanDerWaalsContact C-N 3.3Å
1209	I	93.7	Very high	87.2	Confident	32 Å²	32	49.6 Å²	49.6	16%	0.164	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	119	179.7	-65.6	169.7	0	0	0	108.7	P521 A1009 K1011 I1040 Y1041 N1207	P521-I1209 HydrophobicContact CG-CB 4.43Å; P521-I1209 HydrophobicContact CG-CD1 3.86Å; P521-I1209 HydrophobicContact CG-CG2 4.07Å; A1009-I1209 HydrophobicContact CB-CG2 3.81Å; K1011-I1209 HydrophobicContact CB-CG1 4.04Å; K1011-I1209 HydrophobicContact CD-CG1 4.5Å; K1011-I1209 HydrophobicContact CG-CG1 3.92Å; I1040-I1209 CarbonylContact C-O 3.53Å; Y1041-I1209 HydrophobicContact CD1-CB 4.39Å; Y1041-I1209 HydrophobicContact CD1-CD1 4.4Å; Y1041-I1209 PolarHBondContact N-O 3.4Å; Y1041-I1209 PolarHBondContact O-N 3.47Å; N1207-I1209 PolarHBondContact O-N 3.12Å
1210	V	94	Very high	85.3	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	129	-173.5	-167.1	0	0	0	0	109.7	A1009 M1010 I1012 Y1022 L1025 P1037 G1039 I1040 L1212	A1009-V1210 WeakPolarHBondContact CA-O 3.36Å; M1010-V1210 PolarHBondContact N-O 2.67Å; M1010-V1210 PolarHBondContact O-N 2.53Å; I1012-V1210 HydrophobicContact CD1-CG2 3.75Å; I1012-V1210 HydrophobicContact CG1-CG2 3.99Å; Y1022-V1210 HydrophobicContact CE2-CG1 4.39Å; L1025-V1210 HydrophobicContact CD2-CB 4.34Å; L1025-V1210 HydrophobicContact CD2-CG1 3.95Å; L1025-V1210 HydrophobicContact CD2-CG2 3.75Å; P1037-V1210 HydrophobicContact CB-CG1 3.82Å; G1039-V1210 WeakPolarHBondContact O-CG1 3.42Å; I1040-V1210 HydrophobicContact CG2-CB 4.46Å; I1040-V1210 HydrophobicContact CG2-CG1 4.16Å; I1040-V1210 HydrophobicContact CG2-CG2 4.01Å; V1210-L1212 HydrophobicContact CB-CD2 4.2Å; V1210-L1212 HydrophobicContact CG1-CD2 3.61Å
1211	Y	94.9	Very high	82.9	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	121.8	176	-57.6	-97	0	0	0	109.5	C520 P521 A522 L526 P1037 I1038 G1039 V1194	C520-Y1211 HydrophobicContact CB-CD1 4.46Å; P521-Y1211 VanDerWaalsContact O-CE1 3.25Å; P521-Y1211 WeakPolarHBondContact O-CE1 3.21Å; P521-Y1211 PolarHBondContact O-OH 3.39Å; A522-Y1211 PolarHBondContact O-OH 3.09Å; L526-Y1211 HydrophobicContact CB-CE1 4.43Å; L526-Y1211 HydrophobicContact CD2-CD1 3.58Å; L526-Y1211 HydrophobicContact CD2-CD2 4.42Å; L526-Y1211 HydrophobicContact CD2-CE1 3.79Å; L526-Y1211 HydrophobicContact CD2-CG 3.89Å; P1037-Y1211 CarbonylContact C-O 3.52Å; P1037-Y1211 WeakPolarHBondContact CA-O 3.39Å; I1038-Y1211 PolarHBondContact N-O 2.61Å; G1039-Y1211 PolarHBondContact O-N 2.94Å; V1194-Y1211 HydrophobicContact CB-CE2 4.45Å; V1194-Y1211 HydrophobicContact CG2-CE2 3.61Å
1212	L	93.2	Very high	80.2	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	137.6	-173.9	-53.7	-174	0	0	0	110.9	C1008 M1010 L1029 E1035 I1036 P1037 V1210	C1008-L1212 PolarHBondContact N-O 3.41Å; C1008-L1212 PolarHBondContact O-N 2.87Å; M1010-L1212 HydrophobicContact CB-CD1 3.64Å; M1010-L1212 HydrophobicContact CB-CG 4.37Å; M1010-L1212 HydrophobicContact SD-CD1 4.43Å; L1029-L1212 HydrophobicContact CD1-CD1 4.01Å; L1029-L1212 HydrophobicContact CD1-CD2 3.51Å; L1029-L1212 HydrophobicContact CD1-CG 4.45Å; L1029-L1212 HydrophobicContact CD2-CD1 4.24Å; E1035-L1212 WeakPolarHBondContact OE2-CD1 3.24Å; I1036-L1212 WeakPolarHBondContact O-CA 3.32Å; P1037-L1212 HydrophobicContact CB-CD2 3.6Å; V1210-L1212 HydrophobicContact CB-CD2 4.2Å; V1210-L1212 HydrophobicContact CG1-CD2 3.61Å
1213	I	92.7	Very high	77.1	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.015	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	110.2	163.9	-48.5	179.2	0	0	0	107.5	I605 L617 N618 L995 I1036 I1038	I605-I1213 HydrophobicContact CB-CD1 4.41Å; I605-I1213 HydrophobicContact CG2-CD1 3.47Å; I605-I1213 VanDerWaalsContact CG2-CD1 3.47Å; L617-I1213 HydrophobicContact CB-CG2 4.28Å; N618-I1213 HydrophobicContact CB-CB 4.13Å; N618-I1213 HydrophobicContact CB-CG2 3.55Å; N618-I1213 PolarHBondContact ND2-O 3.29Å; L995-I1213 HydrophobicContact CD2-CD1 4.32Å; I1036-I1213 PolarHBondContact N-O 3.02Å; I1036-I1213 PolarHBondContact O-N 3.05Å; I1038-I1213 HydrophobicContact CD1-CD1 3.93Å; I1038-I1213 HydrophobicContact CD1-CG1 3.64Å; I1038-I1213 HydrophobicContact CG1-CD1 3.98Å; I1038-I1213 HydrophobicContact CG1-CG1 3.71Å
1214	R	88.5	Confident	74.1	Confident	98 Å²	98	58.1 Å²	58.1	37%	0.37	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	145.9	172.9	-72.5	-106.3	162	157	-19.2	110.1	G1005 F1006 C1008 E1035	G1005-R1214 CarbonylContact C-O 3.51Å; G1005-R1214 WeakPolarHBondContact CA-O 3.16Å; F1006-R1214 HydrophobicContact CD1-CB 3.83Å; F1006-R1214 HydrophobicContact CD2-CB 4.34Å; F1006-R1214 HydrophobicContact CE1-CB 3.33Å; F1006-R1214 HydrophobicContact CE1-CG 4.12Å; F1006-R1214 HydrophobicContact CE2-CB 3.92Å; F1006-R1214 HydrophobicContact CE2-CG 3.92Å; F1006-R1214 HydrophobicContact CG-CB 4.31Å; F1006-R1214 HydrophobicContact CZ-CB 3.4Å; F1006-R1214 HydrophobicContact CZ-CG 3.64Å; F1006-R1214 PolarHBondContact N-O 2.81Å; F1006-R1214 PolarHBondContact O-N 3.35Å; C1008-R1214 HydrophobicContact CB-CG 3.74Å; E1035-R1214 VanDerWaalsContact CD-CZ 3.49Å; E1035-R1214 HydrophobicContact CG-CG 4.44Å; E1035-R1214 IonicContact OE1-CZ 3.68Å; E1035-R1214 IonicContact OE1-NE 2.64Å; E1035-R1214 IonicContact OE1-NH2 3.17Å; E1035-R1214 PolarHBondContact OE1-NH2 3.32Å; E1035-R1214 IonicContact OE2-CZ 2.65Å; E1035-R1214 IonicContact OE2-NE 2.94Å; E1035-R1214 PolarHBondContact OE2-NE 3.04Å; E1035-R1214 IonicContact OE2-NH2 2.77Å; E1035-R1214 PolarHBondContact OE2-NH2 3.44Å
1215	S	87.2	Confident	71	Confident	19 Å²	19	61.9 Å²	61.9	13%	0.133	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-64.8	156	166	-176	0	0	0	0	110.9	N618 P1217	N618-S1215 WeakPolarHBondContact O-CA 3.31Å; S1215-P1217 WeakPolarHBondContact O-CD 3.48Å
1216	D	80.9	Confident	68.2	Low	6 Å²	6	63.9 Å²	63.9	3%	0.032	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-60.6	121.9	172.2	177.7	-0.3	0	0	0	110.7	Y824 G1003 L1218 A1219	Y824-D1216 PolarHBondContact OH-OD1 3.47Å; Y824-D1216 VanDerWaalsContact OH-OD1 3.08Å; G1003-D1216 VanDerWaalsContact CA-OD2 3.25Å; G1003-D1216 WeakPolarHBondContact CA-OD2 3.38Å; G1003-D1216 PolarHBondContact N-OD2 2.75Å; D1216-L1218 VanDerWaalsContact C-N 3.29Å; D1216-L1218 PolarHBondContact O-N 3.16Å; D1216-L1218 WeakPolarHBondContact OD1-CB 3.48Å; D1216-L1218 PolarHBondContact OD1-N 2.8Å; D1216-A1219 HydrophobicContact CB-CB 3.96Å
1217	P	75.2	Confident	65.4	Low	63 Å²	63	66 Å²	66	41%	0.409	38%	0.377	S	S	.	.	S	Bend	trans	-65.8	-23	176.6	-20.6	33.4	0	0	0	115.1	Y824 F1006 S1215	Y824-P1217 HydrophobicContact CE2-CG 4.41Å; F1006-P1217 HydrophobicContact CE1-CG 4.03Å; S1215-P1217 WeakPolarHBondContact O-CD 3.48Å
1218	L	70.6	Confident	62.5	Low	71 Å²	71	71.7 Å²	71.7	37%	0.372	40%	0.401	S	S	.	.	S	Bend	trans	-88.3	-22.8	-177.3	-66.7	173.2	0	0	0	112.8	L766 Y824 D1216 H1220 V1221	L766-L1218 HydrophobicContact CD1-CD1 3.83Å; Y824-L1218 HydrophobicContact CD2-CD1 3.81Å; Y824-L1218 HydrophobicContact CD2-CG 4.13Å; Y824-L1218 HydrophobicContact CE2-CD1 3.51Å; Y824-L1218 HydrophobicContact CE2-CG 3.7Å; D1216-L1218 VanDerWaalsContact C-N 3.29Å; D1216-L1218 PolarHBondContact O-N 3.16Å; D1216-L1218 WeakPolarHBondContact OD1-CB 3.48Å; D1216-L1218 PolarHBondContact OD1-N 2.8Å; L1218-H1220 PolarHBondContact O-N 3.44Å; L1218-V1221 PolarHBondContact O-N 3Å; L1218-V1221 VanDerWaalsContact O-N 3.08Å
1219	A	61.8	Low	59.5	Low	56 Å²	56	76.9 Å²	76.9	46%	0.463	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-3	177.9	0	0	0	0	0	114.6	D1216	D1216-A1219 HydrophobicContact CB-CB 3.96Å
1220	H	49.4	Very low	56.3	Low	113 Å²	113	80.9 Å²	80.9	52%	0.523	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-4.1	173.3	-65.4	-33.5	0	0	0	114.2	H622 L1218 P1222	H622-H1220 AromaticContact CD2-CE1 3.98Å; H622-H1220 AromaticContact CD2-ND1 3.93Å; H622-H1220 AromaticContact NE2-CE1 3.69Å; H622-H1220 AromaticContact NE2-ND1 3.54Å; L1218-H1220 PolarHBondContact O-N 3.44Å; H1220-P1222 WeakPolarHBondContact O-CD 3.45Å
1221	V	38.4	Very low	53.2	Low	106 Å²	106	85.9 Å²	85.9	64%	0.642	50%	0.503	S	S	*	.	S	Bend	trans	-90.2	112.8	173.2	-174.8	0	0	0	0	109.1	L1218	L1218-V1221 PolarHBondContact O-N 3Å; L1218-V1221 VanDerWaalsContact O-N 3.08Å
1222	P	31.4	Very low	50.1	Low	102 Å²	102	94.1 Å²	94.1	66%	0.662	55%	0.546	S	S	*	.			trans	-67.1	143.9	173.4	28.8	-34.1	0	0	0	110.4	H1220 V1224	H1220-P1222 WeakPolarHBondContact O-CD 3.45Å; P1222-V1224 PolarHBondContact O-N 3.1Å
1223	E	26.8	Very low	47	Very low	194 Å²	194	104 Å²	104	91%	0.907	59%	0.589	S	S	*	*			trans	-61	105.7	175.5	-67.8	-171.9	140.8	0	0	110.5	P1225	E1223-P1225 WeakPolarHBondContact O-CD 3.45Å
1224	V	26.8	Very low	43.9	Very low	117 Å²	117	113 Å²	113	71%	0.709	63%	0.631	S	S	*	*			trans	-72.3	117.3	171	-179.4	0	0	0	0	107.5	P1222	P1222-V1224 PolarHBondContact O-N 3.1Å
1225	P	27.8	Very low	41	Very low	98 Å²	98	119.5 Å²	119.5	64%	0.636	66%	0.656	S	S	*	*			trans	-63.3	144.5	-179.7	26.6	-34.4	0	0	0	110.1	E1223 V1227	E1223-P1225 WeakPolarHBondContact O-CD 3.45Å; P1225-V1227 PolarHBondContact O-N 2.91Å
1226	P	29.3	Very low	38.1	Very low	122 Å²	122	127.9 Å²	127.9	79%	0.792	69%	0.692	S	S	*	*			trans	-62.8	109.1	-173.4	24.5	-34.1	0	0	0	111.1	H1228	P1226-H1228 PolarHBondContact O-N 3.35Å; P1226-H1228 VanDerWaalsContact O-N 3.17Å
1227	V	28.5	Very low	35.5	Very low	123 Å²	123	137.3 Å²	137.3	75%	0.745	73%	0.733	S	S	*	*			trans	-68.2	112.8	179	177.9	0	0	0	0	109.2	P1225 S1229	P1225-V1227 PolarHBondContact O-N 2.91Å; V1227-S1229 PolarHBondContact O-N 3.16Å
1228	H	29.1	Very low	33.2	Very low	182 Å²	182	140 Å²	140	84%	0.843	75%	0.753	S	S	*	*			trans	-63.5	96.7	172.8	-83.9	-67	0	0	0	111.1	P1226 S1230	P1226-H1228 PolarHBondContact O-N 3.35Å; P1226-H1228 VanDerWaalsContact O-N 3.17Å; H1228-S1230 VanDerWaalsContact C-N 3.33Å; H1228-S1230 PolarHBondContact O-N 3.48Å
1229	S	28.8	Very low	31	Very low	109 Å²	109	141.6 Å²	141.6	76%	0.762	77%	0.771	S	S	*	*			trans	-77.6	76.3	174.8	45.5	0	0	0	0	111.8	V1227 S1231	V1227-S1229 PolarHBondContact O-N 3.16Å; S1229-S1231 PolarHBondContact O-N 3.3Å; S1229-S1231 VanDerWaalsContact O-N 3.13Å
1230	S	27.9	Very low	29.4	Very low	116 Å²	116	146.4 Å²	146.4	81%	0.811	79%	0.787	S	S	*	*			trans	-77.8	90.2	177.9	58.6	0	0	0	0	112.8	H1228	H1228-S1230 VanDerWaalsContact C-N 3.33Å; H1228-S1230 PolarHBondContact O-N 3.48Å
1231	S	27.8	Very low	28.3	Very low	106 Å²	106	148.3 Å²	148.3	74%	0.741	80%	0.801	S	S	*	*			trans	-150.1	104.2	162.3	47.5	0	0	0	0	115	S1229	S1229-S1231 PolarHBondContact O-N 3.3Å; S1229-S1231 VanDerWaalsContact O-N 3.13Å
1232	L	29.3	Very low	27.9	Very low	172 Å²	172	149.4 Å²	149.4	90%	0.901	81%	0.808	S	S	*	*			trans	-1	119	148.5	-65.5	162.2	0	0	0	117.8
1233	K	28.8	Very low	27.7	Very low	208 Å²	208	154 Å²	154	90%	0.904	82%	0.818	S	S	*	*			trans	-148.7	158.9	136.1	-116.4	166.6	-173.4	175.2	0	111.3
1234	E	28.4	Very low	27.7	Very low	193 Å²	193	153.6 Å²	153.6	90%	0.902	82%	0.816	S	S	*	*			trans	-92.5	166.7	-148.9	-67.4	179.9	100.9	0	0	115.9
1235	R	26.9	Very low	27.8	Very low	233 Å²	233	155.7 Å²	155.7	88%	0.879	82%	0.823	S	S	*	*			trans	-61.6	130.6	178.3	-62.1	166.4	173.6	166.5	-3.4	111.5
1236	H	27.1	Very low	27.8	Very low	195 Å²	195	157 Å²	157	90%	0.903	83%	0.83	S	S	*	*			trans	-131.8	119.8	134	-99.5	-86.6	0	0	0	109.1
1237	K	25.8	Very low	28.1	Very low	205 Å²	205	157.3 Å²	157.3	89%	0.891	83%	0.831	S	S	*	*			trans	-93	127.5	169.6	-79.6	-168.2	171.4	-167	0	108.7
1238	S	26.8	Very low	28.1	Very low	118 Å²	118	163 Å²	163	83%	0.825	86%	0.856	S	S	*	*			trans	-134.1	112.1	159.1	52.5	0	0	0	0	107.5
1239	S	24.2	Very low	28.1	Very low	106 Å²	106	162.1 Å²	162.1	74%	0.741	86%	0.857	S	S	*	*			trans	-79.8	128.2	-175.3	48	0	0	0	0	112
1240	I	29.3	Very low	28	Very low	157 Å²	157	164.8 Å²	164.8	81%	0.805	86%	0.862	S	S	*	*			trans	-132.7	115.4	151.3	-62.4	-177.2	0	0	0	106
1241	D	25.4	Very low	28	Very low	153 Å²	153	167.6 Å²	167.6	82%	0.818	87%	0.865	S	S	*	*			trans	-85.8	125.1	177.3	-56	-65.1	0	0	0	109.9
1242	T	29.1	Very low	28	Very low	129 Å²	129	171.2 Å²	171.2	79%	0.791	87%	0.872	S	S	*	*			trans	-126.3	129	160.9	49.7	0	0	0	0	108.3
1243	K	27.3	Very low	28	Very low	198 Å²	198	171.1 Å²	171.1	86%	0.861	87%	0.87	S	S	*	*			trans	-60.8	152.7	-163.5	-67.4	173.7	174.3	178.4	0	114.2
1244	E	28.5	Very low	27.9	Very low	186 Å²	186	168.7 Å²	168.7	87%	0.869	87%	0.868	S	S	*	*			trans	-62.9	133.7	154.5	-56.2	164.7	131.7	0	0	109.4
1245	D	28.4	Very low	27.9	Very low	160 Å²	160	166.9 Å²	166.9	86%	0.856	87%	0.865	S	S	*	*			trans	-120.6	128	154.2	-87.9	-48.7	0	0	0	107.2
1246	T	26.6	Very low	28	Very low	127 Å²	127	161.8 Å²	161.8	78%	0.779	86%	0.864	S	S	*	*			trans	-78.4	144.9	-175.7	47	0	0	0	0	111.9
1247	P	36.8	Very low	28	Very low	127 Å²	127	159.1 Å²	159.1	83%	0.825	86%	0.861	S	S	*	*			trans	-70	150.9	-179.8	30.4	-36	0	0	0	112.7
1248	L	28.2	Very low	28.2	Very low	243 Å²	243	154.9 Å²	154.9	100%	1.272	86%	0.858	S	S	*	*			trans	-125.5	0	166.8	-115.1	172.8	0	0	0	108.6

Retrieved 1,248 of 1,248 residues in 2695.5 ms (Link to these results)

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