A0A5K4F0B9_SCHMA Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession A0A5K4F0B9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,140 aa.

						>A0A5K4F0B9_SCHMA|A0A5K4F0B9
MPHQNGVKSNIYRGQLPTSATCPGSLYTCDFHDDIQNVVQKRTALMPGQMDLISNQTSNYHPLPIINHPNLTVCQKSFCGTFFDCSSNASSPGCAASSPVCHSGVYGIIEPPQSSSIPTAQTLALSAHHVSYNPDTVVPQGFATENRMHGNPSAHRLTHSHSAQDAGGFMFQSLFPSPGQVLHRYGSHLTPNHIQMHQISPPGNIYGPLVSVPVPYFSLGSTSSSSLSHNPLVYSGRSASNSACASTNNNPSGASPLVSRRPRIPNSNSCAFSELWQPGPVPNISTQSSALPLTSNIGITQNPPNCGLRERSPCNHDTSAYNESQFYITEDKCFLQPGRICHHQVTPITQSPKTKDIDESLLSSDSNASPTGGCKLEPGNKKGAPLPPPIPPRSNLRNQFVSTTNTRVNAADHIISATAVHPVTPSHTYKKEIASRPQSLNTTVNRQNYRTTSNSNKNATSPVATISSSLVLSISEESNKVSTTDSRVQTSDDNMQSVLYTANDINSPSDTPPKLPPRMVTSNNGNILIPKKSQVPEKVEKVSTSHLNTPTEQQQDEMGMDDFCSRSASPFVNQPIKTYFSNSTEPVIPVKLNDDDTMEKPTYPSTKLSTQVQEPEIAKESMDSSHEQHTFRIVKPVNPAVYRRFMEQRMADIGRIHRERKERRDRLESEMSKVGLDENARVQMRCLLRKKESNHMRMQRAKMDQSMFYRIKHLGVGAFGKVWLVRKKDNNQLYAMKLLNKRDVVERRQLAHVQAERDILAEADNEWVVKLFFSFQDSRALYLVMEYIPGGDMMSLLIKKGIFEEPLARFYIAELTLALQSVHAMGFVHRDIKPDNILINREGHIKLTDFGLCTGFRWTHSSKYWDLDFNIPCTSPSRNRINRAKTAEPPESTESTEDQITKSCKECDEDDVTTIEKEEVGVLEQVHNFRQTNGKQFTALRGVHHDKTLERRRNSFANRRCAQSLVGTPNYIAPEILRRQDYGQACDWWSVGVILYEMLVGQPPFLAQTAADTQIRVVQWYNYLKLPGEPRLKKDASNLIRQLLRDPSDRLSDPVKIKSHPFFESVAWDKLVQQTPPYVPTIRDELDTSNFDPVDDERTLYSSGNNHSLDYSSTNNTQLPFPNFTFKRFFDRDPTTIQTP
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33	Very low	32.3	Very low	235 Å²	235	145.7 Å²	145.7	100%	1.158	80%	0.798	S	S	*	*				0	132.1	0	-68.6	-58.7	-168	0	0	108.6
2	P	39.2	Very low	32	Very low	101 Å²	101	151.8 Å²	151.8	66%	0.656	80%	0.803	S	S	*	*			cis	-127.3	149.3	-41.9	37.5	-26.2	0	0	0	112.3
3	H	34.5	Very low	31.8	Very low	158 Å²	158	158.2 Å²	158.2	73%	0.731	81%	0.809	S	S	*	*			trans	58.7	152.8	137.2	-73	-115.6	0	0	0	121.4
4	Q	35.8	Very low	31.7	Very low	135 Å²	135	151.6 Å²	151.6	63%	0.631	80%	0.801	S	S	*	*			cis	-167.6	172.4	-31.3	-124.1	-179.6	2.1	0	0	108
5	N	35.1	Very low	31.6	Very low	138 Å²	138	151.7 Å²	151.7	74%	0.738	80%	0.795	S	S	*	*			trans	24.5	128.3	147.5	-48.6	-19.1	0	0	0	119.2
6	G	30.2	Very low	31.5	Very low	75 Å²	75	151.9 Å²	151.9	77%	0.773	80%	0.796	S	S	*	*			cis	128.4	113.4	8.4	0	0	0	0	0	111.1
7	V	33.2	Very low	31.5	Very low	142 Å²	142	150.1 Å²	150.1	86%	0.861	80%	0.795	S	S	*	*			trans	-128.4	133.2	177.3	-180	0	0	0	0	108.9
8	K	27.7	Very low	31.4	Very low	207 Å²	207	144 Å²	144	90%	0.9	77%	0.765	S	S	*	*			trans	-98.8	133.2	171.9	-68.1	178	179.4	175.4	0	109.5
9	S	28.3	Very low	31.2	Very low	100 Å²	100	139.9 Å²	139.9	70%	0.699	75%	0.749	S	S	*	*			trans	-157.4	130.8	155.9	57.6	0	0	0	0	112.7
10	N	30.4	Very low	31.1	Very low	144 Å²	144	136.8 Å²	136.8	77%	0.77	74%	0.743	S	S	*	*			trans	61.3	106	148.9	-57.5	-8	0	0	0	119.6
11	I	28.4	Very low	31	Very low	168 Å²	168	136.8 Å²	136.8	86%	0.862	75%	0.748	S	S	*	*			trans	-53.6	130	149.6	-62.3	162.4	0	0	0	108.8
12	Y	28.6	Very low	30.7	Very low	219 Å²	219	130.3 Å²	130.3	86%	0.859	73%	0.725	S	S	*	*			trans	-135.1	139.2	163.8	-121.5	-95.8	0	0	0	111.3
13	R	28.5	Very low	30.2	Very low	234 Å²	234	131.1 Å²	131.1	88%	0.883	73%	0.73	S	S	*	*			trans	-114.1	67.7	-168.8	-164.8	-176	-168.3	-178.3	4.8	111.1	Q15	R13-Q15 PolarHBondContact O-N 2.9Å
14	G	30.9	Very low	29.9	Very low	67 Å²	67	127 Å²	127	69%	0.691	73%	0.73	S	S	*	*			trans	-74.3	111	169.9	0	0	0	0	0	110.3
15	Q	29.6	Very low	29.5	Very low	152 Å²	152	124.9 Å²	124.9	71%	0.71	73%	0.73	S	S	*	*				63.8	90.8	79.2	-64.3	-170.2	4.9	0	0	113.4	R13 F631	R13-Q15 PolarHBondContact O-N 2.9Å; Q15-F631 HydrophobicContact CB-CE1 4.37Å; Q15-F631 HydrophobicContact CB-CZ 4.15Å; Q15-F631 VanDerWaalsContact CD-CZ 3.45Å; Q15-F631 HydrophobicContact CG-CE1 4.07Å; Q15-F631 HydrophobicContact CG-CE2 4.36Å; Q15-F631 HydrophobicContact CG-CZ 3.55Å
16	L	30.4	Very low	29.2	Very low	156 Å²	156	125.2 Å²	125.2	82%	0.817	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-101.3	133.8	154.9	-90.5	164.4	0	0	0	107.9
17	P	31.9	Very low	29.1	Very low	120 Å²	120	130.8 Å²	130.8	78%	0.779	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-71.8	145.9	-170.9	28.4	-34.9	0	0	0	112.5
18	T	29.2	Very low	28.9	Very low	41 Å²	41	128.6 Å²	128.6	25%	0.252	72%	0.717	S	S	.	*	P	Polyproline II helix	trans	-97.5	145.9	-173.4	63.1	0	0	0	0	113.1	F631 R632	T18-F631 HydrophobicContact CG2-CD1 4.2Å; T18-R632 HydrophobicContact CG2-CB 4.43Å; T18-R632 WeakPolarHBondContact CG2-O 3.16Å; T18-R632 PolarHBondContact OG1-N 3.47Å; T18-R632 VanDerWaalsContact OG1-N 3.14Å
19	S	28.1	Very low	29	Very low	67 Å²	67	122.5 Å²	122.5	47%	0.469	70%	0.7	S	S	.	*			trans	70.5	108.6	164.8	72.8	0	0	0	0	119.1	R632	S19-R632 VanDerWaalsContact CB-CZ 3.46Å; S19-R632 PolarHBondContact OG-NE 2.92Å; S19-R632 VanDerWaalsContact OG-NE 3.12Å; S19-R632 PolarHBondContact OG-NH2 3.41Å
20	A	29.1	Very low	29.1	Very low	76 Å²	76	123 Å²	123	63%	0.628	70%	0.695	S	S	*	*			trans	-149.7	135.4	130.1	0	0	0	0	0	110.3	C22	A20-C22 HydrophobicContact CB-CB 3.98Å; A20-C22 VanDerWaalsContact CB-SG 3.55Å; A20-C22 PolarHBondContact O-N 3.47Å
21	T	28.6	Very low	29.2	Very low	138 Å²	138	123.2 Å²	123.2	85%	0.847	69%	0.689	S	S	*	*			trans	-82.3	54.3	163.7	-46.8	0	0	0	0	108.6
22	C	27.8	Very low	29.4	Very low	99 Å²	99	121.9 Å²	121.9	67%	0.669	68%	0.679	S	S	*	*			trans	-78	142.2	-173.3	-94	0	0	0	0	111.9	A20 G24	A20-C22 HydrophobicContact CB-CB 3.98Å; A20-C22 VanDerWaalsContact CB-SG 3.55Å; A20-C22 PolarHBondContact O-N 3.47Å; C22-G24 PolarHBondContact O-N 3.34Å
23	P	27.2	Very low	29.7	Very low	118 Å²	118	117.5 Å²	117.5	77%	0.766	67%	0.67	S	S	*	*			trans	-73.2	97	173	30.7	-32.6	0	0	0	109.3	S25	P23-S25 PolarHBondContact O-N 3.33Å
24	G	29.6	Very low	29.9	Very low	71 Å²	71	110.4 Å²	110.4	73%	0.732	65%	0.65	S	S	*	*			trans	-57.5	102.2	175.8	0	0	0	0	0	111.4	C22 L26	C22-G24 PolarHBondContact O-N 3.34Å; G24-L26 VanDerWaalsContact C-N 3.3Å; G24-L26 PolarHBondContact O-N 3.05Å
25	S	27.6	Very low	30.1	Very low	90 Å²	90	112.8 Å²	112.8	63%	0.629	65%	0.646	S	S	*	*			trans	-77.6	82.3	175.7	-168	0	0	0	0	109.8	P23 Y27	P23-S25 PolarHBondContact O-N 3.33Å; S25-Y27 PolarHBondContact O-N 2.68Å
26	L	29	Very low	30.5	Very low	145 Å²	145	113.1 Å²	113.1	76%	0.759	65%	0.647	S	S	*	*			trans	-78.9	108.3	144.4	-79.5	170	0	0	0	107	G24 T28	G24-L26 VanDerWaalsContact C-N 3.3Å; G24-L26 PolarHBondContact O-N 3.05Å; L26-T28 PolarHBondContact O-N 2.92Å
27	Y	26.5	Very low	30.7	Very low	193 Å²	193	110.6 Å²	110.6	76%	0.757	64%	0.635	S	S	*	*			trans	-52.7	117.6	146.6	-84.1	-107.9	0	0	0	106.3	S25 C29	S25-Y27 PolarHBondContact O-N 2.68Å; Y27-C29 PolarHBondContact O-N 2.88Å
28	T	30.3	Very low	30.9	Very low	96 Å²	96	110.3 Å²	110.3	59%	0.589	63%	0.63	S	S	*	*			trans	-74.3	81.5	152.5	55.2	0	0	0	0	105.7	L26	L26-T28 PolarHBondContact O-N 2.92Å
29	C	28.8	Very low	31.3	Very low	78 Å²	78	114 Å²	114	53%	0.527	65%	0.652	S	S	.	*			trans	-49.8	140.7	150.5	-57	0	0	0	0	106.6	Y27 F31	Y27-C29 PolarHBondContact O-N 2.88Å; C29-F31 VanDerWaalsContact C-N 3.26Å; C29-F31 PolarHBondContact O-N 3.23Å
30	D	31.7	Very low	31.8	Very low	111 Å²	111	118.7 Å²	118.7	59%	0.594	67%	0.667	S	S	*	*			trans	-69	90.6	178.6	-79.5	-51.4	0	0	0	108.4	H32	D30-H32 PolarHBondContact O-N 2.95Å
31	F	31.5	Very low	32.1	Very low	149 Å²	149	122.7 Å²	122.7	65%	0.654	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	72.5	174.9	-104.5	-86.3	0	0	0	109.3	C29 I35	C29-F31 VanDerWaalsContact C-N 3.26Å; C29-F31 PolarHBondContact O-N 3.23Å; F31-I35 HydrophobicContact CD1-CD1 4.4Å; F31-I35 HydrophobicContact CD1-CG1 4.35Å
32	H	33.5	Very low	32.5	Very low	139 Å²	139	127.1 Å²	127.1	64%	0.644	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.9	-29.3	176.2	-148.1	15.4	0	0	0	113.4	D30	D30-H32 PolarHBondContact O-N 2.95Å
33	D	34	Very low	32.9	Very low	128 Å²	128	129.3 Å²	129.3	68%	0.684	68%	0.682	S	S	*	*	S	Bend	trans	-99.7	-29.9	-179	-59.4	-59.2	0	0	0	114.1	I35	D33-I35 PolarHBondContact O-N 3.01Å
34	D	33	Very low	33.2	Very low	84 Å²	84	127.9 Å²	127.9	45%	0.449	68%	0.68	S	S	.	*	H	α-helix	trans	-74.9	-14.1	-171	-75.8	-44.8	0	0	0	116.3	Q36 N37 V38	D34-Q36 VanDerWaalsContact C-N 3.33Å; D34-Q36 PolarHBondContact O-N 2.76Å; D34-N37 PolarHBondContact O-N 3.09Å; D34-V38 WeakPolarHBondContact O-CG2 3.41Å; D34-V38 PolarHBondContact O-N 3.19Å
35	I	35.7	Very low	33.4	Very low	118 Å²	118	132.5 Å²	132.5	61%	0.605	69%	0.687	S	S	*	*	H	α-helix	trans	-77.2	-17.8	-174.8	-69	179.6	0	0	0	112.9	F31 D33	F31-I35 HydrophobicContact CD1-CD1 4.4Å; F31-I35 HydrophobicContact CD1-CG1 4.35Å; D33-I35 PolarHBondContact O-N 3.01Å
36	Q	36.8	Very low	33.8	Very low	158 Å²	158	136.2 Å²	136.2	74%	0.738	70%	0.696	S	S	*	*	H	α-helix	trans	-77.8	-46	168.7	-70.9	-68.7	-17.8	0	0	111.5	D34 V38 V39	D34-Q36 VanDerWaalsContact C-N 3.33Å; D34-Q36 PolarHBondContact O-N 2.76Å; Q36-V38 PolarHBondContact O-N 3.11Å; Q36-V39 PolarHBondContact O-N 2.81Å
37	N	34.8	Very low	34.1	Very low	104 Å²	104	135.1 Å²	135.1	56%	0.556	70%	0.698	S	S	*	*	H	α-helix	trans	-74.8	-23.8	-170.3	-70.4	-33.6	0	0	0	114.7	D34 V39	D34-N37 PolarHBondContact O-N 3.09Å; N37-V39 VanDerWaalsContact C-N 3.32Å; N37-V39 PolarHBondContact O-N 3.37Å
38	V	35.9	Very low	34.4	Very low	114 Å²	114	129.1 Å²	129.1	69%	0.691	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-16.8	-179.7	173.1	0	0	0	0	113	D34 Q36	D34-V38 WeakPolarHBondContact O-CG2 3.41Å; D34-V38 PolarHBondContact O-N 3.19Å; Q36-V38 PolarHBondContact O-N 3.11Å
39	V	38.1	Very low	34.6	Very low	117 Å²	117	133.7 Å²	133.7	71%	0.709	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-26.8	-180	-178.8	0	0	0	0	112.7	Q36 N37	Q36-V39 PolarHBondContact O-N 2.81Å; N37-V39 VanDerWaalsContact C-N 3.32Å; N37-V39 PolarHBondContact O-N 3.37Å
40	Q	37.8	Very low	34.5	Very low	166 Å²	166	138.1 Å²	138.1	78%	0.776	72%	0.724	S	S	*	*	S	Bend	trans	-88	-9.4	-173	-81.5	-179.3	-29.9	0	0	115.8	R42	Q40-R42 PolarHBondContact O-N 3.02Å
41	K	36.7	Very low	34.5	Very low	160 Å²	160	139.1 Å²	139.1	70%	0.696	73%	0.73	S	S	*	*	S	Bend	trans	-95.6	27.3	-171.4	-107.9	179.4	-179.9	179.6	0	115.7
42	R	36.3	Very low	34.6	Very low	232 Å²	232	138.8 Å²	138.8	88%	0.875	73%	0.734	S	S	*	*	S	Bend	trans	-133	28.2	-171.6	-131.5	-179.4	-167.8	-177.1	4.5	119	Q40	Q40-R42 PolarHBondContact O-N 3.02Å
43	T	35.5	Very low	34.6	Very low	145 Å²	145	139.6 Å²	139.6	89%	0.89	74%	0.741	S	S	*	*			trans	-150.8	104	156.1	33.2	0	0	0	0	110.3
44	A	33.5	Very low	34.2	Very low	88 Å²	88	137.9 Å²	137.9	73%	0.727	74%	0.739	S	S	*	*			trans	-147.1	86.6	173.6	0	0	0	0	0	110.2
45	L	34.3	Very low	34.1	Very low	167 Å²	167	140 Å²	140	87%	0.874	75%	0.751	S	S	*	*			trans	-169.1	84.2	162.8	-106.2	162.4	0	0	0	109.5
46	M	36	Very low	33.9	Very low	168 Å²	168	142.1 Å²	142.1	83%	0.828	76%	0.758	S	S	*	*			trans	23.2	154.9	140.1	-58.5	-61.2	153.5	0	0	121.6
47	P	35.6	Very low	33.7	Very low	122 Å²	122	140.9 Å²	140.9	79%	0.792	76%	0.762	S	S	*	*			cis	-142.3	176	-41.1	39.9	-23.8	0	0	0	113.4
48	G	32.8	Very low	33.5	Very low	67 Å²	67	140.3 Å²	140.3	69%	0.691	77%	0.766	S	S	*	*			trans	143	131.2	153.5	0	0	0	0	0	116.7
49	Q	33.5	Very low	33.2	Very low	193 Å²	193	141.9 Å²	141.9	90%	0.902	77%	0.771	S	S	*	*			trans	57.8	112.4	165.7	-61	179.9	-88.8	0	0	115.6
50	M	27.3	Very low	32.8	Very low	170 Å²	170	147.3 Å²	147.3	84%	0.837	78%	0.78	S	S	*	*				48	130.2	63.5	-70.2	174.6	158.7	0	0	112.4
51	D	32.1	Very low	32.4	Very low	133 Å²	133	147.1 Å²	147.1	71%	0.711	78%	0.779	S	S	*	*			cis	-161	-178.3	28	-142.4	-28	0	0	0	114
52	L	32.5	Very low	32.3	Very low	141 Å²	141	145 Å²	145	74%	0.738	78%	0.781	S	S	*	*			trans	86.4	121.5	152	-73.3	160.3	0	0	0	122.3
53	I	33.9	Very low	32.1	Very low	156 Å²	156	140.8 Å²	140.8	80%	0.8	78%	0.775	S	S	*	*			trans	81.3	82	148.6	-54.5	160	0	0	0	117.5
54	S	27.1	Very low	31.9	Very low	92 Å²	92	139.7 Å²	139.7	64%	0.643	77%	0.771	S	S	*	*			trans	-80.5	157.2	141.2	53.1	0	0	0	0	111.1
55	N	30.4	Very low	31.8	Very low	130 Å²	130	142.9 Å²	142.9	70%	0.695	77%	0.774	S	S	*	*				172	153.1	116.5	-98.3	-50.5	0	0	0	116.9
56	Q	30.2	Very low	31.6	Very low	161 Å²	161	141.7 Å²	141.7	75%	0.752	77%	0.767	S	S	*	*			trans	56.8	105.4	144.4	-65.3	160.9	34.4	0	0	121.1
57	T	32.9	Very low	31.3	Very low	133 Å²	133	141.6 Å²	141.6	82%	0.816	77%	0.77	S	S	*	*				-172	112.2	104.3	41	0	0	0	0	106.9
58	S	30.1	Very low	31.1	Very low	91 Å²	91	143.2 Å²	143.2	64%	0.636	77%	0.766	S	S	*	*				77.7	109.2	57.7	76.8	0	0	0	0	115.1
59	N	30.7	Very low	31.3	Very low	148 Å²	148	144.4 Å²	144.4	79%	0.791	76%	0.762	S	S	*	*			trans	65.7	119.3	155.9	-52.1	-19.9	0	0	0	119.4
60	Y	30.1	Very low	31.1	Very low	231 Å²	231	142.3 Å²	142.3	91%	0.906	76%	0.757	S	S	*	*				-173.8	138	111.2	-106.6	-75	0	0	0	111.7
61	H	28.8	Very low	31.2	Very low	162 Å²	162	140.9 Å²	140.9	75%	0.75	75%	0.752	S	S	*	*			trans	-87.2	149.4	166.8	-102.1	-79.4	0	0	0	110
62	P	34.3	Very low	30.9	Very low	115 Å²	115	140.3 Å²	140.3	75%	0.747	75%	0.754	S	S	*	*				-135.9	154.7	92.7	39.7	-28.1	0	0	0	111.9
63	L	31.8	Very low	30.9	Very low	144 Å²	144	140.2 Å²	140.2	75%	0.754	76%	0.759	S	S	*	*				66.3	130.2	50.4	-72.8	177.7	0	0	0	114.8
64	P	32.5	Very low	30.6	Very low	122 Å²	122	138.1 Å²	138.1	79%	0.792	76%	0.756	S	S	*	*			trans	-94	142.7	-167.6	36.4	-34.9	0	0	0	113.5
65	I	31.2	Very low	30.6	Very low	154 Å²	154	142 Å²	142	79%	0.79	76%	0.764	S	S	*	*			trans	-134.7	117.3	173.8	-59.2	-177.8	0	0	0	111.6
66	I	30	Very low	30.6	Very low	143 Å²	143	145 Å²	145	73%	0.733	77%	0.771	S	S	*	*			trans	12.1	117.5	142.2	-49.2	172.4	0	0	0	116.6
67	N	30.2	Very low	30.5	Very low	165 Å²	165	141.9 Å²	141.9	88%	0.882	77%	0.767	S	S	*	*			trans	-97.3	110.4	158	-96.5	-38.3	0	0	0	109.8
68	H	31.4	Very low	30.3	Very low	156 Å²	156	145.1 Å²	145.1	72%	0.722	77%	0.77	S	S	*	*			trans	-130.5	146.7	158.3	-104.3	-91.7	0	0	0	109.2
69	P	36.9	Very low	30.2	Very low	93 Å²	93	146.3 Å²	146.3	60%	0.604	78%	0.777	S	S	*	*			trans	-91.7	147	-162.6	34.7	-34.9	0	0	0	113.3
70	N	29.3	Very low	30	Very low	148 Å²	148	141.9 Å²	141.9	79%	0.791	77%	0.767	S	S	*	*				-177.9	161.7	125.2	-105.7	-44	0	0	0	116.2
71	L	28.2	Very low	30	Very low	141 Å²	141	137.4 Å²	137.4	74%	0.738	76%	0.764	S	S	*	*			trans	71.4	129.5	149.1	-72.6	159.8	0	0	0	122.9
72	T	26.7	Very low	30	Very low	121 Å²	121	137.4 Å²	137.4	74%	0.742	76%	0.762	S	S	*	*			trans	59.1	126.2	146.1	52.6	0	0	0	0	119.7
73	V	31.4	Very low	29.7	Very low	139 Å²	139	139.4 Å²	139.4	84%	0.842	76%	0.759	S	S	*	*				-148.5	127.3	70.1	150.2	0	0	0	0	108.2
74	C	29.3	Very low	29.5	Very low	112 Å²	112	139 Å²	139	76%	0.757	76%	0.758	S	S	*	*			cis	106.7	149.5	48.1	-160.1	0	0	0	0	111
75	Q	26.4	Very low	29.3	Very low	172 Å²	172	137.7 Å²	137.7	80%	0.804	75%	0.75	S	S	*	*			trans	-96.2	149.4	-160.8	-56.6	152.5	-74.2	0	0	114.5
76	K	30.2	Very low	29.2	Very low	194 Å²	194	135.1 Å²	135.1	84%	0.843	75%	0.746	S	S	*	*			trans	175.9	130.7	137.4	-91.1	146.5	-171.3	178.9	0	107.2
77	S	27.5	Very low	29.4	Very low	95 Å²	95	133.4 Å²	133.4	66%	0.664	75%	0.746	S	S	*	*			cis	75.8	144.7	33.1	88.8	0	0	0	0	115.1
78	F	28.6	Very low	29.4	Very low	202 Å²	202	133.2 Å²	133.2	89%	0.886	75%	0.745	S	S	*	*			trans	84.1	164.1	-176.9	-82.2	-94	0	0	0	119.8
79	C	28.1	Very low	29.5	Very low	115 Å²	115	129.8 Å²	129.8	78%	0.777	74%	0.744	S	S	*	*			trans	-51.6	160.5	-172	-53.3	0	0	0	0	114.5
80	G	28	Very low	29.4	Very low	56 Å²	56	130.4 Å²	130.4	58%	0.577	75%	0.751	S	S	*	*			cis	101.8	137.6	16.9	0	0	0	0	0	111.2
81	T	30.1	Very low	29.4	Very low	137 Å²	137	128.7 Å²	128.7	84%	0.84	75%	0.75	S	S	*	*			trans	68.6	150.5	-170.4	75.3	0	0	0	0	114
82	F	27.4	Very low	30	Very low	162 Å²	162	127.9 Å²	127.9	71%	0.711	75%	0.753	S	S	*	*			cis	-160.1	169.9	-17.4	-135.4	-77.6	0	0	0	107.8
83	F	28.8	Very low	30.1	Very low	157 Å²	157	125.6 Å²	125.6	69%	0.689	75%	0.754	S	S	*	*			trans	63.6	111.4	158.7	-74.5	-57.3	0	0	0	117.6
84	D	27.6	Very low	30.2	Very low	135 Å²	135	125.2 Å²	125.2	72%	0.722	76%	0.756	S	S	*	*				89.4	156.8	95	-92.7	26	0	0	0	112.8
85	C	27.9	Very low	30.3	Very low	94 Å²	94	124.6 Å²	124.6	64%	0.635	76%	0.759	S	S	*	*			cis	-147.8	129.2	4.1	-135.8	0	0	0	0	108
86	S	28.9	Very low	30.7	Very low	100 Å²	100	121.4 Å²	121.4	70%	0.699	76%	0.762	S	S	*	*				92.4	157.8	102.2	-78.3	0	0	0	0	118.3
87	S	34.7	Very low	31	Very low	107 Å²	107	117.8 Å²	117.8	75%	0.748	76%	0.762	S	S	*	*			trans	82.6	121	175.5	-48.1	0	0	0	0	116.2
88	N	30.1	Very low	31	Very low	161 Å²	161	118.6 Å²	118.6	86%	0.861	77%	0.767	S	S	*	*				85.3	135.7	50.5	-69.7	-18	0	0	0	112.9
89	A	33.5	Very low	31.7	Very low	84 Å²	84	113.9 Å²	113.9	69%	0.694	76%	0.757	S	S	*	*			cis	-161.2	171	-0.3	0	0	0	0	0	114.6
90	S	33.9	Very low	32	Very low	106 Å²	106	114.4 Å²	114.4	74%	0.741	76%	0.756	S	S	*	*			trans	49.6	108.7	143.7	60.1	0	0	0	0	123.9
91	S	29.5	Very low	32.2	Very low	112 Å²	112	117 Å²	117	78%	0.783	76%	0.764	S	S	*	*				10.4	171.2	104.8	-49.2	0	0	0	0	121.4
92	P	40.5	Very low	32.4	Very low	124 Å²	124	118.6 Å²	118.6	81%	0.805	76%	0.762	S	S	*	*			cis	-145.7	170.7	-44.2	41	-23.8	0	0	0	116.5
93	G	30.2	Very low	32.7	Very low	74 Å²	74	115.3 Å²	115.3	76%	0.763	76%	0.759	S	S	*	*			trans	82.9	143.9	132.8	0	0	0	0	0	123.4
94	C	32.4	Very low	32.9	Very low	130 Å²	130	111.4 Å²	111.4	88%	0.878	76%	0.763	S	S	*	*			trans	175.4	130.3	151.1	-91.8	0	0	0	0	107.8
95	A	31.2	Very low	33.2	Very low	99 Å²	99	110.2 Å²	110.2	82%	0.818	76%	0.76	S	S	*	*				78.5	139.6	66.1	0	0	0	0	0	113.7
96	A	35.9	Very low	33.4	Very low	105 Å²	105	116.3 Å²	116.3	87%	0.868	77%	0.772	S	S	*	*			cis	-114.7	-136.6	1.5	0	0	0	0	0	111.8
97	S	35.3	Very low	33.6	Very low	119 Å²	119	114.6 Å²	114.6	83%	0.832	77%	0.77	S	S	*	*			cis	-155.2	-171	8.3	64.2	0	0	0	0	112.1
98	S	28.9	Very low	33.4	Very low	112 Å²	112	117.5 Å²	117.5	78%	0.783	78%	0.775	S	S	*	*			trans	-165.9	-157.9	-175.2	-145.5	0	0	0	0	109
99	P	42.2	Very low	33.6	Very low	103 Å²	103	117.6 Å²	117.6	67%	0.669	77%	0.774	S	S	*	*			cis	-144.1	-162	-4.3	31.4	-4	0	0	0	117
100	V	34	Very low	33.6	Very low	125 Å²	125	122.3 Å²	122.3	76%	0.758	78%	0.782	S	S	*	*			trans	69.8	138.9	160.5	-121.1	0	0	0	0	117.6
101	C	32.5	Very low	34.3	Very low	111 Å²	111	122.1 Å²	122.1	75%	0.75	78%	0.778	S	S	*	*			cis	-144.1	-174.9	16.4	-39.2	0	0	0	0	111.1
102	H	34.2	Very low	34.8	Very low	171 Å²	171	122.1 Å²	122.1	79%	0.792	78%	0.775	S	S	*	*			cis	-157.8	-160.8	-4.2	-151.9	-114.9	0	0	0	111.9
103	S	35	Very low	34.5	Very low	93 Å²	93	124.9 Å²	124.9	65%	0.65	78%	0.777	S	S	*	*			trans	-49.6	156.1	171.8	56.4	0	0	0	0	117.6
104	G	32.9	Very low	34.7	Very low	75 Å²	75	125.7 Å²	125.7	77%	0.773	77%	0.771	S	S	*	*			cis	149.5	-175	9.4	0	0	0	0	0	110.1
105	V	34.1	Very low	34.7	Very low	110 Å²	110	124.7 Å²	124.7	67%	0.667	77%	0.766	S	S	*	*			cis	-158.4	163	-6.4	-165.5	0	0	0	0	108.3
106	Y	32.3	Very low	34.9	Very low	222 Å²	222	124.5 Å²	124.5	87%	0.871	76%	0.758	S	S	*	*			trans	73.4	132.8	168.7	-55.9	-71.3	0	0	0	119.7
107	G	32.8	Very low	34.8	Very low	64 Å²	64	127.3 Å²	127.3	66%	0.66	76%	0.757	S	S	*	*			cis	166.4	159.4	-14.3	0	0	0	0	0	116.3
108	I	31.2	Very low	34.9	Very low	167 Å²	167	126.7 Å²	126.7	86%	0.856	75%	0.75	S	S	*	*			trans	61.4	143.3	158.9	12.4	-178.4	0	0	0	117.8
109	I	33.7	Very low	35.1	Very low	163 Å²	163	127.4 Å²	127.4	84%	0.836	75%	0.75	S	S	*	*			cis	-135	161.5	17.2	-59.6	175.8	0	0	0	111.6
110	E	32.4	Very low	34.5	Very low	184 Å²	184	126.5 Å²	126.5	86%	0.86	75%	0.751	S	S	*	*			trans	-106.4	173.5	-169.7	-85.6	-170.4	129.6	0	0	117.6
111	P	49.6	Very low	34.5	Very low	101 Å²	101	129.3 Å²	129.3	66%	0.656	76%	0.756	S	S	*	*			trans	-113.1	-175	178.7	43.9	-35	0	0	0	114.8
112	P	39.8	Very low	34.5	Very low	112 Å²	112	129 Å²	129	73%	0.727	75%	0.751	S	S	*	*			trans	-114.9	149.9	152.4	37.1	-27.1	0	0	0	111.8
113	Q	33.7	Very low	34.3	Very low	182 Å²	182	128.2 Å²	128.2	85%	0.85	75%	0.752	S	S	*	*			cis	73.4	138.5	39.9	-61.4	-152.2	43	0	0	113.5
114	S	35.1	Very low	34.2	Very low	92 Å²	92	128 Å²	128	64%	0.643	76%	0.755	S	S	*	*			cis	-164.2	174	7.1	51.6	0	0	0	0	113
115	S	33	Very low	34.1	Very low	109 Å²	109	131.8 Å²	131.8	76%	0.762	76%	0.757	S	S	*	*			trans	68.6	156.2	149.4	71.3	0	0	0	0	120.2
116	S	34	Very low	34	Very low	94 Å²	94	131.3 Å²	131.3	66%	0.657	76%	0.758	S	S	*	*			cis	-170.1	121.6	-12.2	40.8	0	0	0	0	115.9
117	I	33.9	Very low	34.1	Very low	165 Å²	165	124.3 Å²	124.3	85%	0.846	75%	0.747	S	S	*	*			trans	64.9	-168.7	141.8	-24.6	171.7	0	0	0	117.9
118	P	36.9	Very low	34.2	Very low	106 Å²	106	129.4 Å²	129.4	69%	0.688	75%	0.753	S	S	*	*				-131.1	-176.6	-112	41.6	-23.5	0	0	0	121.3
119	T	33.4	Very low	34.3	Very low	127 Å²	127	129.5 Å²	129.5	78%	0.779	75%	0.749	S	S	*	*			trans	101.1	102.9	144.1	1.2	0	0	0	0	122.6
120	A	30.8	Very low	34.1	Very low	84 Å²	84	127.5 Å²	127.5	69%	0.694	74%	0.744	S	S	*	*				53.3	160.5	128.4	0	0	0	0	0	124.9
121	Q	34.4	Very low	34	Very low	184 Å²	184	123.3 Å²	123.3	86%	0.86	74%	0.736	S	S	*	*			trans	75.7	148	166.1	-59.6	-163.8	18.1	0	0	117
122	T	30.9	Very low	33.1	Very low	105 Å²	105	129.7 Å²	129.7	64%	0.644	75%	0.748	S	S	*	*			cis	-168.5	153	-13.1	-95.9	0	0	0	0	111.1
123	L	30.9	Very low	32.7	Very low	153 Å²	153	131 Å²	131	80%	0.801	75%	0.749	S	S	*	*			trans	62	121.1	162.8	-81.8	165.6	0	0	0	123
124	A	32.5	Very low	33.3	Very low	88 Å²	88	126.5 Å²	126.5	73%	0.727	74%	0.736	S	S	*	*				162.5	111.4	126.3	0	0	0	0	0	110.2
125	L	31.3	Very low	33.3	Very low	156 Å²	156	129 Å²	129	82%	0.817	74%	0.742	S	S	*	*				63	129.4	82.4	-66.4	170.9	0	0	0	114.7
126	S	31.5	Very low	33.3	Very low	99 Å²	99	129.8 Å²	129.8	69%	0.692	74%	0.742	S	S	*	*			cis	-168.7	143.6	-5.6	-166.7	0	0	0	0	113.8
127	A	34.7	Very low	33.5	Very low	75 Å²	75	131.5 Å²	131.5	62%	0.62	75%	0.749	S	S	*	*			trans	46.9	118.2	141.6	0	0	0	0	0	122.1
128	H	34.4	Very low	33.5	Very low	172 Å²	172	129.7 Å²	129.7	80%	0.796	75%	0.745	S	S	*	*				84.9	127.5	80.9	-80.1	-67.1	0	0	0	114.9
129	H	33.1	Very low	33.6	Very low	168 Å²	168	130.1 Å²	130.1	78%	0.778	75%	0.748	S	S	*	*				68.5	145.8	93.3	-115	-110.1	0	0	0	112.9
130	V	30.7	Very low	33.7	Very low	121 Å²	121	134 Å²	134	73%	0.733	76%	0.757	S	S	*	*			cis	-152.5	168.1	42.5	-178.3	0	0	0	0	111.1
131	S	29.2	Very low	33.8	Very low	97 Å²	97	133.6 Å²	133.6	68%	0.678	76%	0.761	S	S	*	*			trans	-74.6	163.2	171.9	54	0	0	0	0	115.9
132	Y	31.9	Very low	33.6	Very low	235 Å²	235	134.9 Å²	134.9	92%	0.922	76%	0.764	S	S	*	*			trans	-154.6	162.1	145	-117.9	-82.2	0	0	0	112.8
133	N	31.4	Very low	33.7	Very low	138 Å²	138	133.5 Å²	133.5	74%	0.738	76%	0.763	S	S	*	*			trans	-164.5	161.6	-175.8	-166	44.5	0	0	0	106.6
134	P	44.3	Very low	33.9	Very low	89 Å²	89	132.2 Å²	132.2	58%	0.578	76%	0.762	S	S	*	*			cis	-122.6	-170.9	-4.9	21.5	5	0	0	0	112.6
135	D	36.2	Very low	33.7	Very low	145 Å²	145	136.4 Å²	136.4	78%	0.775	77%	0.766	S	S	*	*				171.4	156.6	111.8	-90.8	-15.6	0	0	0	116.8
136	T	33	Very low	33.8	Very low	125 Å²	125	136.2 Å²	136.2	77%	0.767	77%	0.766	S	S	*	*			trans	-36.2	143.5	179	-23	0	0	0	0	119.8
137	V	37.3	Very low	33.8	Very low	130 Å²	130	139.3 Å²	139.3	79%	0.788	76%	0.763	S	S	*	*				176	134.9	118	151.5	0	0	0	0	114
138	V	34.8	Very low	33.7	Very low	126 Å²	126	143.4 Å²	143.4	76%	0.764	77%	0.771	S	S	*	*			trans	6.4	138.6	158.4	-170.5	0	0	0	0	121.6
139	P	38.5	Very low	33.7	Very low	115 Å²	115	143.7 Å²	143.7	75%	0.747	77%	0.772	S	S	*	*			trans	-102.7	157.4	177.8	39.9	-34.9	0	0	0	116.1
140	Q	35.5	Very low	33.6	Very low	209 Å²	209	139.4 Å²	139.4	98%	0.977	77%	0.774	S	S	*	*			trans	-167.2	154.3	156.2	-110.7	176.3	31.8	0	0	111.1
141	G	32.6	Very low	33.7	Very low	75 Å²	75	141.4 Å²	141.4	77%	0.773	78%	0.78	S	S	*	*			trans	131.1	115.4	157.5	0	0	0	0	0	119.5
142	F	31.4	Very low	34.1	Very low	211 Å²	211	141.5 Å²	141.5	93%	0.925	78%	0.779	S	S	*	*			trans	-45.2	166.3	156.9	-65.3	-94.5	0	0	0	115.6
143	A	33.2	Very low	34	Very low	76 Å²	76	135.9 Å²	135.9	63%	0.628	77%	0.773	S	S	*	*			cis	-175.8	-169.6	-16.2	0	0	0	0	0	109.9
144	T	33.7	Very low	34	Very low	127 Å²	127	132.9 Å²	132.9	78%	0.779	77%	0.768	S	S	*	*			trans	64.3	121.1	173.9	59.9	0	0	0	0	115.9
145	E	29.7	Very low	33.4	Very low	175 Å²	175	136.3 Å²	136.3	82%	0.818	78%	0.776	S	S	*	*				78.9	95.2	51	-68.5	-153.4	133.7	0	0	115.2
146	N	33.9	Very low	33	Very low	152 Å²	152	138.2 Å²	138.2	81%	0.813	77%	0.772	S	S	*	*				179.6	144.7	121	-92.8	-61.7	0	0	0	107.5
147	R	29.6	Very low	32.8	Very low	164 Å²	164	138.5 Å²	138.5	62%	0.619	77%	0.768	S	S	*	*			cis	134.5	146.6	-0	179.2	172.2	-179.2	163	1.1	105.7
148	M	33.9	Very low	32.4	Very low	162 Å²	162	137.3 Å²	137.3	80%	0.798	76%	0.761	S	S	*	*			trans	72.1	157.4	-173.7	-45.5	-165.7	-175.2	0	0	114.7
149	H	33.4	Very low	32.2	Very low	178 Å²	178	138.5 Å²	138.5	82%	0.824	76%	0.758	S	S	*	*			cis	-169.9	137.9	-47.8	-103.6	-61.3	0	0	0	105.4
150	G	32.4	Very low	31.8	Very low	78 Å²	78	138.1 Å²	138.1	80%	0.804	76%	0.758	S	S	*	*			trans	162	116.6	176.8	0	0	0	0	0	111.6
151	N	32	Very low	31.6	Very low	162 Å²	162	136.1 Å²	136.1	87%	0.866	75%	0.749	S	S	*	*			trans	-103.8	178.5	177.5	-126.9	4.1	0	0	0	109.4
152	P	38	Very low	31.4	Very low	100 Å²	100	137.3 Å²	137.3	65%	0.649	75%	0.745	S	S	*	*			trans	-122.8	-155.4	-135	41	-22.6	0	0	0	112.8
153	S	30.4	Very low	31.4	Very low	116 Å²	116	131.4 Å²	131.4	81%	0.811	74%	0.736	S	S	*	*			trans	81.8	147.1	170.1	-54.5	0	0	0	0	116
154	A	30.3	Very low	31.3	Very low	75 Å²	75	135.7 Å²	135.7	62%	0.62	74%	0.743	S	S	*	*			cis	-167.8	158.9	-22.7	0	0	0	0	0	109.7
155	H	31.5	Very low	31.1	Very low	161 Å²	161	135.9 Å²	135.9	75%	0.745	74%	0.739	S	S	*	*			trans	67.6	159.5	153.5	-72.6	-21	0	0	0	117.3
156	R	27.9	Very low	31	Very low	185 Å²	185	132.7 Å²	132.7	70%	0.698	74%	0.743	S	S	*	*			cis	-164.3	145.9	-6.4	-115.7	166.5	-176.5	-119.9	4.4	110
157	L	28.6	Very low	30.8	Very low	132 Å²	132	129.2 Å²	129.2	69%	0.691	74%	0.743	S	S	*	*			trans	63.3	173	143.6	-59.5	168.2	0	0	0	116.4
158	T	29.1	Very low	30.6	Very low	104 Å²	104	124.8 Å²	124.8	64%	0.638	75%	0.748	S	S	*	*			cis	-166.1	176.8	-15	20.2	0	0	0	0	108.6
159	H	30.1	Very low	30.3	Very low	152 Å²	152	126.2 Å²	126.2	70%	0.704	75%	0.75	S	S	*	*			cis	-157.2	144	1.5	-131.9	-53.3	0	0	0	111.3
160	S	30.1	Very low	30	Very low	106 Å²	106	124.5 Å²	124.5	74%	0.741	74%	0.744	S	S	*	*			trans	-160.7	122.4	148.5	23.8	0	0	0	0	109.9
161	H	31.1	Very low	29.7	Very low	167 Å²	167	128.8 Å²	128.8	77%	0.773	74%	0.741	S	S	*	*				74.2	129.2	73.1	-68	-60.7	0	0	0	112.2
162	S	30	Very low	29.4	Very low	100 Å²	100	128.6 Å²	128.6	70%	0.699	74%	0.735	S	S	*	*			cis	-164.8	154.7	6	50.4	0	0	0	0	113.3
163	A	31.6	Very low	28.9	Very low	88 Å²	88	129 Å²	129	73%	0.727	74%	0.74	S	S	*	*			trans	60.7	166.6	149.3	0	0	0	0	0	119.7
164	Q	30	Very low	28.8	Very low	166 Å²	166	131.1 Å²	131.1	78%	0.776	74%	0.741	S	S	*	*				-164.3	151.3	-57.8	-121.2	174.6	-88.7	0	0	109.2
165	D	29	Very low	28.9	Very low	130 Å²	130	135.5 Å²	135.5	70%	0.695	75%	0.747	S	S	*	*			trans	57.9	116.8	151.8	-56.1	-36.6	0	0	0	123.4
166	A	28.6	Very low	29	Very low	109 Å²	109	133.2 Å²	133.2	90%	0.901	75%	0.746	S	S	*	*			trans	73.6	133.9	133	0	0	0	0	0	122.5
167	G	28.6	Very low	29.3	Very low	79 Å²	79	128.8 Å²	128.8	81%	0.814	74%	0.743	S	S	*	*			trans	128.4	75.6	138.2	0	0	0	0	0	120.5
168	G	26.5	Very low	29.4	Very low	71 Å²	71	127.9 Å²	127.9	73%	0.732	75%	0.745	S	S	*	*			trans	68.8	152.6	132.3	0	0	0	0	0	123.6
169	F	28.1	Very low	29.6	Very low	192 Å²	192	126.8 Å²	126.8	84%	0.842	76%	0.755	S	S	*	*			trans	73	103.5	153.6	-73.1	-82.1	0	0	0	123.1
170	M	25.9	Very low	29.7	Very low	142 Å²	142	128.1 Å²	128.1	70%	0.7	76%	0.762	S	S	*	*				73.8	129.4	122.8	-92	-175.6	176.1	0	0	123.4
171	F	25.4	Very low	29.8	Very low	167 Å²	167	129.8 Å²	129.8	73%	0.732	77%	0.767	S	S	*	*			trans	65.3	154.1	157.1	-69.7	-61.4	0	0	0	116.5
172	Q	26	Very low	29.7	Very low	158 Å²	158	128.3 Å²	128.3	74%	0.738	76%	0.764	S	S	*	*			cis	-149.3	-176.2	2.6	-143.7	151.5	62.6	0	0	110.7
173	S	28.5	Very low	29.8	Very low	108 Å²	108	131.6 Å²	131.6	76%	0.755	77%	0.768	S	S	*	*			trans	70.7	141.5	169.4	74.1	0	0	0	0	117.5
174	L	28.5	Very low	29.7	Very low	161 Å²	161	137.6 Å²	137.6	84%	0.843	77%	0.772	S	S	*	*			cis	-148.2	166.4	-6.7	-116.6	164.3	0	0	0	111.8
175	F	31.1	Very low	29.8	Very low	168 Å²	168	140.5 Å²	140.5	74%	0.737	78%	0.778	S	S	*	*			trans	-82.7	178.2	-171.2	-84.8	-84.7	0	0	0	113.4
176	P	34.5	Very low	29.8	Very low	112 Å²	112	137.6 Å²	137.6	73%	0.727	78%	0.778	S	S	*	*			cis	-139.6	178.8	23.4	39.7	-19	0	0	0	117.5
177	S	32.9	Very low	30	Very low	92 Å²	92	138.1 Å²	138.1	64%	0.643	78%	0.775	S	S	*	*			cis	-165.9	147.7	-29	-89.3	0	0	0	0	109.4
178	P	32.5	Very low	30.1	Very low	113 Å²	113	142.7 Å²	142.7	73%	0.734	78%	0.775	S	S	*	*			trans	-85.8	130.8	173.6	33.4	-32.3	0	0	0	112.3	Q180	P178-Q180 PolarHBondContact O-N 3Å
179	G	32.5	Very low	30.4	Very low	82 Å²	82	147.6 Å²	147.6	85%	0.845	78%	0.784	S	S	*	*			trans	-80.5	110.7	178.1	0	0	0	0	0	113.2
180	Q	32.9	Very low	30.7	Very low	180 Å²	180	144.2 Å²	144.2	84%	0.841	78%	0.778	S	S	*	*			trans	-84.6	122.1	163.9	-68.8	-176.3	-6.2	0	0	109.8	P178	P178-Q180 PolarHBondContact O-N 3Å
181	V	31.5	Very low	31.2	Very low	141 Å²	141	143.3 Å²	143.3	86%	0.855	78%	0.783	S	S	*	*			trans	-92.3	103.2	162.5	177.8	0	0	0	0	107.8
182	L	28.6	Very low	31.6	Very low	136 Å²	136	143.5 Å²	143.5	71%	0.712	79%	0.792	S	S	*	*			trans	-98	104	172.4	-164.2	169	0	0	0	107.8
183	H	32.8	Very low	31.9	Very low	169 Å²	169	143 Å²	143	78%	0.782	79%	0.79	S	S	*	*			trans	-126.2	129.7	168.8	-134.6	-91	0	0	0	110.7
184	R	30.3	Very low	32	Very low	213 Å²	213	146.4 Å²	146.4	80%	0.804	80%	0.797	S	S	*	*			trans	-79.1	131.2	-176.6	-59.8	174.5	179.5	176.6	-1.3	110.4
185	Y	31.3	Very low	32	Very low	228 Å²	228	144.5 Å²	144.5	89%	0.894	78%	0.784	S	S	*	*			trans	-171.8	127.3	134.2	-83.4	-65.9	0	0	0	104.7
186	G	29.3	Very low	31.9	Very low	68 Å²	68	145.4 Å²	145.4	70%	0.701	79%	0.793	S	S	*	*			cis	90.8	76	18.3	0	0	0	0	0	109
187	S	32.4	Very low	31.8	Very low	121 Å²	121	147.9 Å²	147.9	85%	0.846	79%	0.794	S	S	*	*				-148.5	172.4	98.7	50.9	0	0	0	0	115.1
188	H	31.6	Very low	31.5	Very low	175 Å²	175	152 Å²	152	81%	0.81	80%	0.803	S	S	*	*			trans	-77.5	155.5	-168.9	-66.5	-129.7	0	0	0	114.4
189	L	31.4	Very low	31.4	Very low	174 Å²	174	154.6 Å²	154.6	91%	0.911	81%	0.809	S	S	*	*				-161.5	150.3	116.9	-102.1	165.8	0	0	0	110
190	T	34.7	Very low	31.4	Very low	120 Å²	120	155.7 Å²	155.7	74%	0.736	80%	0.804	S	S	*	*			trans	-104.7	153.1	-163.7	39.1	0	0	0	0	114.4
191	P	36.5	Very low	31.7	Very low	123 Å²	123	152.9 Å²	152.9	80%	0.799	80%	0.801	S	S	*	*			trans	-84.9	164.4	179.7	36.2	-36.3	0	0	0	112.5
192	N	34.3	Very low	31.8	Very low	171 Å²	171	150.7 Å²	150.7	91%	0.914	79%	0.79	S	S	*	*			trans	-128.6	147.5	173	-130.7	-24	0	0	0	112.3
193	H	31.7	Very low	31.9	Very low	149 Å²	149	145.4 Å²	145.4	69%	0.69	77%	0.768	S	S	*	*			trans	-83.1	134.2	-165.3	-122.3	-124.7	0	0	0	113.3	Q195	H193-Q195 PolarHBondContact ND1-OE1 3Å
194	I	31.8	Very low	31.8	Very low	178 Å²	178	141.5 Å²	141.5	91%	0.913	75%	0.753	S	S	*	*			trans	-134.7	142.9	139.8	-65.6	-170.7	0	0	0	107.4
195	Q	27.1	Very low	31.9	Very low	122 Å²	122	139.1 Å²	139.1	57%	0.57	76%	0.755	S	S	*	*			trans	-129	128.5	-150.2	174.2	176.9	-23.7	0	0	112.3	H193	H193-Q195 PolarHBondContact ND1-OE1 3Å
196	M	30.1	Very low	31.8	Very low	186 Å²	186	138.8 Å²	138.8	92%	0.916	75%	0.753	S	S	*	*			trans	-140.5	142.9	164.7	-92.6	-68.6	177.5	0	0	109.2
197	H	31.7	Very low	31.8	Very low	165 Å²	165	139 Å²	139	76%	0.764	76%	0.755	S	S	*	*			trans	-74.8	155.5	-150	-89.1	-117.4	0	0	0	118.1
198	Q	27.3	Very low	31.9	Very low	177 Å²	177	138.5 Å²	138.5	83%	0.827	75%	0.749	S	S	*	*			trans	-79.1	150.3	168.9	-53.4	163	-20.9	0	0	112.1
199	I	30.7	Very low	31.8	Very low	168 Å²	168	138.3 Å²	138.3	86%	0.862	75%	0.753	S	S	*	*			trans	-144.9	159.8	137.1	-60	-169.3	0	0	0	107
200	S	30.7	Very low	31.7	Very low	105 Å²	105	135.4 Å²	135.4	73%	0.734	74%	0.743	S	S	*	*			trans	-134.4	-140.3	-173.9	-60.4	0	0	0	0	115.6
201	P	39.5	Very low	31.5	Very low	121 Å²	121	134.6 Å²	134.6	79%	0.786	74%	0.742	S	S	*	*			trans	-107.1	-172.9	-136.8	22.4	3	0	0	0	114.4
202	P	33.3	Very low	31.3	Very low	96 Å²	96	133.4 Å²	133.4	62%	0.623	73%	0.732	S	S	*	*			cis	-133.9	-119.1	15.1	41.2	-18.9	0	0	0	115.9
203	G	32.5	Very low	31.2	Very low	24 Å²	24	130.6 Å²	130.6	25%	0.247	72%	0.723	C	S	.	*			trans	166.1	-125.5	-176	0	0	0	0	0	116	R397 N398	G203-R397 PolarHBondContact O-NE 3.3Å; G203-R397 PolarHBondContact O-NH2 2.73Å; G203-N398 WeakPolarHBondContact CA-ND2 3.16Å; G203-N398 WeakPolarHBondContact CA-OD1 3.49Å
204	N	30	Very low	31.2	Very low	88 Å²	88	128.5 Å²	128.5	47%	0.471	72%	0.721	S	S	.	*			trans	101.2	147.9	-173.1	-100.6	6.8	0	0	0	113.1	R397 N398	N204-R397 VanDerWaalsContact CG-NH2 3.35Å; N204-R397 VanDerWaalsContact N-NE 3.13Å; N204-R397 PolarHBondContact OD1-NE 2.91Å; N204-R397 PolarHBondContact OD1-NH1 2.79Å; N204-R397 VanDerWaalsContact OD1-NH1 3.1Å; N204-N398 PolarHBondContact N-ND2 2.8Å; N204-N398 PolarHBondContact N-OD1 3.47Å; N204-N398 PolarHBondContact O-ND2 3.36Å; N204-N398 PolarHBondContact O-OD1 3.38Å
205	I	31.8	Very low	31.3	Very low	162 Å²	162	125.2 Å²	125.2	83%	0.831	71%	0.711	S	S	*	*			trans	173.2	162.7	133	-89	157.2	0	0	0	111.3
206	Y	30.6	Very low	31.4	Very low	221 Å²	221	129.2 Å²	129.2	87%	0.867	72%	0.722	S	S	*	*			trans	-84.8	156.7	-162.7	-72.2	-114.1	0	0	0	116.5
207	G	29.2	Very low	31.4	Very low	72 Å²	72	130 Å²	130	74%	0.742	72%	0.721	S	S	*	*			trans	83.4	177.1	137.5	0	0	0	0	0	118.7
208	P	33.6	Very low	31.4	Very low	111 Å²	111	126.9 Å²	126.9	72%	0.721	72%	0.718	S	S	*	*			cis	-106.1	163.6	0.1	38.7	-32	0	0	0	114.5	V210	P208-V210 HydrophobicContact CG-CG2 4.13Å; P208-V210 PolarHBondContact O-N 3.1Å
209	L	28.6	Very low	31.6	Very low	171 Å²	171	126.9 Å²	126.9	90%	0.895	72%	0.723	S	S	*	*			trans	-73.7	115.3	158.2	-74.5	163.9	0	0	0	108.8	S211	L209-S211 PolarHBondContact O-N 2.93Å
210	V	31	Very low	31.7	Very low	114 Å²	114	122.3 Å²	122.3	69%	0.691	72%	0.717	S	S	*	*			trans	-92.6	82.2	173.4	-174.5	0	0	0	0	109.8	P208 V212	P208-V210 HydrophobicContact CG-CG2 4.13Å; P208-V210 PolarHBondContact O-N 3.1Å; V210-V212 HydrophobicContact CG1-CG2 4.43Å; V210-V212 PolarHBondContact O-N 3.35Å; V210-V212 VanDerWaalsContact O-N 3.1Å
211	S	30	Very low	31.7	Very low	102 Å²	102	122.4 Å²	122.4	71%	0.713	72%	0.717	S	S	*	*			trans	-68	99.7	164.2	-65.9	0	0	0	0	109.2	L209 P213	L209-S211 PolarHBondContact O-N 2.93Å; S211-P213 WeakPolarHBondContact O-CD 3.27Å
212	V	31.9	Very low	31.4	Very low	98 Å²	98	122.5 Å²	122.5	59%	0.594	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-66.2	120.9	170.4	-176.8	0	0	0	0	108.4	V210 V214	V210-V212 HydrophobicContact CG1-CG2 4.43Å; V210-V212 PolarHBondContact O-N 3.35Å; V210-V212 VanDerWaalsContact O-N 3.1Å; V212-V214 PolarHBondContact O-N 3.12Å
213	P	32.2	Very low	31.3	Very low	113 Å²	113	123.1 Å²	123.1	73%	0.734	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-69.7	128.3	177.3	28.4	-33.4	0	0	0	110.1	S211	S211-P213 WeakPolarHBondContact O-CD 3.27Å
214	V	31.8	Very low	31.3	Very low	105 Å²	105	126.4 Å²	126.4	64%	0.636	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-83.5	121.5	162.3	178.7	0	0	0	0	106.8	V212 Y216	V212-V214 PolarHBondContact O-N 3.12Å; V214-Y216 PolarHBondContact O-N 3.35Å
215	P	33	Very low	31.3	Very low	108 Å²	108	127.6 Å²	127.6	70%	0.701	76%	0.757	S	S	*	*			trans	-70.4	101.7	174.4	28.5	-32.4	0	0	0	109.4	F217	P215-F217 PolarHBondContact O-N 3.07Å
216	Y	29.9	Very low	31.2	Very low	206 Å²	206	124.3 Å²	124.3	81%	0.808	75%	0.748	S	S	*	*			trans	-70.9	90	169.4	-96.3	-91.1	0	0	0	109.9	V214 S218	V214-Y216 PolarHBondContact O-N 3.35Å; Y216-S218 PolarHBondContact O-N 3.35Å
217	F	30.5	Very low	31.3	Very low	202 Å²	202	121.5 Å²	121.5	89%	0.886	75%	0.748	S	S	*	*			trans	-72.6	81.5	154.9	-90	-79.3	0	0	0	108.7	P215 L219	P215-F217 PolarHBondContact O-N 3.07Å; F217-L219 PolarHBondContact O-N 3.44Å
218	S	31.4	Very low	31.4	Very low	101 Å²	101	122.2 Å²	122.2	71%	0.706	74%	0.741	S	S	*	*			trans	-84.7	107.7	171.8	-166.7	0	0	0	0	109.1	Y216 G220	Y216-S218 PolarHBondContact O-N 3.35Å; S218-G220 PolarHBondContact O-N 2.91Å
219	L	31.5	Very low	31.5	Very low	177 Å²	177	124.5 Å²	124.5	93%	0.927	74%	0.742	S	S	*	*			trans	-57.5	131.2	169.3	-84.2	158.8	0	0	0	110.1	F217	F217-L219 PolarHBondContact O-N 3.44Å
220	G	31.9	Very low	31.8	Very low	72 Å²	72	123.3 Å²	123.3	74%	0.742	74%	0.736	S	S	*	*			trans	-138	81.4	-174.1	0	0	0	0	0	111.4	S218	S218-G220 PolarHBondContact O-N 2.91Å
221	S	32.2	Very low	32.2	Very low	106 Å²	106	123 Å²	123	74%	0.741	74%	0.736	S	S	*	*			trans	-50	151.5	163.1	55.7	0	0	0	0	111.7
222	T	31.6	Very low	32.4	Very low	123 Å²	123	126 Å²	126	76%	0.755	74%	0.744	S	S	*	*			cis	-170.2	178	15.9	-1.4	0	0	0	0	110.6
223	S	32.6	Very low	32.5	Very low	109 Å²	109	126.4 Å²	126.4	76%	0.762	75%	0.746	S	S	*	*			trans	74.1	149.6	151.8	75.1	0	0	0	0	118
224	S	31.1	Very low	32.6	Very low	94 Å²	94	131.1 Å²	131.1	66%	0.657	75%	0.751	S	S	*	*			cis	-173.2	156	-23.9	48.8	0	0	0	0	109
225	S	30.3	Very low	32.8	Very low	112 Å²	112	131.1 Å²	131.1	78%	0.783	76%	0.756	S	S	*	*			trans	61.4	153.1	169.3	37.9	0	0	0	0	116.3
226	S	30.7	Very low	33	Very low	93 Å²	93	129.3 Å²	129.3	65%	0.65	76%	0.757	S	S	*	*			cis	-166	161.4	-13.8	44.8	0	0	0	0	109
227	L	31.2	Very low	33.3	Very low	163 Å²	163	131.2 Å²	131.2	85%	0.853	76%	0.762	S	S	*	*			trans	67.3	150.7	166.9	-60.8	155.5	0	0	0	114.7
228	S	33	Very low	33.6	Very low	87 Å²	87	126.3 Å²	126.3	61%	0.608	75%	0.753	S	S	*	*			cis	-161.8	160.4	-9.2	44	0	0	0	0	111.5
229	H	36	Very low	34	Very low	159 Å²	159	126 Å²	126	74%	0.736	76%	0.757	S	S	*	*			trans	72.7	99.5	153.2	-68.3	-42.8	0	0	0	122
230	N	34.1	Very low	34.3	Very low	146 Å²	146	122.2 Å²	122.2	78%	0.781	75%	0.745	S	S	*	*				79.3	156.4	109.4	-75.2	4.4	0	0	0	121.7
231	P	38.6	Very low	34.4	Very low	106 Å²	106	126 Å²	126	69%	0.688	75%	0.748	S	S	*	*			trans	-126.6	-170.3	-144.8	45.4	-32.4	0	0	0	114.1
232	L	34.1	Very low	34.6	Very low	166 Å²	166	125.7 Å²	125.7	87%	0.869	75%	0.746	S	S	*	*			trans	-178.7	163.1	145	-91.8	166.7	0	0	0	107.8
233	V	35.7	Very low	34.7	Very low	106 Å²	106	124.1 Å²	124.1	64%	0.642	75%	0.745	S	S	*	*				-174.9	161.2	-54	128.3	0	0	0	0	109.2
234	Y	33.4	Very low	34.6	Very low	212 Å²	212	124.8 Å²	124.8	83%	0.831	75%	0.749	S	S	*	*			trans	90.1	109.8	-171.1	-76.8	-102.6	0	0	0	114.6
235	S	36.3	Very low	34.7	Very low	106 Å²	106	124.5 Å²	124.5	74%	0.741	75%	0.752	S	S	*	*			cis	93.6	137.8	41.8	81.3	0	0	0	0	113.6
236	G	37.1	Very low	34.8	Very low	70 Å²	70	124.2 Å²	124.2	72%	0.722	75%	0.75	S	S	*	*			cis	159.1	-172.5	-3.5	0	0	0	0	0	113.1
237	R	35.9	Very low	34.8	Very low	246 Å²	246	125.3 Å²	125.3	93%	0.928	75%	0.753	S	S	*	*			trans	73.5	146.1	176.4	-64.9	-172.7	175.2	-153	-1.3	117.1
238	S	37.5	Very low	34.8	Very low	99 Å²	99	124.2 Å²	124.2	69%	0.692	75%	0.748	S	S	*	*			cis	-171.9	146.6	-17	49.3	0	0	0	0	113.5
239	A	38.6	Very low	35	Very low	95 Å²	95	127.1 Å²	127.1	79%	0.785	76%	0.757	S	S	*	*			trans	68.2	149	146.5	0	0	0	0	0	119.6
240	S	37.6	Very low	35	Very low	96 Å²	96	126.9 Å²	126.9	67%	0.671	76%	0.761	S	S	*	*			cis	-172.9	152.1	-18	53.4	0	0	0	0	111.8
241	N	34.4	Very low	35.2	Very low	151 Å²	151	124.9 Å²	124.9	81%	0.807	76%	0.756	S	S	*	*			trans	39.2	144.8	131.8	-60.4	4.9	0	0	0	121.5
242	S	36.9	Very low	35	Very low	101 Å²	101	125.8 Å²	125.8	71%	0.706	77%	0.765	S	S	*	*			cis	-176	144.1	-4.6	46.5	0	0	0	0	113.1
243	A	33.5	Very low	34.8	Very low	89 Å²	89	121.4 Å²	121.4	74%	0.736	76%	0.759	S	S	*	*			trans	64.7	151.9	134.7	0	0	0	0	0	123.6
244	C	31.2	Very low	34.8	Very low	124 Å²	124	121.3 Å²	121.3	84%	0.838	77%	0.77	S	S	*	*			trans	83	106.4	151.8	-70.1	0	0	0	0	121.8
245	A	33.1	Very low	34.7	Very low	88 Å²	88	116.5 Å²	116.5	73%	0.727	77%	0.768	S	S	*	*				89.6	103.8	118.7	0	0	0	0	0	121.1
246	S	31.3	Very low	34.7	Very low	105 Å²	105	116.5 Å²	116.5	73%	0.734	77%	0.765	S	S	*	*				89	122.4	121.4	-59.6	0	0	0	0	122.2
247	T	31.4	Very low	34.4	Very low	116 Å²	116	120.8 Å²	120.8	71%	0.712	77%	0.77	S	S	*	*			trans	77.5	112.7	137.1	50.3	0	0	0	0	122.3
248	N	32.2	Very low	34.3	Very low	140 Å²	140	115.7 Å²	115.7	75%	0.749	77%	0.766	S	S	*	*				93.3	144.2	128.6	-62.9	-5.7	0	0	0	121.8
249	N	36	Very low	33.9	Very low	148 Å²	148	115.6 Å²	115.6	79%	0.791	77%	0.765	S	S	*	*			trans	80.6	91.4	156.2	-57.9	-19.6	0	0	0	120.8
250	N	35.5	Very low	33.7	Very low	155 Å²	155	123 Å²	123	83%	0.829	77%	0.773	S	S	*	*				22.9	151.2	109.7	-97.2	1.4	0	0	0	120.1
251	P	40.1	Very low	33.4	Very low	103 Å²	103	129 Å²	129	67%	0.669	78%	0.781	S	S	*	*			cis	-142.2	-162.3	-46.5	38	-17.2	0	0	0	112.4
252	S	32.5	Very low	33.4	Very low	125 Å²	125	126.7 Å²	126.7	87%	0.874	77%	0.774	S	S	*	*			trans	79.5	151	163.3	81.8	0	0	0	0	119.1
253	G	31.5	Very low	33.3	Very low	74 Å²	74	133.1 Å²	133.1	76%	0.763	78%	0.783	S	S	*	*			trans	126.6	90.5	165.4	0	0	0	0	0	117.8
254	A	34.2	Very low	33.2	Very low	104 Å²	104	135.2 Å²	135.2	86%	0.86	78%	0.781	S	S	*	*			trans	48.8	129.4	146.1	0	0	0	0	0	123.7
255	S	31.5	Very low	33.5	Very low	112 Å²	112	135.4 Å²	135.4	78%	0.783	78%	0.78	S	S	*	*			trans	-64	179.8	149.9	-43.6	0	0	0	0	111.6
256	P	37.5	Very low	33.3	Very low	106 Å²	106	137.7 Å²	137.7	69%	0.688	78%	0.78	S	S	*	*			cis	-148	-176.3	14.9	45.1	-24.7	0	0	0	118.3
257	L	30.5	Very low	33.5	Very low	159 Å²	159	138.3 Å²	138.3	83%	0.832	78%	0.784	S	S	*	*			trans	48.9	131.4	146.2	-71.4	159.6	0	0	0	121.5
258	V	33.7	Very low	33.5	Very low	140 Å²	140	139.5 Å²	139.5	85%	0.848	79%	0.786	S	S	*	*				179.6	141.9	105.2	151.4	0	0	0	0	112.6
259	S	29	Very low	33.5	Very low	96 Å²	96	138.3 Å²	138.3	67%	0.671	79%	0.789	S	S	*	*			trans	-52.4	153.5	-179.5	113.5	0	0	0	0	117.6
260	R	34	Very low	33.2	Very low	250 Å²	250	137 Å²	137	94%	0.943	79%	0.79	S	S	*	*			trans	-139.3	121.4	133.1	-71.3	-162	177.1	-154.7	-2	113.6
261	R	31	Very low	32.9	Very low	223 Å²	223	133.7 Å²	133.7	84%	0.842	79%	0.785	S	S	*	*			trans	-100	-172.5	149.1	-97.4	-170.9	179	-154.5	1.4	107.2
262	P	35.9	Very low	32.4	Very low	102 Å²	102	138.2 Å²	138.2	66%	0.662	79%	0.794	S	S	*	*			cis	-138.5	-178.1	5.9	36.7	-15.3	0	0	0	115.9
263	R	33.9	Very low	32.2	Very low	236 Å²	236	136.7 Å²	136.7	89%	0.891	78%	0.783	S	S	*	*				176.4	162.5	112.3	-91.2	177.6	-161.9	-123.9	2.4	112.2
264	I	31.4	Very low	32.2	Very low	134 Å²	134	141.5 Å²	141.5	69%	0.687	79%	0.786	S	S	*	*			trans	-141.6	152.8	-177.2	-60.4	166.3	0	0	0	107.4	N266	I264-N266 WeakPolarHBondContact CG2-OD1 3.32Å
265	P	36.8	Very low	31.9	Very low	128 Å²	128	142.8 Å²	142.8	83%	0.831	78%	0.778	S	S	*	*			trans	-121.5	147.1	143.4	35.5	-27.3	0	0	0	112.7
266	N	29.6	Very low	31.8	Very low	136 Å²	136	149.3 Å²	149.3	73%	0.727	79%	0.785	S	S	*	*			trans	-102.1	153.8	-173	-65.7	-19.8	0	0	0	113	I264	I264-N266 WeakPolarHBondContact CG2-OD1 3.32Å
267	S	35.4	Very low	31.3	Very low	117 Å²	117	152.1 Å²	152.1	82%	0.818	79%	0.789	S	S	*	*			trans	-173.5	165.3	139.4	48.1	0	0	0	0	110.8
268	N	30.6	Very low	31.5	Very low	141 Å²	141	150.2 Å²	150.2	75%	0.754	79%	0.787	S	S	*	*				-166.8	151.3	-64.1	-112.6	6.5	0	0	0	108.7
269	S	32.3	Very low	31.3	Very low	116 Å²	116	146.5 Å²	146.5	81%	0.811	78%	0.777	S	S	*	*			trans	63.5	147.8	172	75	0	0	0	0	116.8
270	C	30.3	Very low	31.7	Very low	120 Å²	120	148 Å²	148	81%	0.811	78%	0.784	S	S	*	*			cis	-132.1	145.7	-21.2	-87.9	0	0	0	0	106.7
271	A	29.1	Very low	31.7	Very low	86 Å²	86	143.1 Å²	143.1	71%	0.711	78%	0.782	S	S	*	*			cis	83.4	85.7	35.3	0	0	0	0	0	115.1
272	F	28.9	Very low	31.7	Very low	197 Å²	197	138.4 Å²	138.4	86%	0.864	78%	0.78	S	S	*	*				-151.2	143.6	127	-138	-91	0	0	0	110.6
273	S	28.4	Very low	31.4	Very low	93 Å²	93	138.1 Å²	138.1	65%	0.65	77%	0.773	S	S	*	*			trans	-151.7	148.2	-169.6	-60.8	0	0	0	0	110.7
274	E	31.4	Very low	31.2	Very low	175 Å²	175	134.6 Å²	134.6	82%	0.818	77%	0.77	S	S	*	*			trans	-158	111	149.2	-112	156.1	-150.6	0	0	108.2
275	L	28.5	Very low	31.2	Very low	132 Å²	132	132.9 Å²	132.9	69%	0.691	77%	0.77	S	S	*	*				73.9	97.8	64.3	-84.1	157	0	0	0	114.7
276	W	29.8	Very low	31	Very low	249 Å²	249	132.8 Å²	132.8	94%	0.943	77%	0.767	S	S	*	*			trans	-139.4	112	143.9	-93.5	85.4	0	0	0	109.5
277	Q	27.6	Very low	31.1	Very low	164 Å²	164	136 Å²	136	77%	0.766	78%	0.778	S	S	*	*			trans	-109.7	156.5	150.8	-62.9	-171	2.8	0	0	106.8
278	P	34.1	Very low	30.9	Very low	120 Å²	120	136 Å²	136	78%	0.779	78%	0.778	S	S	*	*				-127.4	-176.6	83.4	3.6	20.3	0	0	0	111.9
279	G	30.1	Very low	31.1	Very low	62 Å²	62	134.7 Å²	134.7	64%	0.639	78%	0.78	S	S	*	*			cis	133.9	122.7	5.8	0	0	0	0	0	110.5
280	P	36.4	Very low	31.2	Very low	128 Å²	128	133.9 Å²	133.9	83%	0.831	78%	0.78	S	S	*	*			trans	-104.2	147.7	-167.9	37.8	-33.7	0	0	0	115.2
281	V	33.3	Very low	31.3	Very low	147 Å²	147	135.7 Å²	135.7	89%	0.891	78%	0.781	S	S	*	*			trans	-154.1	164.5	170.5	-102.2	0	0	0	0	110.6
282	P	31.8	Very low	31.7	Very low	124 Å²	124	136.8 Å²	136.8	81%	0.805	78%	0.781	S	S	*	*			trans	-119.4	-158.2	-131.7	45.2	-36.3	0	0	0	115.8
283	N	29.2	Very low	31.7	Very low	95 Å²	95	134.8 Å²	134.8	51%	0.508	78%	0.778	S	S	.	*			trans	-139.5	135.4	-172.3	174.7	76.9	0	0	0	110.4	Y579	N283-Y579 HydrophobicContact CB-CD2 4.49Å; N283-Y579 HydrophobicContact CB-CE1 4.25Å; N283-Y579 HydrophobicContact CB-CE2 3.71Å; N283-Y579 WeakPolarHBondContact ND2-CD2 3.24Å; N283-Y579 VanDerWaalsContact OD1-CE2 3.29Å; N283-Y579 WeakPolarHBondContact OD1-CE2 3.48Å
284	I	30.5	Very low	31.9	Very low	163 Å²	163	137.2 Å²	137.2	84%	0.836	79%	0.789	S	S	*	*			trans	-164.2	169.4	161.2	-112.7	159.3	0	0	0	113.3
285	S	30.8	Very low	31.9	Very low	97 Å²	97	133.3 Å²	133.3	68%	0.678	78%	0.781	S	S	*	*			trans	-60.3	145.9	-156.3	54.1	0	0	0	0	121.6
286	T	31.9	Very low	32	Very low	127 Å²	127	133.2 Å²	133.2	78%	0.779	78%	0.781	S	S	*	*			trans	-18	146.6	140	52	0	0	0	0	119.8
287	Q	33.6	Very low	32	Very low	202 Å²	202	128.4 Å²	128.4	94%	0.944	77%	0.773	S	S	*	*			trans	-134.6	171.7	133.1	-78.2	-159.5	-1.7	0	0	110.3
288	S	30.9	Very low	32.2	Very low	118 Å²	118	123.7 Å²	123.7	83%	0.825	77%	0.769	S	S	*	*			trans	-133.2	144.8	-166.7	172.1	0	0	0	0	112.1
289	S	33.7	Very low	31.8	Very low	114 Å²	114	125 Å²	125	80%	0.797	77%	0.767	S	S	*	*			trans	-161	142.9	157.9	51.3	0	0	0	0	115.2
290	A	34.2	Very low	31.7	Very low	99 Å²	99	127.5 Å²	127.5	82%	0.818	77%	0.771	S	S	*	*			trans	62.8	105.4	147	0	0	0	0	0	122.5
291	L	33.8	Very low	31.6	Very low	158 Å²	158	129.5 Å²	129.5	83%	0.827	77%	0.769	S	S	*	*			trans	-52.8	172.7	141	-77.3	170.2	0	0	0	112.7
292	P	36.2	Very low	31.5	Very low	109 Å²	109	129.9 Å²	129.9	71%	0.708	77%	0.766	S	S	*	*			cis	-150.2	177.3	33.2	44.1	-22.7	0	0	0	120.7
293	L	28.6	Very low	32	Very low	154 Å²	154	129.7 Å²	129.7	81%	0.806	77%	0.765	S	S	*	*			trans	3.9	143.9	141.7	-59.6	153.9	0	0	0	117.5
294	T	34.2	Very low	32.7	Very low	144 Å²	144	131.2 Å²	131.2	88%	0.883	78%	0.78	S	S	*	*				-154.3	176.6	68.4	42.3	0	0	0	0	115.5
295	S	29.9	Very low	32.9	Very low	93 Å²	93	131.1 Å²	131.1	65%	0.65	78%	0.781	S	S	*	*			trans	-96.7	161.2	-178.1	56.2	0	0	0	0	114.2
296	N	31.1	Very low	33.1	Very low	130 Å²	130	133 Å²	133	70%	0.695	79%	0.792	S	S	*	*				165.9	136.3	116.8	-83.7	-18.4	0	0	0	116.5
297	I	29.6	Very low	33.2	Very low	148 Å²	148	130 Å²	130	76%	0.759	79%	0.787	S	S	*	*			trans	59.7	135.9	131.9	-55.9	167.6	0	0	0	121.2	I299	I297-I299 HydrophobicContact CG2-CD1 4.22Å
298	G	31.7	Very low	33.2	Very low	66 Å²	66	128.3 Å²	128.3	68%	0.68	78%	0.784	S	S	*	*			trans	126.5	82.9	166.3	0	0	0	0	0	112.8
299	I	26.8	Very low	33.3	Very low	146 Å²	146	134.6 Å²	134.6	75%	0.749	79%	0.789	S	S	*	*				63.6	127.1	65.6	-40.2	173.3	0	0	0	114	I297	I297-I299 HydrophobicContact CG2-CD1 4.22Å
300	T	27.2	Very low	33	Very low	116 Å²	116	137.2 Å²	137.2	71%	0.712	79%	0.789	S	S	*	*			trans	108.8	124	158.8	67.8	0	0	0	0	121.3
301	Q	34.6	Very low	33	Very low	169 Å²	169	144 Å²	144	79%	0.79	79%	0.794	S	S	*	*			trans	71.7	100.5	134.7	-66.5	173.4	40.4	0	0	123.6
302	N	30.6	Very low	32.9	Very low	156 Å²	156	141.7 Å²	141.7	83%	0.834	79%	0.79	S	S	*	*				44.1	144.1	124.3	-67.2	-3	0	0	0	124.3
303	P	43.2	Very low	32.9	Very low	120 Å²	120	142.4 Å²	142.4	78%	0.779	80%	0.795	S	S	*	*			trans	-99.4	170.9	177	41.2	-37	0	0	0	114.7
304	P	43.1	Very low	33	Very low	127 Å²	127	141 Å²	141	83%	0.825	80%	0.797	S	S	*	*			trans	-114.4	156	162	37.6	-28.3	0	0	0	114.9
305	N	35.2	Very low	32.7	Very low	160 Å²	160	141.2 Å²	141.2	86%	0.856	79%	0.793	S	S	*	*			trans	-74.3	157.2	177.4	-77.3	-54.9	0	0	0	114.5
306	C	34.5	Very low	32.9	Very low	136 Å²	136	145 Å²	145	92%	0.919	80%	0.8	S	S	*	*				173.6	142.9	122.6	-94	0	0	0	0	111.3
307	G	35.3	Very low	32.8	Very low	66 Å²	66	144.8 Å²	144.8	68%	0.68	80%	0.799	S	S	*	*			cis	173.6	132.1	-10.2	0	0	0	0	0	114.1
308	L	32.5	Very low	32.8	Very low	165 Å²	165	143.4 Å²	143.4	86%	0.864	80%	0.797	S	S	*	*			trans	48.1	114.3	149.6	-57	170.8	0	0	0	120.9
309	R	32.7	Very low	32.7	Very low	250 Å²	250	145.7 Å²	145.7	94%	0.943	80%	0.803	S	S	*	*				-165.9	142.4	93.9	-119.5	-179.1	177.9	-178	0.1	113.6
310	E	28.3	Very low	32.9	Very low	170 Å²	170	142.5 Å²	142.5	79%	0.794	80%	0.798	S	S	*	*			trans	-103.4	156.8	178.5	-53.7	158.8	115.8	0	0	111.4
311	R	33.9	Very low	32.9	Very low	241 Å²	241	147 Å²	147	91%	0.909	80%	0.804	S	S	*	*			trans	-170.3	116.4	130.4	-105.9	163.4	-169.3	-119.9	-2.6	114
312	S	32.6	Very low	32.7	Very low	109 Å²	109	146.1 Å²	146.1	76%	0.762	80%	0.804	S	S	*	*			trans	17.2	146.2	146.3	-44.4	0	0	0	0	123
313	P	34.6	Very low	32.5	Very low	124 Å²	124	147.8 Å²	147.8	81%	0.805	81%	0.807	S	S	*	*			trans	-86.4	167.9	173.2	38	-36.9	0	0	0	113.7
314	C	31	Very low	32	Very low	125 Å²	125	147.7 Å²	147.7	85%	0.845	81%	0.809	S	S	*	*			trans	-136.5	139.4	168.8	-62.6	0	0	0	0	111.4
315	N	28.7	Very low	31.2	Very low	149 Å²	149	148.4 Å²	148.4	80%	0.797	80%	0.802	S	S	*	*			trans	-86.8	-170.4	161.8	-73.6	-30.7	0	0	0	109.9
316	H	33.8	Very low	31	Very low	172 Å²	172	150 Å²	150	80%	0.796	80%	0.801	S	S	*	*			trans	85.6	140.6	-177.4	-58.6	-63.2	0	0	0	115.3
317	D	30.1	Very low	30.7	Very low	126 Å²	126	152.1 Å²	152.1	67%	0.674	79%	0.791	S	S	*	*			cis	-157.8	-179.6	-27.1	-137.2	-65.3	0	0	0	111.1
318	T	27.9	Very low	30.2	Very low	119 Å²	119	156.8 Å²	156.8	73%	0.73	80%	0.799	S	S	*	*			trans	-57	136.2	173.4	48.6	0	0	0	0	114.8
319	S	30.8	Very low	30.2	Very low	114 Å²	114	155.2 Å²	155.2	80%	0.797	80%	0.796	S	S	*	*				159.8	153.2	115.9	56.4	0	0	0	0	116
320	A	30.4	Very low	29.9	Very low	79 Å²	79	152.4 Å²	152.4	65%	0.653	79%	0.794	S	S	*	*			trans	59	122.7	144.7	0	0	0	0	0	123.4
321	Y	26.7	Very low	30	Very low	210 Å²	210	150.2 Å²	150.2	82%	0.824	79%	0.788	S	S	*	*			trans	43.7	126	135.5	-67.9	-88	0	0	0	119.8
322	N	31.2	Very low	29.8	Very low	150 Å²	150	146.4 Å²	146.4	80%	0.802	78%	0.778	S	S	*	*				-161.5	165.4	53.2	-101.7	-44.4	0	0	0	113.9
323	E	25.8	Very low	29.6	Very low	191 Å²	191	147.6 Å²	147.6	89%	0.893	79%	0.785	S	S	*	*			trans	-74.9	149.7	171.5	-56.7	-179.4	109.9	0	0	113
324	S	32.3	Very low	29.2	Very low	118 Å²	118	151.3 Å²	151.3	83%	0.825	79%	0.788	S	S	*	*			trans	-153.7	145.4	148.5	48.6	0	0	0	0	111.8
325	Q	26.8	Very low	29.2	Very low	142 Å²	142	153.5 Å²	153.5	66%	0.664	79%	0.791	S	S	*	*			trans	-84.5	147.1	-165.5	-53.9	164.8	8.8	0	0	112.2
326	F	30.5	Very low	29.3	Very low	193 Å²	193	155.4 Å²	155.4	85%	0.846	80%	0.795	S	S	*	*			trans	-133.3	156.1	148.7	-92.2	-80.7	0	0	0	111.9
327	Y	29.2	Very low	29.1	Very low	181 Å²	181	153.6 Å²	153.6	71%	0.71	80%	0.799	S	S	*	*			trans	-100.6	158.3	-174.2	-81.8	-110.1	0	0	0	111.4
328	I	25.1	Very low	29.1	Very low	164 Å²	164	151 Å²	151	84%	0.841	80%	0.801	S	S	*	*			trans	-113.1	128.4	166	-61.3	174.9	0	0	0	107.4
329	T	31.8	Very low	29.1	Very low	132 Å²	132	157 Å²	157	81%	0.81	81%	0.81	S	S	*	*			trans	-118.4	129.8	166.8	46	0	0	0	0	108.9
330	E	25.9	Very low	29.2	Very low	191 Å²	191	159.7 Å²	159.7	89%	0.893	81%	0.814	S	S	*	*			trans	-78.6	128.2	179.3	-58.1	180	136.9	0	0	110.3
331	D	31.9	Very low	29.2	Very low	125 Å²	125	161.2 Å²	161.2	67%	0.668	82%	0.819	S	S	*	*			trans	-154.9	152.6	136.5	-135.1	-9.6	0	0	0	115.7
332	K	29.2	Very low	29.3	Very low	161 Å²	161	160 Å²	160	70%	0.7	82%	0.821	S	S	*	*			trans	-10	133.3	174	-58	140.6	-172.6	94.9	0	119.1
333	C	27.7	Very low	29.3	Very low	134 Å²	134	161.6 Å²	161.6	91%	0.905	82%	0.823	S	S	*	*			trans	-150	134.5	135.1	-136.4	0	0	0	0	112
334	F	26.3	Very low	29.5	Very low	201 Å²	201	161.1 Å²	161.1	88%	0.882	82%	0.821	S	S	*	*			trans	-87.9	150.2	175.3	-89.6	-112.1	0	0	0	110.7
335	L	31.2	Very low	29.4	Very low	172 Å²	172	162.2 Å²	162.2	90%	0.901	82%	0.822	S	S	*	*			trans	-134.1	130.5	164.2	-84.5	171.7	0	0	0	111
336	Q	30.1	Very low	29.7	Very low	188 Å²	188	160.3 Å²	160.3	88%	0.879	82%	0.82	S	S	*	*			trans	-85.7	152.7	172.3	-70.6	-167.6	-1.4	0	0	111.5
337	P	29.8	Very low	29.9	Very low	135 Å²	135	156.6 Å²	156.6	88%	0.877	82%	0.816	S	S	*	*			trans	-83.7	117	178.9	32	-32.6	0	0	0	112.3
338	G	31.2	Very low	30	Very low	71 Å²	71	154.5 Å²	154.5	73%	0.732	82%	0.815	S	S	*	*			trans	-133.4	130.8	-178.5	0	0	0	0	0	114.2
339	R	27.8	Very low	30.2	Very low	244 Å²	244	152.9 Å²	152.9	92%	0.921	81%	0.813	S	S	*	*			trans	-17.4	125	173.2	-57.3	174.6	-178.2	-170.6	0.2	117.8
340	I	31.9	Very low	30.2	Very low	171 Å²	171	154.9 Å²	154.9	88%	0.877	81%	0.813	S	S	*	*			trans	-127.9	136.6	144.4	-63.4	-177	0	0	0	107.9
341	C	30.9	Very low	30.4	Very low	112 Å²	112	150.8 Å²	150.8	76%	0.757	81%	0.806	S	S	*	*			trans	-85.8	164.4	-170.2	-62.5	0	0	0	0	113.5	H343	C341-H343 PolarHBondContact O-N 3.47Å
342	H	27.9	Very low	30.7	Very low	184 Å²	184	150.7 Å²	150.7	85%	0.852	81%	0.812	S	S	*	*			trans	-58	132.1	169.7	-84.5	-109.3	0	0	0	111.7
343	H	33.1	Very low	30.8	Very low	184 Å²	184	152.9 Å²	152.9	85%	0.852	82%	0.821	S	S	*	*			trans	-128.5	144	148.5	-102.8	36	0	0	0	109.4	C341	C341-H343 PolarHBondContact O-N 3.47Å
344	Q	28.2	Very low	31.1	Very low	181 Å²	181	153.1 Å²	153.1	85%	0.846	82%	0.819	S	S	*	*			trans	-80.1	132.5	-174	-66.4	165	-23.1	0	0	109.7
345	V	31.3	Very low	31.5	Very low	141 Å²	141	152.7 Å²	152.7	86%	0.855	82%	0.817	S	S	*	*			trans	-110.2	89.2	166.5	-177.8	0	0	0	0	107.6
346	T	32.9	Very low	31.5	Very low	101 Å²	101	152 Å²	152	62%	0.62	81%	0.814	S	S	*	*			trans	-74.6	132	166	33.9	0	0	0	0	109.3	I348	T346-I348 PolarHBondContact O-N 3.34Å
347	P	35.1	Very low	31.8	Very low	116 Å²	116	151 Å²	151	75%	0.753	81%	0.813	S	S	*	*			trans	-72.4	109	169	29.2	-31.4	0	0	0	108.9	T349	P347-T349 PolarHBondContact O-N 2.95Å; P347-T349 VanDerWaalsContact O-N 3.16Å
348	I	30.2	Very low	32	Very low	136 Å²	136	152 Å²	152	70%	0.697	81%	0.811	S	S	*	*			trans	-76.4	100.7	173.4	-63.5	176.9	0	0	0	108.3	T346 Q350	T346-I348 PolarHBondContact O-N 3.34Å; I348-Q350 HydrophobicContact CG2-CG 3.97Å; I348-Q350 PolarHBondContact O-N 2.87Å
349	T	30.3	Very low	31.9	Very low	130 Å²	130	156.8 Å²	156.8	80%	0.798	81%	0.814	S	S	*	*			trans	-78.3	107.4	165.9	50.6	0	0	0	0	109.5	P347	P347-T349 PolarHBondContact O-N 2.95Å; P347-T349 VanDerWaalsContact O-N 3.16Å
350	Q	31.4	Very low	32	Very low	174 Å²	174	150 Å²	150	81%	0.813	80%	0.804	S	S	*	*			trans	-115.4	113.5	162.8	-78	-174.5	7.1	0	0	109.2	I348	I348-Q350 HydrophobicContact CG2-CG 3.97Å; I348-Q350 PolarHBondContact O-N 2.87Å
351	S	29.4	Very low	32	Very low	106 Å²	106	148.8 Å²	148.8	74%	0.741	80%	0.799	S	S	*	*			trans	-82.8	122.4	177.8	51.6	0	0	0	0	111.2
352	P	39.8	Very low	32.1	Very low	123 Å²	123	150.8 Å²	150.8	80%	0.799	80%	0.801	S	S	*	*			trans	-65.6	140.7	159.9	-13	29	0	0	0	109.4	T354	P352-T354 PolarHBondContact O-N 3.39Å
353	K	30.5	Very low	32.2	Very low	206 Å²	206	145.8 Å²	145.8	90%	0.896	79%	0.787	S	S	*	*			trans	-81.1	115.8	176.3	-60.5	173.6	-176.7	177.1	0	109.4
354	T	33.7	Very low	32.4	Very low	139 Å²	139	143 Å²	143	85%	0.853	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-79.3	125.5	161.9	47.1	0	0	0	0	109	P352	P352-T354 PolarHBondContact O-N 3.39Å
355	K	35.4	Very low	32.6	Very low	193 Å²	193	139.8 Å²	139.8	84%	0.839	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-90.6	150.7	164.1	-78.7	-173.7	171.7	-172.2	0	109.4
356	D	30.2	Very low	32.9	Very low	158 Å²	158	139 Å²	139	85%	0.845	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-67.1	133.9	171.3	-37.8	-91.9	0	0	0	110.6
357	I	37.3	Very low	32.8	Very low	167 Å²	167	140.8 Å²	140.8	86%	0.856	78%	0.784	S	S	*	*			trans	-141.5	134.8	159.3	-60.9	-174.7	0	0	0	106.5
358	D	32.8	Very low	32.8	Very low	154 Å²	154	139.9 Å²	139.9	82%	0.824	79%	0.786	S	S	*	*			trans	-83.1	-174.2	-170.6	-96	-52.2	0	0	0	115.1
359	E	30.6	Very low	32.9	Very low	173 Å²	173	138.9 Å²	138.9	81%	0.808	79%	0.791	S	S	*	*			trans	-54.4	165.6	-173.2	-56.5	-171.6	109.3	0	0	117.8
360	S	29	Very low	33.7	Very low	102 Å²	102	137.6 Å²	137.6	71%	0.713	78%	0.784	S	S	*	*			trans	79.3	122.2	151.1	76.9	0	0	0	0	118.8
361	L	32.2	Very low	33.8	Very low	145 Å²	145	136 Å²	136	76%	0.759	79%	0.787	S	S	*	*				177.7	142.2	91.2	-87.2	174.5	0	0	0	113
362	L	32.8	Very low	34.1	Very low	153 Å²	153	135 Å²	135	80%	0.801	79%	0.794	S	S	*	*			trans	61.1	108.1	146	-63.4	167.3	0	0	0	122
363	S	30.8	Very low	33.6	Very low	80 Å²	80	132.8 Å²	132.8	56%	0.559	79%	0.792	S	S	*	*			trans	-50.1	161.6	154.3	49.7	0	0	0	0	117.5
364	S	35.7	Very low	33.6	Very low	126 Å²	126	128.8 Å²	128.8	88%	0.881	79%	0.789	S	S	*	*			trans	-152.9	126.3	147.7	-68.3	0	0	0	0	110.3
365	D	33.9	Very low	33.4	Very low	112 Å²	112	131.9 Å²	131.9	60%	0.599	79%	0.791	S	S	*	*			trans	-94.4	165.4	-178.2	-74	-58.4	0	0	0	113.5
366	S	36.7	Very low	33.3	Very low	126 Å²	126	130.6 Å²	130.6	88%	0.881	79%	0.792	S	S	*	*			trans	-157.7	138.4	136.7	22.5	0	0	0	0	111.2
367	N	32.1	Very low	33.5	Very low	138 Å²	138	130.9 Å²	130.9	74%	0.738	79%	0.789	S	S	*	*			trans	-114.9	153.4	-168.2	-83.6	-74.4	0	0	0	113.2
368	A	35.1	Very low	33.5	Very low	97 Å²	97	128.4 Å²	128.4	80%	0.802	78%	0.783	S	S	*	*			trans	-148	140.3	158.3	0	0	0	0	0	111.2
369	S	31.3	Very low	33.5	Very low	115 Å²	115	124.4 Å²	124.4	80%	0.804	78%	0.779	S	S	*	*			trans	-180	179.4	-170.9	-102.4	0	0	0	0	109.5
370	P	47.6	Very low	33.6	Very low	102 Å²	102	122.9 Å²	122.9	66%	0.662	78%	0.776	S	S	*	*			cis	-132	-168.4	-24.3	33	-13	0	0	0	111.8
371	T	34	Very low	33.9	Very low	142 Å²	142	127.7 Å²	127.7	87%	0.871	78%	0.784	S	S	*	*				157.7	156.9	122.9	44.3	0	0	0	0	113.5
372	G	34.3	Very low	34.1	Very low	85 Å²	85	129.8 Å²	129.8	88%	0.876	79%	0.787	S	S	*	*			trans	105.1	131.2	170.7	0	0	0	0	0	114.7
373	G	29	Very low	34.1	Very low	75 Å²	75	126.1 Å²	126.1	77%	0.773	79%	0.786	S	S	*	*			trans	-168.2	170.3	179.5	0	0	0	0	0	114.6
374	C	30.7	Very low	34.3	Very low	122 Å²	122	126.6 Å²	126.6	82%	0.824	80%	0.795	S	S	*	*			trans	-155.7	151.5	172.3	-98.8	0	0	0	0	111.7
375	K	29.8	Very low	34.3	Very low	204 Å²	204	126.1 Å²	126.1	89%	0.887	79%	0.789	S	S	*	*			trans	-82.1	147.3	174.4	-61.9	176	178.7	177.8	0	111
376	L	33.6	Very low	34.4	Very low	166 Å²	166	128.7 Å²	128.7	87%	0.869	80%	0.801	S	S	*	*			trans	-154.1	159.1	155.8	-107.3	176	0	0	0	112.4
377	E	33.9	Very low	34.3	Very low	165 Å²	165	127.8 Å²	127.8	77%	0.771	79%	0.793	S	S	*	*			trans	-78.2	154.6	-164.7	-75.2	-75.8	113.3	0	0	116.2	G379	E377-G379 PolarHBondContact O-N 3.29Å
378	P	37.3	Very low	34.4	Very low	114 Å²	114	125.8 Å²	125.8	74%	0.74	79%	0.787	S	S	*	*			trans	-74.7	92.4	172.4	31.6	-34.3	0	0	0	112.2	N380	P378-N380 PolarHBondContact O-N 3.43Å
379	G	32.5	Very low	34.5	Very low	71 Å²	71	126 Å²	126	73%	0.732	78%	0.78	S	S	*	*			trans	-61.3	97.5	-179.3	0	0	0	0	0	115	E377 K381	E377-G379 PolarHBondContact O-N 3.29Å; G379-K381 PolarHBondContact O-N 2.98Å; G379-K381 VanDerWaalsContact O-N 3.16Å
380	N	33.1	Very low	34.7	Very low	141 Å²	141	127.9 Å²	127.9	75%	0.754	78%	0.78	S	S	*	*			trans	-68.9	103.9	-174.6	-159	-12	0	0	0	112.9	P378	P378-N380 PolarHBondContact O-N 3.43Å
381	K	36.1	Very low	34	Very low	202 Å²	202	126.4 Å²	126.4	88%	0.878	77%	0.77	S	S	*	*			trans	-116.6	84.1	176.8	-74.5	-173.3	177.6	178.5	0	112.1	G379 G383	G379-K381 PolarHBondContact O-N 2.98Å; G379-K381 VanDerWaalsContact O-N 3.16Å; K381-G383 PolarHBondContact O-N 3.33Å
382	K	35.5	Very low	33.9	Very low	190 Å²	190	124.9 Å²	124.9	83%	0.826	76%	0.763	S	S	*	*			trans	-68.8	114.5	165.8	-70.2	-175.9	177	-179.4	0	109.5	A384	K382-A384 PolarHBondContact O-N 2.96Å
383	G	33.8	Very low	33.7	Very low	76 Å²	76	132.1 Å²	132.1	78%	0.784	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-69	126.8	171.6	0	0	0	0	0	110.7	K381	K381-G383 PolarHBondContact O-N 3.33Å
384	A	33.4	Very low	34	Very low	89 Å²	89	133.3 Å²	133.3	74%	0.736	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-72.5	143.4	173	0	0	0	0	0	110.5	K382	K382-A384 PolarHBondContact O-N 2.96Å
385	P	36.5	Very low	33.9	Very low	116 Å²	116	134.9 Å²	134.9	75%	0.753	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-64.1	140.5	172.8	27.8	-33.9	0	0	0	110.4
386	L	36	Very low	33.9	Very low	166 Å²	166	132.1 Å²	132.1	87%	0.869	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-66	138	175	-71.3	169.2	0	0	0	110
387	P	34.6	Very low	33.8	Very low	108 Å²	108	130.4 Å²	130.4	70%	0.701	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-63.7	148.7	174.7	27.9	-34.6	0	0	0	110.7
388	P	34.9	Very low	33.8	Very low	95 Å²	95	126.2 Å²	126.2	62%	0.617	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-60.9	144.2	178.4	26	-34.4	0	0	0	110.9	I390	P388-I390 PolarHBondContact O-N 3.26Å
389	P	36.7	Very low	33.6	Very low	101 Å²	101	129.4 Å²	129.4	66%	0.656	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-62.9	127.6	-177.7	25.3	-33.9	0	0	0	111	W858	P389-W858 WeakPolarHBondContact O-CH2 3.24Å; P389-W858 VanDerWaalsContact O-CZ3 3.31Å; P389-W858 WeakPolarHBondContact O-CZ3 3.34Å
390	I	35.1	Very low	33.5	Very low	156 Å²	156	136.2 Å²	136.2	80%	0.8	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-63.2	134.1	175.6	-58.7	174.9	0	0	0	108.6	P388	P388-I390 PolarHBondContact O-N 3.26Å
391	P	33	Very low	33.3	Very low	70 Å²	70	135.8 Å²	135.8	46%	0.455	74%	0.736	S	S	.	*	P	Polyproline II helix	trans	-64.7	142.3	178.7	25.8	-33.3	0	0	0	111.1	R393 W858	P391-R393 PolarHBondContact O-N 3.4Å; P391-W858 HydrophobicContact CB-CD2 4.35Å; P391-W858 HydrophobicContact CB-CE3 3.8Å; P391-W858 HydrophobicContact CB-CH2 4.15Å; P391-W858 HydrophobicContact CB-CZ3 3.71Å; P391-W858 HydrophobicContact CG-CE3 4.19Å; P391-W858 HydrophobicContact CG-CZ3 4.11Å
392	P	33.2	Very low	32.8	Very low	110 Å²	110	131.5 Å²	131.5	71%	0.714	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-61.2	137.8	169.1	27.4	-33.8	0	0	0	109.6	S394	P392-S394 PolarHBondContact O-N 3.22Å
393	R	29.9	Very low	32.6	Very low	237 Å²	237	128.5 Å²	128.5	89%	0.894	73%	0.73	S	S	*	*			trans	-66.8	92.7	177.7	-77.1	-177.3	170.8	179	-3.3	110.7	P391 N395	P391-R393 PolarHBondContact O-N 3.4Å; R393-N395 PolarHBondContact O-N 2.83Å; R393-N395 VanDerWaalsContact O-N 3.08Å
394	S	34.7	Very low	32.5	Very low	100 Å²	100	131.2 Å²	131.2	70%	0.699	73%	0.731	S	S	*	*			trans	-74.8	91.8	172.3	43.9	0	0	0	0	110.9	P392 L396	P392-S394 PolarHBondContact O-N 3.22Å; S394-L396 PolarHBondContact O-N 3.13Å
395	N	28.6	Very low	32.3	Very low	156 Å²	156	134.9 Å²	134.9	83%	0.834	74%	0.738	S	S	*	*			trans	-65.5	99.7	171.1	-71.4	-25.4	0	0	0	110.2	R393	R393-N395 PolarHBondContact O-N 2.83Å; R393-N395 VanDerWaalsContact O-N 3.08Å
396	L	30.2	Very low	32.1	Very low	146 Å²	146	136 Å²	136	76%	0.764	74%	0.743	S	S	*	*			trans	-110.8	103.5	174.4	-80.1	167.7	0	0	0	110.4	S394	S394-L396 PolarHBondContact O-N 3.13Å
397	R	30.3	Very low	31.7	Very low	130 Å²	130	139.2 Å²	139.2	49%	0.491	74%	0.744	S	S	.	*			trans	-142.9	115.2	169.6	-91.3	174.8	82.8	151.6	0.5	109.4	G203 N204	G203-R397 PolarHBondContact O-NE 3.3Å; G203-R397 PolarHBondContact O-NH2 2.73Å; N204-R397 VanDerWaalsContact CG-NH2 3.35Å; N204-R397 VanDerWaalsContact N-NE 3.13Å; N204-R397 PolarHBondContact OD1-NE 2.91Å; N204-R397 PolarHBondContact OD1-NH1 2.79Å; N204-R397 VanDerWaalsContact OD1-NH1 3.1Å
398	N	34	Very low	31.6	Very low	77 Å²	77	139.5 Å²	139.5	41%	0.412	74%	0.743	S	S	.	*			trans	55.4	117	157.9	-58.2	39.7	0	0	0	117.8	G203 N204	G203-N398 WeakPolarHBondContact CA-ND2 3.16Å; G203-N398 WeakPolarHBondContact CA-OD1 3.49Å; N204-N398 PolarHBondContact N-ND2 2.8Å; N204-N398 PolarHBondContact N-OD1 3.47Å; N204-N398 PolarHBondContact O-ND2 3.36Å; N204-N398 PolarHBondContact O-OD1 3.38Å
399	Q	33.2	Very low	31.5	Very low	181 Å²	181	141.9 Å²	141.9	85%	0.846	75%	0.751	S	S	*	*				71.2	120.7	76.3	-72.9	-175.8	-3.4	0	0	114.5
400	F	30.2	Very low	31.1	Very low	214 Å²	214	141.7 Å²	141.7	94%	0.939	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-102.3	144	167	-106.7	-91.9	0	0	0	110.2
401	V	30.3	Very low	31	Very low	131 Å²	131	138.5 Å²	138.5	79%	0.794	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-85.4	144.3	173.8	175.2	0	0	0	0	110.1
402	S	25.8	Very low	31.1	Very low	113 Å²	113	141.4 Å²	141.4	79%	0.79	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-80.9	131.1	175.8	-53.9	0	0	0	0	112.1
403	T	29.4	Very low	31.3	Very low	127 Å²	127	143.9 Å²	143.9	78%	0.779	77%	0.768	S	S	*	*			trans	-147.9	100.7	159.6	22.5	0	0	0	0	110.4
404	T	32.3	Very low	31.4	Very low	133 Å²	133	138.9 Å²	138.9	82%	0.816	76%	0.758	S	S	*	*			trans	-118	114.3	160.2	47.7	0	0	0	0	107.6	T406	T404-T406 PolarHBondContact O-N 2.85Å
405	N	29	Very low	31.4	Very low	165 Å²	165	141 Å²	141	88%	0.882	76%	0.76	S	S	*	*			trans	-70.3	121	-178.9	-71.1	-37.9	0	0	0	111
406	T	31.9	Very low	31.4	Very low	140 Å²	140	138.5 Å²	138.5	86%	0.859	76%	0.755	S	S	*	*			trans	-127.1	143.7	157.4	-41	0	0	0	0	108	T404	T404-T406 PolarHBondContact O-N 2.85Å
407	R	28.6	Very low	31.5	Very low	234 Å²	234	135.6 Å²	135.6	88%	0.883	75%	0.751	S	S	*	*			trans	-115.1	169.3	-161.6	-169.1	-179	-175.8	-174.5	2	110.5
408	V	32.3	Very low	31.6	Very low	113 Å²	113	136 Å²	136	69%	0.685	77%	0.768	S	S	*	*			trans	102.9	115.1	160.3	-173.6	0	0	0	0	116.7
409	N	32	Very low	31.5	Very low	146 Å²	146	135.7 Å²	135.7	78%	0.781	78%	0.777	S	S	*	*			trans	51.1	116.8	152.9	-53.2	0.4	0	0	0	120.3
410	A	28.9	Very low	31.5	Very low	96 Å²	96	133 Å²	133	79%	0.793	77%	0.773	S	S	*	*				76.9	146.1	54	0	0	0	0	0	115.2
411	A	33.9	Very low	31.5	Very low	90 Å²	90	131.3 Å²	131.3	74%	0.744	77%	0.767	S	S	*	*			trans	70.6	134.6	-170.8	0	0	0	0	0	114.2
412	D	35	Very low	31.7	Very low	131 Å²	131	130.1 Å²	130.1	70%	0.701	76%	0.762	S	S	*	*			cis	-144.6	142.7	3.8	-94.6	-25.7	0	0	0	109.8
413	H	36.4	Very low	32	Very low	162 Å²	162	131.3 Å²	131.3	75%	0.75	76%	0.764	S	S	*	*				54.3	140.2	104	-66.2	-49.9	0	0	0	116.1
414	I	33.2	Very low	32.2	Very low	132 Å²	132	130.8 Å²	130.8	68%	0.677	76%	0.761	S	S	*	*			cis	-161.5	159.5	7	-128.3	164.6	0	0	0	112.6
415	I	33.3	Very low	32.4	Very low	144 Å²	144	130 Å²	130	74%	0.738	76%	0.759	S	S	*	*			trans	27	131.2	155.4	-61	159.4	0	0	0	119.9
416	S	30.4	Very low	32.4	Very low	104 Å²	104	126.4 Å²	126.4	73%	0.727	75%	0.746	S	S	*	*			cis	100.7	138.6	19.7	-167.6	0	0	0	0	116.7
417	A	31	Very low	32.5	Very low	84 Å²	84	127.6 Å²	127.6	69%	0.694	74%	0.741	S	S	*	*			trans	65.5	165.7	173	0	0	0	0	0	115.5
418	T	33.4	Very low	32.6	Very low	138 Å²	138	121.5 Å²	121.5	85%	0.847	73%	0.731	S	S	*	*			cis	-164.5	164.6	4.7	-1.1	0	0	0	0	106.8
419	A	30.4	Very low	32.5	Very low	72 Å²	72	126.8 Å²	126.8	60%	0.595	74%	0.74	S	S	*	*			cis	-179.8	-177.7	-30.8	0	0	0	0	0	107.9
420	V	33.8	Very low	32.3	Very low	124 Å²	124	128.8 Å²	128.8	75%	0.752	74%	0.741	S	S	*	*			trans	73.3	120.9	167.3	-163.9	0	0	0	0	112.9
421	H	30.6	Very low	32.5	Very low	179 Å²	179	133 Å²	133	83%	0.829	74%	0.742	S	S	*	*				62.1	160.1	66.3	-73.5	-61.2	0	0	0	113.9
422	P	34.4	Very low	32.1	Very low	106 Å²	106	136.5 Å²	136.5	69%	0.688	74%	0.743	S	S	*	*			cis	-138.9	-172.5	-5.8	34.7	-12.4	0	0	0	116.4
423	V	32	Very low	31.9	Very low	137 Å²	137	137.3 Å²	137.3	83%	0.83	75%	0.746	S	S	*	*			trans	81.4	155.4	138.6	149.3	0	0	0	0	122.5
424	T	33.1	Very low	31.7	Very low	117 Å²	117	134.1 Å²	134.1	72%	0.718	75%	0.747	S	S	*	*			trans	-102.2	164.3	-170.1	50.4	0	0	0	0	114.6
425	P	36.6	Very low	31.7	Very low	117 Å²	117	132.9 Å²	132.9	76%	0.76	75%	0.751	S	S	*	*				-129.2	155.5	115.3	9.2	12.5	0	0	0	111.1
426	S	28.8	Very low	31.6	Very low	88 Å²	88	136.3 Å²	136.3	62%	0.615	75%	0.754	S	S	*	*			cis	99.5	151	28.8	86	0	0	0	0	115.1
427	H	35.4	Very low	32	Very low	165 Å²	165	135.8 Å²	135.8	76%	0.764	75%	0.748	S	S	*	*			trans	78.4	127.9	-173	-55.4	-71.6	0	0	0	116.4
428	T	30.4	Very low	32.1	Very low	107 Å²	107	138.9 Å²	138.9	66%	0.656	75%	0.748	S	S	*	*			cis	92.4	114.3	24.7	69.6	0	0	0	0	116.2
429	Y	29.7	Very low	32.1	Very low	224 Å²	224	136.9 Å²	136.9	88%	0.878	74%	0.74	S	S	*	*				-171	172.5	110.3	-118.5	-94.5	0	0	0	113.6
430	K	28	Very low	32.2	Very low	187 Å²	187	140 Å²	140	81%	0.813	75%	0.746	S	S	*	*			trans	-119	149.7	-176.6	-63.3	177.3	176.6	179.9	0	113.4
431	K	32.1	Very low	32	Very low	185 Å²	185	140.4 Å²	140.4	80%	0.804	74%	0.744	S	S	*	*				172.8	138	129.8	-93.7	169.6	177.8	-175.6	0	108.5
432	E	26.5	Very low	32	Very low	164 Å²	164	137 Å²	137	77%	0.766	74%	0.736	S	S	*	*			cis	92.7	139	27	-163.8	-174.8	-159	0	0	114.6
433	I	31.4	Very low	31.7	Very low	148 Å²	148	138 Å²	138	76%	0.759	74%	0.74	S	S	*	*			trans	114.9	125.2	162.8	-60.6	174	0	0	0	117
434	A	31.8	Very low	31.6	Very low	95 Å²	95	136.5 Å²	136.5	79%	0.785	73%	0.731	S	S	*	*			trans	60.7	145.8	162.4	0	0	0	0	0	119.6
435	S	33	Very low	31.5	Very low	106 Å²	106	137.2 Å²	137.2	74%	0.741	73%	0.731	S	S	*	*			cis	-155	136.1	-13.6	44.7	0	0	0	0	108.1
436	R	31.5	Very low	31	Very low	215 Å²	215	142.4 Å²	142.4	81%	0.811	74%	0.735	S	S	*	*				51.2	144.2	89.2	-114.6	-162.7	176.1	-170.3	0.6	114.6
437	P	37.8	Very low	31.2	Very low	94 Å²	94	146.4 Å²	146.4	61%	0.61	74%	0.744	S	S	*	*			cis	-144.9	167.2	6.9	45.7	-27.5	0	0	0	119
438	Q	34.2	Very low	30.8	Very low	148 Å²	148	144.6 Å²	144.6	69%	0.692	74%	0.74	S	S	*	*			trans	56.7	122.4	132.6	-73.1	166.3	-38	0	0	121.1
439	S	32	Very low	30.7	Very low	96 Å²	96	149 Å²	149	67%	0.671	75%	0.746	S	S	*	*				106.8	157.5	73.3	75	0	0	0	0	110.6
440	L	33.4	Very low	30.7	Very low	138 Å²	138	148.8 Å²	148.8	72%	0.723	74%	0.744	S	S	*	*			cis	-130.7	154.4	22	-77.7	165.9	0	0	0	109.9
441	N	28.9	Very low	30.8	Very low	132 Å²	132	145 Å²	145	71%	0.706	74%	0.737	S	S	*	*				51.5	145.3	76.7	-52.1	-11.9	0	0	0	113.3
442	T	30.6	Very low	30.8	Very low	109 Å²	109	142.5 Å²	142.5	67%	0.669	74%	0.736	S	S	*	*			cis	-157.4	140.7	23.6	-17.4	0	0	0	0	106.7
443	T	28.8	Very low	31.1	Very low	126 Å²	126	139.2 Å²	139.2	77%	0.773	73%	0.732	S	S	*	*				49.5	140	88.5	-14.6	0	0	0	0	113.3
444	V	30.4	Very low	31.1	Very low	106 Å²	106	139.5 Å²	139.5	64%	0.642	74%	0.735	S	S	*	*				-178.2	144.2	79.3	165.9	0	0	0	0	110.7
445	N	30.3	Very low	31.3	Very low	132 Å²	132	139.4 Å²	139.4	71%	0.706	73%	0.729	S	S	*	*			trans	46.9	140.6	161.2	-58.9	-13.2	0	0	0	121.6
446	R	25.9	Very low	31.3	Very low	226 Å²	226	140.2 Å²	140.2	85%	0.853	73%	0.725	S	S	*	*			cis	79.1	84.6	6.7	-151.7	-169.4	-161.1	-173.7	8	118.2
447	Q	32.7	Very low	31.5	Very low	172 Å²	172	138.1 Å²	138.1	80%	0.804	72%	0.721	S	S	*	*			trans	-155.3	118.9	152	-96.1	157.6	13.1	0	0	106
448	N	27.6	Very low	31.3	Very low	126 Å²	126	140.7 Å²	140.7	67%	0.674	73%	0.73	S	S	*	*				60.6	105.8	61.6	-75.5	2.1	0	0	0	114.7
449	Y	29.1	Very low	31.2	Very low	201 Å²	201	137.8 Å²	137.8	79%	0.788	73%	0.731	S	S	*	*				178.6	131.6	111.4	-82.2	-64.4	0	0	0	107.4
450	R	28.4	Very low	31.4	Very low	219 Å²	219	140.1 Å²	140.1	83%	0.826	74%	0.742	S	S	*	*				59.5	128.3	76.9	-123.8	-172.6	-168.2	177.9	4.1	110.8
451	T	31.4	Very low	31.2	Very low	108 Å²	108	138.5 Å²	138.5	66%	0.663	74%	0.742	S	S	*	*			cis	-160.9	158.7	44.6	44.8	0	0	0	0	114.3
452	T	30.7	Very low	31.8	Very low	131 Å²	131	137.3 Å²	137.3	80%	0.804	74%	0.742	S	S	*	*			trans	60.9	147.6	145.5	48.3	0	0	0	0	120.4
453	S	32.7	Very low	31.8	Very low	96 Å²	96	138.2 Å²	138.2	67%	0.671	75%	0.747	S	S	*	*			cis	-158.6	167.1	5.2	52	0	0	0	0	111.9
454	N	31.7	Very low	31.9	Very low	154 Å²	154	136 Å²	136	82%	0.824	74%	0.741	S	S	*	*			trans	43.2	132.5	143.5	-66.5	-1.9	0	0	0	120.9
455	S	35.5	Very low	31.8	Very low	93 Å²	93	137.4 Å²	137.4	65%	0.65	75%	0.75	S	S	*	*			cis	-167.6	167.5	5.7	61.4	0	0	0	0	114.4
456	N	33.7	Very low	31.8	Very low	123 Å²	123	138.1 Å²	138.1	66%	0.658	75%	0.752	S	S	*	*			trans	72.6	102.8	145.1	-76.7	-44	0	0	0	122.5
457	K	36.4	Very low	32	Very low	170 Å²	170	132.3 Å²	132.3	74%	0.739	75%	0.746	S	S	*	*				105	117.4	121.7	-69.5	170.2	-176.9	178.5	0	120.3
458	N	33.4	Very low	31.9	Very low	148 Å²	148	129.6 Å²	129.6	79%	0.791	75%	0.746	S	S	*	*			trans	67.9	123.6	151.2	-50.7	-1.3	0	0	0	116.3
459	A	32.3	Very low	32.2	Very low	87 Å²	87	128.5 Å²	128.5	72%	0.719	75%	0.748	S	S	*	*			cis	68.1	129.5	46.2	0	0	0	0	0	112.7
460	T	35.1	Very low	32.2	Very low	145 Å²	145	126.1 Å²	126.1	89%	0.89	75%	0.748	S	S	*	*			cis	-150.7	-172.1	12.8	-21	0	0	0	0	111.6
461	S	29.4	Very low	32.3	Very low	105 Å²	105	120.9 Å²	120.9	73%	0.734	74%	0.741	S	S	*	*			trans	-145.8	164.2	-168.3	-179.6	0	0	0	0	110.1
462	P	42.2	Very low	32.1	Very low	107 Å²	107	122.8 Å²	122.8	70%	0.695	75%	0.746	S	S	*	*			cis	-130.7	-164.2	-15.9	23	2.3	0	0	0	113.9
463	V	30	Very low	32.1	Very low	128 Å²	128	121.5 Å²	121.5	78%	0.776	74%	0.743	S	S	*	*			trans	98.5	139.1	155.9	-172.3	0	0	0	0	117.9
464	A	31	Very low	32	Very low	80 Å²	80	124.7 Å²	124.7	66%	0.661	75%	0.75	S	S	*	*			trans	95.9	98.7	165.6	0	0	0	0	0	120.3
465	T	28.8	Very low	32.2	Very low	134 Å²	134	121.2 Å²	121.2	82%	0.822	74%	0.738	S	S	*	*				64.6	149.7	127	-28.7	0	0	0	0	122.2
466	I	29.7	Very low	32.2	Very low	148 Å²	148	124.8 Å²	124.8	76%	0.759	75%	0.745	S	S	*	*			trans	95.7	108.5	160.6	-53.5	-174	0	0	0	118.3
467	S	30.3	Very low	32.3	Very low	103 Å²	103	127 Å²	127	72%	0.72	75%	0.751	S	S	*	*			trans	34.3	128.8	136.6	-49.9	0	0	0	0	124.5
468	S	30.9	Very low	32.3	Very low	115 Å²	115	122.5 Å²	122.5	80%	0.804	74%	0.741	S	S	*	*				80.6	135.3	129.1	-64	0	0	0	0	122.9
469	S	32.8	Very low	32.3	Very low	103 Å²	103	122.2 Å²	122.2	72%	0.72	74%	0.74	S	S	*	*			trans	99.2	135.7	136.2	-116.8	0	0	0	0	120.5
470	L	29.1	Very low	32.2	Very low	151 Å²	151	127.6 Å²	127.6	79%	0.791	75%	0.746	S	S	*	*			trans	69.9	148.6	151.1	-63.1	164.4	0	0	0	118.5
471	V	30.4	Very low	32.4	Very low	110 Å²	110	127.9 Å²	127.9	67%	0.667	75%	0.748	S	S	*	*			cis	-168.3	166.5	-23.8	72.9	0	0	0	0	110.5
472	L	28.8	Very low	32.4	Very low	148 Å²	148	127.2 Å²	127.2	78%	0.775	74%	0.743	S	S	*	*			trans	61.1	130	161.2	-66.5	174.1	0	0	0	119.7
473	S	29.1	Very low	31.9	Very low	104 Å²	104	128.1 Å²	128.1	73%	0.727	75%	0.747	S	S	*	*				172.4	171.3	105.2	-71.7	0	0	0	0	112.1
474	I	32.6	Very low	32	Very low	163 Å²	163	128.1 Å²	128.1	84%	0.836	75%	0.748	S	S	*	*			trans	75.6	128.3	166	-53.2	168.9	0	0	0	114.8
475	S	35	Very low	31.9	Very low	81 Å²	81	131.1 Å²	131.1	57%	0.566	75%	0.752	S	S	*	*			cis	-165.6	170.2	-16.1	-111.1	0	0	0	0	110.6
476	E	35.8	Very low	32.1	Very low	168 Å²	168	129.6 Å²	129.6	79%	0.785	75%	0.747	S	S	*	*			trans	29.3	140.4	159	-69.2	100.7	-104.7	0	0	121.4
477	E	35	Very low	31.9	Very low	168 Å²	168	132.7 Å²	132.7	79%	0.785	75%	0.749	S	S	*	*			cis	-149.8	-160.8	10.5	-139.3	-129.6	127.6	0	0	107.8	N479	E477-N479 PolarHBondContact OE1-N 3.26Å
478	S	35.7	Very low	32.1	Very low	77 Å²	77	133.8 Å²	133.8	54%	0.538	75%	0.751	S	S	.	*			cis	-151.2	-177	9.3	69.4	0	0	0	0	115.2
479	N	34.3	Very low	32.1	Very low	142 Å²	142	134.8 Å²	134.8	76%	0.759	74%	0.743	S	S	*	*			trans	58.5	78.1	152.4	-73.4	-23.2	0	0	0	117.7	E477	E477-N479 PolarHBondContact OE1-N 3.26Å
480	K	30.2	Very low	32.1	Very low	199 Å²	199	135.6 Å²	135.6	87%	0.865	74%	0.744	S	S	*	*			trans	-80.1	128.2	148.2	-93.6	-178.1	172.9	178.6	0	110.7
481	V	39.4	Very low	32	Very low	151 Å²	151	132.2 Å²	132.2	92%	0.915	73%	0.733	S	S	*	*			trans	-135.5	137.7	141.5	179.8	0	0	0	0	107.6
482	S	29.6	Very low	32.2	Very low	92 Å²	92	133.8 Å²	133.8	64%	0.643	74%	0.738	S	S	*	*			trans	-146.9	126.7	-177.5	58	0	0	0	0	110.8
483	T	31.1	Very low	32.2	Very low	126 Å²	126	133.5 Å²	133.5	77%	0.773	74%	0.737	S	S	*	*			trans	164.1	146.9	131.4	39	0	0	0	0	110.5
484	T	32.1	Very low	32.3	Very low	128 Å²	128	135.1 Å²	135.1	79%	0.785	74%	0.738	S	S	*	*			trans	62.3	143.3	159.1	47.2	0	0	0	0	117.6
485	D	30.2	Very low	32	Very low	142 Å²	142	134.9 Å²	134.9	76%	0.759	74%	0.735	S	S	*	*			cis	-153.6	174.4	-7.1	-148.6	-27.6	0	0	0	110
486	S	31.2	Very low	31.6	Very low	102 Å²	102	138.3 Å²	138.3	71%	0.713	74%	0.742	S	S	*	*			trans	60.9	116.4	167.9	60.3	0	0	0	0	117
487	R	27.1	Very low	31.1	Very low	213 Å²	213	135.2 Å²	135.2	80%	0.804	74%	0.739	S	S	*	*				78.3	102.4	52.4	-174.9	-169	175.8	171.2	0.7	113.6
488	V	34.8	Very low	30.7	Very low	126 Å²	126	133.2 Å²	133.2	76%	0.764	74%	0.738	S	S	*	*			trans	174.8	110.5	142.8	144.3	0	0	0	0	103.9
489	Q	29.1	Very low	30.1	Very low	137 Å²	137	135.9 Å²	135.9	64%	0.64	75%	0.745	S	S	*	*				58.5	121.1	76.5	-61.1	178.8	-105.2	0	0	109.9
490	T	32.8	Very low	29.6	Very low	119 Å²	119	137.2 Å²	137.2	73%	0.73	74%	0.741	S	S	*	*			cis	-143.1	164.7	23.2	27.4	0	0	0	0	109.8
491	S	28.6	Very low	29.5	Very low	80 Å²	80	134.2 Å²	134.2	56%	0.559	74%	0.739	S	S	*	*				62.2	131	62.3	120.1	0	0	0	0	111.6
492	D	33.8	Very low	28.9	Very low	143 Å²	143	130.6 Å²	130.6	77%	0.765	73%	0.725	S	S	*	*			cis	-149.3	-175	12.2	-82.5	-49.8	0	0	0	115
493	D	29.1	Very low	29	Very low	143 Å²	143	133.3 Å²	133.3	77%	0.765	73%	0.732	S	S	*	*			trans	-60.1	-178.2	-174.8	-67	-61.5	0	0	0	120.3
494	N	31	Very low	29	Very low	138 Å²	138	133.5 Å²	133.5	74%	0.738	73%	0.729	S	S	*	*			trans	83.4	124.1	171.2	-64.7	-52.2	0	0	0	116.5
495	M	26.2	Very low	28.9	Very low	158 Å²	158	133.6 Å²	133.6	78%	0.778	72%	0.723	S	S	*	*			cis	85	144.3	38.9	-69.1	-125.2	-172.3	0	0	114.9
496	Q	25.9	Very low	29.1	Very low	153 Å²	153	134.2 Å²	134.2	72%	0.715	73%	0.726	S	S	*	*			trans	69.4	109.6	173.4	-68	132.7	45.3	0	0	114
497	S	26.7	Very low	29.1	Very low	103 Å²	103	134.8 Å²	134.8	72%	0.72	73%	0.73	S	S	*	*				85.1	167.3	65.2	74.8	0	0	0	0	113.3
498	V	25.4	Very low	29.7	Very low	126 Å²	126	130 Å²	130	76%	0.764	73%	0.727	S	S	*	*			trans	79.3	113.2	-164.4	-172.8	0	0	0	0	110
499	L	22.9	Very low	29.5	Very low	132 Å²	132	128.8 Å²	128.8	69%	0.691	72%	0.724	S	S	*	*				83.8	111.2	55.3	-72.1	166	0	0	0	114.6
500	Y	24.7	Very low	29.6	Very low	171 Å²	171	129.3 Å²	129.3	67%	0.671	73%	0.731	S	S	*	*			trans	63.7	154.3	152.5	-88.2	-85.6	0	0	0	121.9
501	T	27.1	Very low	29.8	Very low	135 Å²	135	129.9 Å²	129.9	83%	0.828	74%	0.735	S	S	*	*			trans	67.4	151	169.3	62.8	0	0	0	0	118.1
502	A	28.4	Very low	30	Very low	76 Å²	76	131.2 Å²	131.2	63%	0.628	74%	0.742	S	S	*	*			cis	-167.5	158	-25.9	0	0	0	0	0	109.8
503	N	30	Very low	30.5	Very low	148 Å²	148	130.9 Å²	130.9	79%	0.791	75%	0.747	S	S	*	*			trans	63.5	149.1	161.7	-59	-0.5	0	0	0	116.6
504	D	31.7	Very low	30.8	Very low	130 Å²	130	133.2 Å²	133.2	70%	0.695	75%	0.75	S	S	*	*			cis	-152.8	152.9	34.4	-109.3	-35.3	0	0	0	115
505	I	31.1	Very low	30.9	Very low	130 Å²	130	134.9 Å²	134.9	67%	0.667	76%	0.758	S	S	*	*			trans	60	88.6	140.8	-59.2	161.5	0	0	0	119.8
506	N	34	Very low	31.6	Very low	155 Å²	155	132.6 Å²	132.6	83%	0.829	76%	0.755	S	S	*	*				153.8	139.7	112.5	-90	-28.5	0	0	0	115.3
507	S	31.6	Very low	32.2	Very low	114 Å²	114	130.1 Å²	130.1	80%	0.797	75%	0.753	S	S	*	*			trans	-108.9	-175.1	178.8	-36.7	0	0	0	0	110.9
508	P	38.9	Very low	32.4	Very low	112 Å²	112	135.8 Å²	135.8	73%	0.727	76%	0.759	S	S	*	*			cis	-139.1	-171.1	-5	41.1	-21.8	0	0	0	116
509	S	31.1	Very low	32.5	Very low	101 Å²	101	136.3 Å²	136.3	71%	0.706	75%	0.754	S	S	*	*			trans	77.8	114	147.8	61.6	0	0	0	0	122.8
510	D	31.6	Very low	33	Very low	148 Å²	148	135.4 Å²	135.4	79%	0.791	75%	0.754	S	S	*	*			trans	16.2	126.5	139.4	-54.9	-55.9	0	0	0	122.5
511	T	35.4	Very low	33.1	Very low	132 Å²	132	132.9 Å²	132.9	81%	0.81	76%	0.756	S	S	*	*				179.7	151.4	104.3	26.4	0	0	0	0	112.6
512	P	33	Very low	33.3	Very low	108 Å²	108	131.8 Å²	131.8	70%	0.701	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-78.7	151.2	171.5	32.4	-34.3	0	0	0	112.6
513	P	45.1	Very low	33.2	Very low	135 Å²	135	134.9 Å²	134.9	88%	0.877	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-75.3	151.6	-171.6	29.5	-35.4	0	0	0	114.6
514	K	34.4	Very low	33.2	Very low	192 Å²	192	135.3 Å²	135.3	84%	0.835	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-98.1	157.4	-169	-66	170.7	178.7	168.3	0	114.1
515	L	33.6	Very low	33	Very low	173 Å²	173	132.4 Å²	132.4	91%	0.906	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-57.3	135.5	154.9	-79.1	161.9	0	0	0	111.1
516	P	42.2	Very low	32.9	Very low	110 Å²	110	133.1 Å²	133.1	71%	0.714	77%	0.768	S	S	*	*			trans	-106.8	170.3	174.1	43.5	-36.6	0	0	0	111.9
517	P	38.1	Very low	32.5	Very low	102 Å²	102	132.4 Å²	132.4	66%	0.662	76%	0.763	S	S	*	*				-145	168.2	-66.8	39.1	-21.6	0	0	0	115.2
518	R	30	Very low	32.3	Very low	222 Å²	222	134.3 Å²	134.3	84%	0.838	76%	0.764	S	S	*	*			trans	67.4	157.8	140.8	-79.9	175.6	161.5	-162.3	-6.7	118.2
519	M	28.9	Very low	31.8	Very low	136 Å²	136	135.9 Å²	135.9	67%	0.67	76%	0.764	S	S	*	*			cis	-160	172.6	-5.1	-133.1	158.7	71.9	0	0	113.9
520	V	31.5	Very low	31.9	Very low	114 Å²	114	136.1 Å²	136.1	69%	0.691	76%	0.764	S	S	*	*			trans	73.2	91.1	154.7	177.2	0	0	0	0	117.6
521	T	28.3	Very low	31.7	Very low	117 Å²	117	137.4 Å²	137.4	72%	0.718	76%	0.762	S	S	*	*			trans	-19.9	142.5	134.2	51.8	0	0	0	0	117.1
522	S	29.9	Very low	31.5	Very low	113 Å²	113	140.3 Å²	140.3	79%	0.79	76%	0.764	S	S	*	*				179.5	145.6	99.9	-92.4	0	0	0	0	115.1
523	N	27.6	Very low	31.6	Very low	141 Å²	141	139.2 Å²	139.2	75%	0.754	76%	0.758	S	S	*	*			trans	-47.7	135.2	174.3	-52	-9.8	0	0	0	114.7
524	N	30	Very low	31	Very low	157 Å²	157	140.2 Å²	140.2	84%	0.84	75%	0.751	S	S	*	*				160.9	143.5	109.3	-84.9	-28.1	0	0	0	110.7
525	G	27.8	Very low	31.2	Very low	68 Å²	68	136.7 Å²	136.7	70%	0.701	75%	0.745	S	S	*	*			trans	-82.8	137.6	171.8	0	0	0	0	0	111.7
526	N	28	Very low	31.3	Very low	145 Å²	145	133.9 Å²	133.9	78%	0.775	74%	0.738	S	S	*	*			trans	-164.8	125.8	148.6	-103.6	-28.7	0	0	0	111.3
527	I	25.5	Very low	30.9	Very low	140 Å²	140	136 Å²	136	72%	0.718	74%	0.738	S	S	*	*				50.5	140.8	124.4	-59.7	174.6	0	0	0	119.8
528	L	27.9	Very low	30.9	Very low	155 Å²	155	140.5 Å²	140.5	81%	0.812	75%	0.747	S	S	*	*			trans	84.6	96.9	163	-81.3	159.3	0	0	0	121.2
529	I	27.7	Very low	31.1	Very low	144 Å²	144	134.5 Å²	134.5	74%	0.738	74%	0.735	S	S	*	*			trans	-33	133.2	137.4	-66.4	159.1	0	0	0	111.8
530	P	33	Very low	31.5	Very low	107 Å²	107	134.7 Å²	134.7	70%	0.695	73%	0.734	S	S	*	*				-157.6	130.9	94.5	38.3	-16.5	0	0	0	121.1
531	K	27.9	Very low	31.6	Very low	174 Å²	174	137.4 Å²	137.4	76%	0.757	74%	0.737	S	S	*	*				63.3	138.4	123.3	-65.3	175.5	177.3	169.7	0	123.5
532	K	30.3	Very low	31.9	Very low	194 Å²	194	138.2 Å²	138.2	84%	0.843	74%	0.741	S	S	*	*			trans	74.2	149	151.9	-73.8	174.8	179.2	-172.8	0	116.3
533	S	35.5	Very low	32.1	Very low	84 Å²	84	136.9 Å²	136.9	59%	0.587	73%	0.732	S	S	*	*			cis	-148.8	167.7	11.3	-106.9	0	0	0	0	109.5
534	Q	33.9	Very low	32.3	Very low	156 Å²	156	136.1 Å²	136.1	73%	0.729	73%	0.733	S	S	*	*			cis	-163.2	134.3	-12.5	-116	165.1	-51.9	0	0	106.6
535	V	37	Very low	32.6	Very low	118 Å²	118	133.5 Å²	133.5	72%	0.715	73%	0.726	S	S	*	*				68.6	145	95.7	168.4	0	0	0	0	114.8
536	P	36.3	Very low	32.9	Very low	115 Å²	115	137.9 Å²	137.9	75%	0.747	73%	0.728	S	S	*	*			cis	-123	-162.1	-9.1	23	1.2	0	0	0	113
537	E	34.2	Very low	33.2	Very low	154 Å²	154	138.1 Å²	138.1	72%	0.72	73%	0.729	S	S	*	*			cis	164.6	133.4	-47.1	-175.3	177.7	-172.1	0	0	110.8	V539	E537-V539 HydrophobicContact CG-CG2 4.2Å
538	K	37.4	Very low	33.5	Very low	197 Å²	197	138.1 Å²	138.1	86%	0.857	73%	0.73	S	S	*	*			trans	-178.4	113.8	142	-100.8	175.4	178.5	-174.3	0	107.8
539	V	34.4	Very low	33.6	Very low	96 Å²	96	136.3 Å²	136.3	58%	0.582	73%	0.726	S	S	*	*				70.7	122.4	69.8	175.3	0	0	0	0	109.5	E537	E537-V539 HydrophobicContact CG-CG2 4.2Å
540	E	36.7	Very low	33.9	Very low	139 Å²	139	135 Å²	135	65%	0.65	73%	0.726	S	S	*	*			cis	-155.1	150.3	42.6	-156.8	141.8	-160.2	0	0	116.1
541	K	33.6	Very low	33.8	Very low	172 Å²	172	135.4 Å²	135.4	75%	0.748	73%	0.727	S	S	*	*			trans	19.2	154	149	-56.9	162.3	-168	156.2	0	120.6
542	V	35.1	Very low	33.9	Very low	134 Å²	134	134.5 Å²	134.5	81%	0.812	73%	0.726	S	S	*	*			cis	-157.5	-165.9	25	82.7	0	0	0	0	111.1
543	S	34	Very low	33.9	Very low	85 Å²	85	131.8 Å²	131.8	59%	0.594	72%	0.716	S	S	*	*				-147.7	173.9	-104.5	-63.9	0	0	0	0	112.1
544	T	31.5	Very low	33.7	Very low	125 Å²	125	134.4 Å²	134.4	77%	0.767	72%	0.719	S	S	*	*			trans	66.8	151.2	160.6	43	0	0	0	0	118.5
545	S	37.3	Very low	33.5	Very low	101 Å²	101	133.6 Å²	133.6	71%	0.706	72%	0.715	S	S	*	*			cis	-161.6	125.8	5.2	34.1	0	0	0	0	109.3
546	H	33.2	Very low	33.1	Very low	161 Å²	161	134.3 Å²	134.3	75%	0.745	72%	0.715	S	S	*	*				97	156.8	81.6	-84	-72.2	0	0	0	116
547	L	35	Very low	33	Very low	150 Å²	150	136.4 Å²	136.4	79%	0.785	72%	0.715	S	S	*	*			trans	80.7	136.5	168.5	-59.3	116.7	0	0	0	119.1
548	N	32.4	Very low	32.8	Very low	139 Å²	139	136.6 Å²	136.6	74%	0.743	72%	0.718	S	S	*	*			cis	-163.9	159.1	-28.4	-116.2	14	0	0	0	112.6
549	T	29.3	Very low	32.5	Very low	118 Å²	118	130.5 Å²	130.5	72%	0.724	71%	0.711	S	S	*	*			trans	-82.3	179.2	165.9	37.7	0	0	0	0	111.4
550	P	34.3	Very low	32.6	Very low	115 Å²	115	133.5 Å²	133.5	75%	0.747	72%	0.72	S	S	*	*			cis	-128.5	-179.3	28.3	29.4	-3.1	0	0	0	114.6
551	T	30.1	Very low	32.2	Very low	117 Å²	117	133.3 Å²	133.3	72%	0.718	72%	0.724	S	S	*	*			cis	83.7	115.9	28.5	-39.3	0	0	0	0	115.6
552	E	31.4	Very low	32.1	Very low	155 Å²	155	131.4 Å²	131.4	72%	0.724	72%	0.722	S	S	*	*				170.1	133.1	128.7	-92.2	-175	141.7	0	0	113.5
553	Q	29.2	Very low	31.8	Very low	136 Å²	136	133 Å²	133	64%	0.636	72%	0.718	S	S	*	*			trans	62.2	151.4	130.6	-61.6	-178.8	30.1	0	0	120.9
554	Q	30.6	Very low	31.5	Very low	139 Å²	139	133.6 Å²	133.6	65%	0.65	72%	0.721	S	S	*	*			cis	-156.2	156.2	2.6	-128.5	169.1	-14.1	0	0	111.4
555	Q	30	Very low	31.3	Very low	140 Å²	140	132.6 Å²	132.6	65%	0.654	72%	0.719	S	S	*	*			trans	31.8	144.2	140.4	-67.3	178.8	-93.4	0	0	121.5
556	D	29.1	Very low	30.9	Very low	132 Å²	132	138.7 Å²	138.7	71%	0.706	73%	0.727	S	S	*	*			cis	-157	-151.6	-0.1	-110.4	-15.2	0	0	0	108.6
557	E	34.5	Very low	30.6	Very low	159 Å²	159	136.2 Å²	136.2	74%	0.743	73%	0.728	S	S	*	*			cis	-154.1	-106.7	16.1	-160.8	-154.8	-121.2	0	0	114.1
558	M	29.8	Very low	30.5	Very low	159 Å²	159	134 Å²	134	78%	0.783	73%	0.731	S	S	*	*			trans	-136.2	166.2	-162.1	-76	179.3	-72	0	0	115.2
559	G	31.1	Very low	30.4	Very low	69 Å²	69	133 Å²	133	71%	0.711	74%	0.735	S	S	*	*			trans	157.1	79.3	156.9	0	0	0	0	0	119.7
560	M	35.5	Very low	30.6	Very low	158 Å²	158	132.9 Å²	132.9	78%	0.778	74%	0.736	S	S	*	*			trans	40.3	114.6	151.9	-77.8	66.4	-170.5	0	0	122.9
561	D	29.7	Very low	30.3	Very low	135 Å²	135	136.5 Å²	136.5	72%	0.722	74%	0.741	S	S	*	*				44.1	141.9	102.6	-36	-27.4	0	0	0	119
562	D	30.4	Very low	30.3	Very low	133 Å²	133	137.6 Å²	137.6	71%	0.711	75%	0.747	S	S	*	*			cis	179	179.5	28.3	-141.7	-21.7	0	0	0	114.2
563	F	28.8	Very low	30.1	Very low	166 Å²	166	136.7 Å²	136.7	73%	0.728	75%	0.747	S	S	*	*			trans	55	100.2	158.9	-84.5	-91.2	0	0	0	124.5
564	C	27.4	Very low	30.2	Very low	99 Å²	99	139.4 Å²	139.4	67%	0.669	76%	0.76	S	S	*	*				80.5	122.7	112.7	-93.9	0	0	0	0	125.9
565	S	28.4	Very low	30.1	Very low	103 Å²	103	137.8 Å²	137.8	72%	0.72	76%	0.761	S	S	*	*				102.3	142.5	113.4	-80.7	0	0	0	0	123.5
566	R	29.2	Very low	29.9	Very low	229 Å²	229	138.6 Å²	138.6	86%	0.864	77%	0.768	S	S	*	*			trans	71.3	88.7	154.8	-74.7	-178.8	171.5	-163.4	-4.9	121.1
567	S	27.2	Very low	29.9	Very low	110 Å²	110	141.7 Å²	141.7	77%	0.769	78%	0.775	S	S	*	*				33.7	113.9	114.3	62.2	0	0	0	0	121
568	A	31.6	Very low	29.6	Very low	104 Å²	104	139.5 Å²	139.5	86%	0.86	77%	0.773	S	S	*	*			trans	-164.9	157.2	134.3	0	0	0	0	0	111.4
569	S	30.5	Very low	29.4	Very low	117 Å²	117	139.3 Å²	139.3	82%	0.818	77%	0.765	S	S	*	*			trans	-91.3	178.2	164.9	-66.9	0	0	0	0	109.5
570	P	34.6	Very low	29.3	Very low	115 Å²	115	145.2 Å²	145.2	75%	0.747	77%	0.771	S	S	*	*			cis	-142	-171.2	12.1	44.5	-24.9	0	0	0	116.9
571	F	27.5	Very low	29.1	Very low	192 Å²	192	143.3 Å²	143.3	84%	0.842	77%	0.773	S	S	*	*			trans	2.8	114.3	155	-102.6	-94.3	0	0	0	119.6
572	V	30.5	Very low	29.1	Very low	139 Å²	139	144.6 Å²	144.6	84%	0.842	78%	0.78	S	S	*	*			trans	-144.7	140.7	143.1	-178.3	0	0	0	0	109.5
573	N	27.4	Very low	29.2	Very low	137 Å²	137	143.4 Å²	143.4	73%	0.733	78%	0.782	S	S	*	*			trans	-76	142.5	176.1	-59.2	-69.5	0	0	0	112.6
574	Q	31.4	Very low	29.5	Very low	193 Å²	193	141 Å²	141	90%	0.902	78%	0.782	S	S	*	*			trans	-137.6	151.6	146.9	-76.6	-152.9	15.8	0	0	111.8
575	P	27.5	Very low	29.7	Very low	105 Å²	105	144.5 Å²	144.5	68%	0.682	79%	0.788	S	S	*	*			trans	-103.4	154.7	-164.3	38.9	-34.9	0	0	0	115.4
576	I	26.5	Very low	30	Very low	156 Å²	156	145.4 Å²	145.4	80%	0.8	79%	0.792	S	S	*	*			trans	44.5	108.5	143.8	-51.8	162.4	0	0	0	117.3
577	K	29.4	Very low	30.1	Very low	197 Å²	197	140 Å²	140	86%	0.857	78%	0.784	S	S	*	*				-162.5	141.6	119.6	-105.5	156.7	-170.8	178.9	0	112.2
578	T	26.2	Very low	30.4	Very low	113 Å²	113	142.8 Å²	142.8	69%	0.693	79%	0.788	S	S	*	*			trans	-68.8	159.3	163.5	48.3	0	0	0	0	110.7
579	Y	26.4	Very low	30.5	Very low	156 Å²	156	142.9 Å²	142.9	61%	0.612	78%	0.78	S	S	*	*				-166.9	160	120.7	-101.7	-64	0	0	0	112.4	N283	N283-Y579 HydrophobicContact CB-CD2 4.49Å; N283-Y579 HydrophobicContact CB-CE1 4.25Å; N283-Y579 HydrophobicContact CB-CE2 3.71Å; N283-Y579 WeakPolarHBondContact ND2-CD2 3.24Å; N283-Y579 VanDerWaalsContact OD1-CE2 3.29Å; N283-Y579 WeakPolarHBondContact OD1-CE2 3.48Å
580	F	28.4	Very low	30.6	Very low	193 Å²	193	143.4 Å²	143.4	85%	0.846	78%	0.778	S	S	*	*			trans	-78.9	160.4	171.8	-82	-113.1	0	0	0	111.1
581	S	32.6	Very low	30.7	Very low	118 Å²	118	147.6 Å²	147.6	83%	0.825	78%	0.784	S	S	*	*			trans	-119.2	134.1	159.6	45.7	0	0	0	0	110.4
582	N	28.5	Very low	30.8	Very low	161 Å²	161	145.6 Å²	145.6	86%	0.861	78%	0.782	S	S	*	*			trans	-131.9	161.1	176.6	-95.8	4.6	0	0	0	108.8
583	S	33.2	Very low	30.9	Very low	109 Å²	109	146.7 Å²	146.7	76%	0.762	78%	0.783	S	S	*	*			trans	-147.6	143.1	168.8	67.7	0	0	0	0	108.3
584	T	34.2	Very low	31.2	Very low	116 Å²	116	146.6 Å²	146.6	71%	0.712	78%	0.783	S	S	*	*			cis	-157.3	135.4	9.5	-29.2	0	0	0	0	110
585	E	31.7	Very low	31.4	Very low	172 Å²	172	144.8 Å²	144.8	80%	0.804	78%	0.779	S	S	*	*			trans	43	175	145	-70.3	-171.1	161.8	0	0	123.4
586	P	35.1	Very low	31.9	Very low	122 Å²	122	146.1 Å²	146.1	79%	0.792	78%	0.78	S	S	*	*			cis	-124.3	-173.7	-6.4	15.6	10.8	0	0	0	116.8
587	V	32.6	Very low	32.3	Very low	116 Å²	116	144.5 Å²	144.5	70%	0.703	78%	0.778	S	S	*	*			trans	-108	151	-161.7	166.1	0	0	0	0	114.9	P589	V587-P589 HydrophobicContact CG1-CG 4.14Å
588	I	33	Very low	32.3	Very low	167 Å²	167	143.6 Å²	143.6	86%	0.856	78%	0.779	S	S	*	*			trans	-147.3	130.7	145.5	-54.2	-176.2	0	0	0	111
589	P	34.1	Very low	32.6	Very low	106 Å²	106	147.7 Å²	147.7	69%	0.688	79%	0.79	S	S	*	*			trans	-135	150.7	176.8	39.6	-23.4	0	0	0	116.5	V587	V587-P589 HydrophobicContact CG1-CG 4.14Å
590	V	32.8	Very low	32.8	Very low	128 Å²	128	148.5 Å²	148.5	78%	0.776	80%	0.797	S	S	*	*			trans	-146.9	111.3	170.6	-177.8	0	0	0	0	114.8
591	K	34.9	Very low	33.1	Very low	203 Å²	203	145 Å²	145	88%	0.883	79%	0.793	S	S	*	*			trans	58.1	155	146.3	-63.9	-176.9	178.2	-175.7	0	124
592	L	29.4	Very low	32.9	Very low	151 Å²	151	144.7 Å²	144.7	79%	0.791	79%	0.787	S	S	*	*			trans	-105.3	174.7	178.5	-69.4	148.4	0	0	0	111.3
593	N	34.2	Very low	33	Very low	162 Å²	162	147.8 Å²	147.8	87%	0.866	79%	0.788	S	S	*	*			trans	-158.5	155.8	135.7	-95.2	-4.4	0	0	0	108.5
594	D	32.4	Very low	33.1	Very low	135 Å²	135	148.4 Å²	148.4	72%	0.722	79%	0.789	S	S	*	*			trans	-101.9	164.5	-171.4	-51.9	-90.4	0	0	0	112.9
595	D	36.4	Very low	32.7	Very low	155 Å²	155	148.5 Å²	148.5	83%	0.829	80%	0.795	S	S	*	*				-177	143.9	123.5	-100.1	-22.8	0	0	0	116.3
596	D	37.8	Very low	32.8	Very low	133 Å²	133	147.2 Å²	147.2	71%	0.711	80%	0.799	S	S	*	*			trans	60.1	127.7	145.3	-89	-19.9	0	0	0	129.6
597	T	34.2	Very low	32.5	Very low	121 Å²	121	150.6 Å²	150.6	74%	0.742	80%	0.801	S	S	*	*			trans	76.8	95.4	139.2	57.1	0	0	0	0	124.6
598	M	30.5	Very low	32.5	Very low	179 Å²	179	153.6 Å²	153.6	88%	0.882	81%	0.812	S	S	*	*				1	135.1	128.9	-75.7	-80.4	178.1	0	0	121.5
599	E	32.4	Very low	32.2	Very low	198 Å²	198	150.5 Å²	150.5	93%	0.925	81%	0.806	S	S	*	*				-157.9	165.4	111.8	-130.7	-172.6	-167.3	0	0	113.1
600	K	31.2	Very low	32.2	Very low	173 Å²	173	152.3 Å²	152.3	75%	0.752	82%	0.815	S	S	*	*			trans	-165.8	132.8	-172	-180	-168.6	176.7	-172.7	0	114.7
601	P	33.5	Very low	32.1	Very low	119 Å²	119	154.4 Å²	154.4	77%	0.773	82%	0.816	S	S	*	*			trans	-136	133.4	136.2	21.3	-1.1	0	0	0	112.6
602	T	30	Very low	31.8	Very low	113 Å²	113	150.7 Å²	150.7	69%	0.693	81%	0.81	S	S	*	*				94	117.7	59.5	-64	0	0	0	0	113.1
603	Y	28.9	Very low	32	Very low	225 Å²	225	152.9 Å²	152.9	88%	0.882	82%	0.816	S	S	*	*			trans	-100.3	156.1	173	-68.1	-94.8	0	0	0	111.5
604	P	35.5	Very low	31.7	Very low	122 Å²	122	154.1 Å²	154.1	79%	0.792	82%	0.817	S	S	*	*			trans	-131.4	153.2	145.3	36.5	-24.5	0	0	0	113.8
605	S	27.3	Very low	31.8	Very low	119 Å²	119	153.5 Å²	153.5	83%	0.832	82%	0.821	S	S	*	*			trans	-126.7	121.3	175.2	-70.2	0	0	0	0	111.1
606	T	32.5	Very low	31.8	Very low	144 Å²	144	154.5 Å²	154.5	88%	0.883	82%	0.82	S	S	*	*			trans	-140.6	149.2	170.2	-42.3	0	0	0	0	111.2
607	K	30.1	Very low	31.6	Very low	194 Å²	194	154 Å²	154	84%	0.843	82%	0.816	S	S	*	*			trans	-89.2	150.6	-178.7	-49.1	159.1	-175.7	170.7	0	110.5
608	L	32.1	Very low	31.8	Very low	178 Å²	178	153.2 Å²	153.2	93%	0.932	82%	0.822	S	S	*	*				-168.8	177.4	110.4	-151.6	50.2	0	0	0	110.8
609	S	26.4	Very low	32.1	Very low	103 Å²	103	153.5 Å²	153.5	72%	0.72	82%	0.818	S	S	*	*			trans	-115.5	136.3	-176.4	-177.9	0	0	0	0	111.8
610	T	33.9	Very low	32.3	Very low	143 Å²	143	153.5 Å²	153.5	88%	0.877	82%	0.818	S	S	*	*			trans	-145.1	154.4	164.4	-61.1	0	0	0	0	109.1
611	Q	30.1	Very low	32.5	Very low	172 Å²	172	150.7 Å²	150.7	80%	0.804	82%	0.82	S	S	*	*			trans	-96.2	156	-171.6	-79.4	-177.8	-17.2	0	0	114.9
612	V	30.1	Very low	32.4	Very low	126 Å²	126	154.2 Å²	154.2	76%	0.764	83%	0.829	S	S	*	*			trans	60.5	111.2	143.1	171.8	0	0	0	0	118.8
613	Q	31.9	Very low	32.5	Very low	196 Å²	196	154.6 Å²	154.6	92%	0.916	83%	0.826	S	S	*	*				-164.3	155.5	116.2	-105.8	170.9	13.9	0	0	111.3
614	E	27.8	Very low	32.6	Very low	188 Å²	188	149.6 Å²	149.6	88%	0.879	82%	0.824	S	S	*	*			trans	-134.3	131.9	-175.9	175.5	176.8	-143.4	0	0	109.1
615	P	35.8	Very low	32.7	Very low	123 Å²	123	147.6 Å²	147.6	80%	0.799	81%	0.813	S	S	*	*			trans	-120.6	161.2	166.4	37.2	-26.3	0	0	0	113.4
616	E	35.7	Very low	33.3	Very low	175 Å²	175	150.1 Å²	150.1	82%	0.818	81%	0.812	S	S	*	*			trans	-86.5	144.8	-160.9	-63.7	-179.7	101.7	0	0	116.9
617	I	33.1	Very low	33.5	Very low	124 Å²	124	152.3 Å²	152.3	64%	0.636	81%	0.812	S	S	*	*			trans	36.5	115.6	131.7	-50.3	171.2	0	0	0	118.4	K619	I617-K619 HydrophobicContact CG2-CG 3.75Å
618	A	38.9	Very low	33.8	Very low	103 Å²	103	151.6 Å²	151.6	85%	0.851	81%	0.811	S	S	*	*			trans	-113.9	143	139.9	0	0	0	0	0	109.1
619	K	36.6	Very low	34.1	Very low	186 Å²	186	151.9 Å²	151.9	81%	0.809	81%	0.807	S	S	*	*			trans	-112.5	119	179.3	-69	177.6	-177.7	171	0	110.5	I617	I617-K619 HydrophobicContact CG2-CG 3.75Å
620	E	37.9	Very low	34.8	Very low	198 Å²	198	152.5 Å²	152.5	93%	0.925	81%	0.807	S	S	*	*			trans	-123.8	149.6	159.1	-67.2	-166.9	146.8	0	0	109.3
621	S	34.9	Very low	35.1	Very low	113 Å²	113	150.6 Å²	150.6	79%	0.79	79%	0.787	S	S	*	*			trans	-128.1	105.2	-165.4	58	0	0	0	0	112.6
622	M	31.2	Very low	36	Very low	194 Å²	194	150.8 Å²	150.8	96%	0.956	78%	0.78	S	S	*	*			trans	-179.3	145.5	162.2	-98.4	158.5	86.6	0	0	106.4
623	D	31.7	Very low	36.8	Very low	120 Å²	120	152.1 Å²	152.1	64%	0.642	78%	0.782	S	S	*	*			cis	-136.4	153.7	-6.9	169.9	45.4	0	0	0	108.9	S625	D623-S625 VanDerWaalsContact C-N 3.31Å; D623-S625 PolarHBondContact O-N 3.45Å; D623-S625 WeakPolarHBondContact OD2-CB 3.43Å; D623-S625 PolarHBondContact OD2-OG 2.87Å
624	S	30.8	Very low	38	Very low	121 Å²	121	148.6 Å²	148.6	85%	0.846	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	25	-162.8	60.4	0	0	0	0	115.8
625	S	37.3	Very low	39.6	Very low	79 Å²	79	145.8 Å²	145.8	55%	0.552	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	-11.2	-161.8	47.5	0	0	0	0	116.8	D623	D623-S625 VanDerWaalsContact C-N 3.31Å; D623-S625 PolarHBondContact O-N 3.45Å; D623-S625 WeakPolarHBondContact OD2-CB 3.43Å; D623-S625 PolarHBondContact OD2-OG 2.87Å
626	H	40.6	Very low	40.8	Very low	173 Å²	173	146.1 Å²	146.1	80%	0.801	76%	0.76	S	S	*	*	S	Bend	trans	-109.9	-5.4	-160.9	-102.3	-79.7	0	0	0	119.4
627	E	36.3	Very low	42.3	Very low	189 Å²	189	142 Å²	142	88%	0.883	75%	0.747	S	S	*	*	S	Bend	trans	-86	-4.8	-172.8	-68.3	-161.4	120	0	0	116.4	H629	E627-H629 PolarHBondContact O-N 2.96Å
628	Q	36.5	Very low	44.4	Very low	179 Å²	179	139.5 Å²	139.5	84%	0.836	74%	0.735	S	S	*	*			trans	-85.2	14.2	-166.6	-61.8	-165.2	10.5	0	0	116.7
629	H	39.6	Very low	46.2	Very low	184 Å²	184	139.5 Å²	139.5	85%	0.852	73%	0.726	S	S	*	*			trans	-120	35.6	-164.2	-128.8	60.1	0	0	0	118	E627	E627-H629 PolarHBondContact O-N 2.96Å
630	T	41.1	Very low	47.9	Very low	117 Å²	117	132.6 Å²	132.6	72%	0.718	70%	0.704	S	S	*	*			trans	-125.3	1.1	174.9	56	0	0	0	0	116.2	R632	T630-R632 PolarHBondContact O-N 2.92Å; T630-R632 VanDerWaalsContact O-N 3.15Å
631	F	39	Very low	49.3	Very low	103 Å²	103	124.3 Å²	124.3	45%	0.452	67%	0.667	S	S	.	*			trans	-72.3	105.8	171	-81.9	-81.5	0	0	0	111.2	Q15 T18 I633	Q15-F631 HydrophobicContact CB-CE1 4.37Å; Q15-F631 HydrophobicContact CB-CZ 4.15Å; Q15-F631 VanDerWaalsContact CD-CZ 3.45Å; Q15-F631 HydrophobicContact CG-CE1 4.07Å; Q15-F631 HydrophobicContact CG-CE2 4.36Å; Q15-F631 HydrophobicContact CG-CZ 3.55Å; T18-F631 HydrophobicContact CG2-CD1 4.2Å; F631-I633 PolarHBondContact O-N 3.32Å
632	R	48.5	Very low	51.2	Low	175 Å²	175	125.3 Å²	125.3	66%	0.66	65%	0.654	S	S	*	*			trans	-69.8	98.1	171.2	-59	-160.2	-160.5	173	4.4	109.6	T18 S19 T630 V634	T18-R632 HydrophobicContact CG2-CB 4.43Å; T18-R632 WeakPolarHBondContact CG2-O 3.16Å; T18-R632 PolarHBondContact OG1-N 3.47Å; T18-R632 VanDerWaalsContact OG1-N 3.14Å; S19-R632 VanDerWaalsContact CB-CZ 3.46Å; S19-R632 PolarHBondContact OG-NE 2.92Å; S19-R632 VanDerWaalsContact OG-NE 3.12Å; S19-R632 PolarHBondContact OG-NH2 3.41Å; T630-R632 PolarHBondContact O-N 2.92Å; T630-R632 VanDerWaalsContact O-N 3.15Å; R632-V634 PolarHBondContact O-N 2.99Å
633	I	47.9	Very low	53.5	Low	155 Å²	155	123.8 Å²	123.8	80%	0.795	64%	0.638	S	S	*	*			trans	-48.2	111	175.2	-59.5	174.3	0	0	0	108.9	F631 K635	F631-I633 PolarHBondContact O-N 3.32Å; I633-K635 PolarHBondContact O-N 3.04Å; I633-K635 VanDerWaalsContact O-N 3.09Å
634	V	57.6	Low	55.4	Low	122 Å²	122	120.9 Å²	120.9	74%	0.739	62%	0.618	S	S	*	*			trans	-65.6	113	177	178.2	0	0	0	0	106.9	R632	R632-V634 PolarHBondContact O-N 2.99Å
635	K	60.5	Low	57.5	Low	128 Å²	128	119.2 Å²	119.2	56%	0.557	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-53.7	124	178.9	-73.6	-168.8	175.4	-174.9	0	108.8	I633 V637 N1116	I633-K635 PolarHBondContact O-N 3.04Å; I633-K635 VanDerWaalsContact O-N 3.09Å; K635-V637 PolarHBondContact O-N 3.07Å; K635-V637 VanDerWaalsContact O-N 3.16Å; K635-N1116 PolarHBondContact NZ-O 3.07Å
636	P	62.1	Low	59.6	Low	130 Å²	130	118.8 Å²	118.8	84%	0.844	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-63.4	120.1	-178.6	24.5	-33	0	0	0	109.7
637	V	67.2	Low	61.6	Low	89 Å²	89	115.6 Å²	115.6	54%	0.539	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-95.2	137.1	175.1	-176.5	0	0	0	0	108.2	K635 P639	K635-V637 PolarHBondContact O-N 3.07Å; K635-V637 VanDerWaalsContact O-N 3.16Å; V637-P639 WeakPolarHBondContact O-CD 3.48Å
638	N	76.1	Confident	63.4	Low	72 Å²	72	109.6 Å²	109.6	39%	0.385	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-54.1	120.3	172.3	176.5	-7.9	0	0	0	109.5	A640 V641 Y642	N638-A640 PolarHBondContact O-N 3.26Å; N638-A640 VanDerWaalsContact O-N 3.13Å; N638-A640 WeakPolarHBondContact OD1-CB 3.32Å; N638-A640 PolarHBondContact OD1-N 3.41Å; N638-V641 HydrophobicContact CB-CB 4.13Å; N638-V641 HydrophobicContact CB-CG2 3.84Å; N638-V641 WeakPolarHBondContact O-CB 3.39Å; N638-V641 PolarHBondContact O-N 3.04Å; N638-Y642 PolarHBondContact O-N 3.35Å
639	P	76.5	Confident	65.4	Low	102 Å²	102	106 Å²	106	66%	0.662	52%	0.522	S	S	*	.	H	α-helix	trans	-57.9	-28.1	-177.9	-27.8	36.4	0	0	0	114.3	V637 R643	V637-P639 WeakPolarHBondContact O-CD 3.48Å; P639-R643 WeakPolarHBondContact O-CB 3.43Å; P639-R643 PolarHBondContact O-N 2.93Å
640	A	71.8	Confident	67.5	Low	42 Å²	42	102.1 Å²	102.1	35%	0.347	51%	0.505	S	S	.	.	H	α-helix	trans	-67.5	-44.7	173.8	0	0	0	0	0	111.8	N638 R643 R644	N638-A640 PolarHBondContact O-N 3.26Å; N638-A640 VanDerWaalsContact O-N 3.13Å; N638-A640 WeakPolarHBondContact OD1-CB 3.32Å; N638-A640 PolarHBondContact OD1-N 3.41Å; A640-R643 PolarHBondContact O-N 3.35Å; A640-R644 WeakPolarHBondContact O-CG 3.22Å; A640-R644 PolarHBondContact O-N 2.8Å
641	V	68.5	Low	69.4	Low	24 Å²	24	99.4 Å²	99.4	15%	0.145	50%	0.495	C	S	.	.	H	α-helix	trans	-65.4	-42.1	176.8	178.1	0	0	0	0	110.6	N638 F645 D868 P1120	N638-V641 HydrophobicContact CB-CB 4.13Å; N638-V641 HydrophobicContact CB-CG2 3.84Å; N638-V641 WeakPolarHBondContact O-CB 3.39Å; N638-V641 PolarHBondContact O-N 3.04Å; V641-F645 VanDerWaalsContact O-CB 3.28Å; V641-F645 WeakPolarHBondContact O-CB 3.42Å; V641-F645 PolarHBondContact O-N 3.37Å; V641-D868 HydrophobicContact CG2-CB 3.85Å; V641-P1120 HydrophobicContact CG1-CG 4.43Å
642	Y	75.4	Confident	71.1	Confident	134 Å²	134	95.7 Å²	95.7	53%	0.525	48%	0.479	S	S	.	.	H	α-helix	trans	-64.6	-43	176	-177.4	-104	0	0	0	112.1	N638 F645 M646	N638-Y642 PolarHBondContact O-N 3.35Å; Y642-F645 PolarHBondContact O-N 2.81Å; Y642-M646 HydrophobicContact CD1-CG 4.31Å; Y642-M646 HydrophobicContact CD2-CG 4.48Å; Y642-M646 HydrophobicContact CE1-CG 3.84Å; Y642-M646 HydrophobicContact CE2-CG 4.03Å; Y642-M646 HydrophobicContact CE2-SD 4.29Å; Y642-M646 WeakPolarHBondContact O-CG 3.39Å; Y642-M646 PolarHBondContact O-N 3.3Å
643	R	79.1	Confident	72.7	Confident	162 Å²	162	90.9 Å²	90.9	61%	0.611	47%	0.466	S	S	*	.	H	α-helix	trans	-57.5	-54.8	173.6	174	-176.8	-63.8	-80.7	1.4	111.4	P639 A640 F645 M646 E647	P639-R643 WeakPolarHBondContact O-CB 3.43Å; P639-R643 PolarHBondContact O-N 2.93Å; A640-R643 PolarHBondContact O-N 3.35Å; R643-F645 VanDerWaalsContact C-N 3.3Å; R643-F645 PolarHBondContact O-N 3.36Å; R643-M646 PolarHBondContact O-N 2.79Å; R643-M646 VanDerWaalsContact O-N 3.11Å; R643-E647 WeakPolarHBondContact CD-OE1 3.35Å; R643-E647 VanDerWaalsContact CG-CD 3.46Å; R643-E647 HydrophobicContact CG-CG 4.31Å; R643-E647 WeakPolarHBondContact CG-OE1 3.39Å; R643-E647 IonicContact NH1-OE1 3.95Å; R643-E647 WeakPolarHBondContact O-CB 3.31Å; R643-E647 WeakPolarHBondContact O-CG 3.22Å; R643-E647 PolarHBondContact O-N 3.46Å
644	R	70.8	Confident	74.4	Confident	58 Å²	58	84.7 Å²	84.7	22%	0.219	44%	0.441	C	S	.	.	H	α-helix	trans	-57.2	-42.9	178.5	-73.9	176.4	177.6	-158.4	-0.1	111.9	A640 E647 Q648 Y864 D868	A640-R644 WeakPolarHBondContact O-CG 3.22Å; A640-R644 PolarHBondContact O-N 2.8Å; R644-E647 PolarHBondContact O-N 3.2Å; R644-Q648 WeakPolarHBondContact O-CB 3.46Å; R644-Q648 PolarHBondContact O-N 2.86Å; R644-Y864 PolarHBondContact NH1-O 2.72Å; R644-D868 WeakPolarHBondContact CD-OD1 3.49Å; R644-D868 VanDerWaalsContact CD-OD2 3.26Å; R644-D868 WeakPolarHBondContact CD-OD2 3.36Å; R644-D868 IonicContact CZ-OD1 3.76Å; R644-D868 IonicContact CZ-OD2 3.57Å; R644-D868 IonicContact NE-OD1 3.45Å; R644-D868 PolarHBondContact NE-OD1 2.87Å; R644-D868 IonicContact NE-OD2 3.68Å; R644-D868 IonicContact NH1-OD1 3.97Å; R644-D868 PolarHBondContact NH1-OD1 3.41Å; R644-D868 IonicContact NH1-OD2 2.71Å; R644-D868 PolarHBondContact NH1-OD2 2.84Å
645	F	76.1	Confident	75.6	Confident	86 Å²	86	83.6 Å²	83.6	38%	0.377	42%	0.424	S	S	.	.	H	α-helix	trans	-59.6	-46.6	175.4	173.6	-99	0	0	0	111.8	V641 Y642 R643 R649 P1122	V641-F645 VanDerWaalsContact O-CB 3.28Å; V641-F645 WeakPolarHBondContact O-CB 3.42Å; V641-F645 PolarHBondContact O-N 3.37Å; Y642-F645 PolarHBondContact O-N 2.81Å; R643-F645 VanDerWaalsContact C-N 3.3Å; R643-F645 PolarHBondContact O-N 3.36Å; F645-R649 WeakPolarHBondContact O-CB 3.45Å; F645-R649 PolarHBondContact O-N 3.1Å; F645-P1122 HydrophobicContact CD2-CB 4.32Å
646	M	81.6	Confident	76.6	Confident	70 Å²	70	78.8 Å²	78.8	35%	0.345	40%	0.403	S	S	.	.	H	α-helix	trans	-67.7	-42.9	178.7	-70.5	-63.3	-72.7	0	0	112.3	Y642 R643 R649 M650	Y642-M646 HydrophobicContact CD1-CG 4.31Å; Y642-M646 HydrophobicContact CD2-CG 4.48Å; Y642-M646 HydrophobicContact CE1-CG 3.84Å; Y642-M646 HydrophobicContact CE2-CG 4.03Å; Y642-M646 HydrophobicContact CE2-SD 4.29Å; Y642-M646 WeakPolarHBondContact O-CG 3.39Å; Y642-M646 PolarHBondContact O-N 3.3Å; R643-M646 PolarHBondContact O-N 2.79Å; R643-M646 VanDerWaalsContact O-N 3.11Å; M646-R649 PolarHBondContact O-N 2.89Å; M646-M650 WeakPolarHBondContact O-CG 3.35Å; M646-M650 PolarHBondContact O-N 3.17Å
647	E	81.9	Confident	77.7	Confident	106 Å²	106	78.8 Å²	78.8	50%	0.495	39%	0.392	S	S	.	.	H	α-helix	trans	-60.1	-49.4	176.5	-73.5	166	-179.8	0	0	111.3	R643 R644 M650 A651	R643-E647 WeakPolarHBondContact CD-OE1 3.35Å; R643-E647 VanDerWaalsContact CG-CD 3.46Å; R643-E647 HydrophobicContact CG-CG 4.31Å; R643-E647 WeakPolarHBondContact CG-OE1 3.39Å; R643-E647 IonicContact NH1-OE1 3.95Å; R643-E647 WeakPolarHBondContact O-CB 3.31Å; R643-E647 WeakPolarHBondContact O-CG 3.22Å; R643-E647 PolarHBondContact O-N 3.46Å; R644-E647 PolarHBondContact O-N 3.2Å; E647-M650 PolarHBondContact O-N 3.13Å; E647-A651 PolarHBondContact O-N 3.42Å
648	Q	74.6	Confident	78.7	Confident	64 Å²	64	81 Å²	81	30%	0.299	39%	0.391	S	S	.	.	H	α-helix	trans	-64.3	-41.2	175.6	-170.4	174	6.7	0	0	111.6	R644 M650 A651 D652 N1123	R644-Q648 WeakPolarHBondContact O-CB 3.46Å; R644-Q648 PolarHBondContact O-N 2.86Å; Q648-M650 VanDerWaalsContact C-N 3.33Å; Q648-M650 PolarHBondContact O-N 3.25Å; Q648-A651 WeakPolarHBondContact O-CB 3.29Å; Q648-A651 PolarHBondContact O-N 3.36Å; Q648-A651 VanDerWaalsContact O-N 3.16Å; Q648-D652 PolarHBondContact O-N 3.47Å; Q648-N1123 PolarHBondContact NE2-ND2 2.8Å; Q648-N1123 PolarHBondContact OE1-ND2 3.48Å
649	R	78.6	Confident	79.1	Confident	103 Å²	103	80.9 Å²	80.9	39%	0.389	39%	0.388	S	S	.	.	H	α-helix	trans	-61.7	-38	178.1	-179.3	63.7	-176.1	124.5	4.3	112.5	F645 M646 I653	F645-R649 WeakPolarHBondContact O-CB 3.45Å; F645-R649 PolarHBondContact O-N 3.1Å; M646-R649 PolarHBondContact O-N 2.89Å; R649-I653 HydrophobicContact CG-CD1 4.39Å; R649-I653 WeakPolarHBondContact O-CD1 3.39Å; R649-I653 VanDerWaalsContact O-CG1 3.27Å; R649-I653 WeakPolarHBondContact O-CG1 3.49Å; R649-I653 PolarHBondContact O-N 2.83Å; R649-I653 VanDerWaalsContact O-N 3.1Å
650	M	82.9	Confident	79.7	Confident	102 Å²	102	79.1 Å²	79.1	50%	0.502	37%	0.368	S	S	.	.	H	α-helix	trans	-69.6	-41.7	173.4	-68.3	-54.6	106.3	0	0	111.6	M646 E647 Q648 D652 I653 G654	M646-M650 WeakPolarHBondContact O-CG 3.35Å; M646-M650 PolarHBondContact O-N 3.17Å; E647-M650 PolarHBondContact O-N 3.13Å; Q648-M650 VanDerWaalsContact C-N 3.33Å; Q648-M650 PolarHBondContact O-N 3.25Å; M650-D652 VanDerWaalsContact C-N 3.34Å; M650-D652 PolarHBondContact O-N 3.43Å; M650-I653 HydrophobicContact CE-CD1 3.74Å; M650-I653 PolarHBondContact O-N 3Å; M650-I653 HydrophobicContact SD-CD1 4.43Å; M650-G654 PolarHBondContact O-N 3.37Å
651	A	80.4	Confident	80.5	Confident	60 Å²	60	82.1 Å²	82.1	50%	0.496	37%	0.373	S	S	.	.	H	α-helix	trans	-61.5	-40.6	175.4	0	0	0	0	0	112.4	E647 Q648 G654 R655	E647-A651 PolarHBondContact O-N 3.42Å; Q648-A651 WeakPolarHBondContact O-CB 3.29Å; Q648-A651 PolarHBondContact O-N 3.36Å; Q648-A651 VanDerWaalsContact O-N 3.16Å; A651-G654 PolarHBondContact O-N 2.61Å; A651-R655 WeakPolarHBondContact O-CB 3.29Å; A651-R655 PolarHBondContact O-N 3.49Å
652	D	75.5	Confident	81.6	Confident	25 Å²	25	86.2 Å²	86.2	13%	0.134	39%	0.391	C	S	.	.	H	α-helix	trans	-63.9	-43.3	173.9	-77.5	-42.7	0	0	0	112.2	Q648 M650 R655 I656	Q648-D652 PolarHBondContact O-N 3.47Å; M650-D652 VanDerWaalsContact C-N 3.34Å; M650-D652 PolarHBondContact O-N 3.43Å; D652-R655 PolarHBondContact O-N 3.34Å; D652-R655 IonicContact OD1-CZ 3.36Å; D652-R655 VanDerWaalsContact OD1-CZ 3.23Å; D652-R655 IonicContact OD1-NH1 3.37Å; D652-R655 PolarHBondContact OD1-NH1 2.98Å; D652-R655 IonicContact OD1-NH2 3.28Å; D652-R655 PolarHBondContact OD1-NH2 3.47Å; D652-I656 WeakPolarHBondContact O-CB 3.34Å; D652-I656 VanDerWaalsContact O-CG1 3.27Å; D652-I656 WeakPolarHBondContact O-CG1 3.44Å; D652-I656 PolarHBondContact O-N 2.98Å
653	I	82.1	Confident	82.4	Confident	74 Å²	74	82.7 Å²	82.7	38%	0.379	38%	0.376	S	S	.	.	H	α-helix	trans	-61.5	-45.8	175.1	-70.6	166	0	0	0	110.5	R649 M650 R655 I656 H657	R649-I653 HydrophobicContact CG-CD1 4.39Å; R649-I653 WeakPolarHBondContact O-CD1 3.39Å; R649-I653 VanDerWaalsContact O-CG1 3.27Å; R649-I653 WeakPolarHBondContact O-CG1 3.49Å; R649-I653 PolarHBondContact O-N 2.83Å; R649-I653 VanDerWaalsContact O-N 3.1Å; M650-I653 HydrophobicContact CE-CD1 3.74Å; M650-I653 PolarHBondContact O-N 3Å; M650-I653 HydrophobicContact SD-CD1 4.43Å; I653-R655 VanDerWaalsContact C-N 3.33Å; I653-R655 PolarHBondContact O-N 3.16Å; I653-I656 PolarHBondContact O-N 3.46Å; I653-H657 WeakPolarHBondContact O-CB 3.28Å; I653-H657 PolarHBondContact O-N 3.36Å
654	G	83.8	Confident	82.9	Confident	26 Å²	26	79.1 Å²	79.1	27%	0.268	36%	0.363	S	S	.	.	H	α-helix	trans	-62.5	-37.8	176.5	0	0	0	0	0	112.9	M650 A651 R658	M650-G654 PolarHBondContact O-N 3.37Å; A651-G654 PolarHBondContact O-N 2.61Å; G654-R658 WeakPolarHBondContact O-CG 3.44Å; G654-R658 PolarHBondContact O-N 3.33Å; G654-R658 PolarHBondContact O-NH1 3.31Å
655	R	82.7	Confident	83.9	Confident	99 Å²	99	79.5 Å²	79.5	37%	0.374	37%	0.369	S	S	.	.	H	α-helix	trans	-67	-50.7	174.9	-166.2	-171.7	59.5	-102.5	-9.5	111.3	A651 D652 I653 H657 R658 E659	A651-R655 WeakPolarHBondContact O-CB 3.29Å; A651-R655 PolarHBondContact O-N 3.49Å; D652-R655 PolarHBondContact O-N 3.34Å; D652-R655 IonicContact OD1-CZ 3.36Å; D652-R655 VanDerWaalsContact OD1-CZ 3.23Å; D652-R655 IonicContact OD1-NH1 3.37Å; D652-R655 PolarHBondContact OD1-NH1 2.98Å; D652-R655 IonicContact OD1-NH2 3.28Å; D652-R655 PolarHBondContact OD1-NH2 3.47Å; I653-R655 VanDerWaalsContact C-N 3.33Å; I653-R655 PolarHBondContact O-N 3.16Å; R655-H657 VanDerWaalsContact C-N 3.26Å; R655-H657 PolarHBondContact O-N 2.94Å; R655-R658 PolarHBondContact O-N 3.32Å; R655-E659 WeakPolarHBondContact CD-OE1 3.28Å; R655-E659 HydrophobicContact CG-CG 4.22Å; R655-E659 WeakPolarHBondContact CG-OE1 3.43Å; R655-E659 IonicContact NE-OE1 3.63Å; R655-E659 PolarHBondContact NE-OE1 3.07Å; R655-E659 WeakPolarHBondContact O-CG 3.48Å; R655-E659 PolarHBondContact O-N 3.12Å
656	I	81.3	Confident	84.6	Confident	26 Å²	26	83.5 Å²	83.5	13%	0.133	38%	0.382	C	S	.	.	H	α-helix	trans	-57.8	-39.8	178.1	-68.5	164.6	0	0	0	110.8	D652 I653 R660 M696	D652-I656 WeakPolarHBondContact O-CB 3.34Å; D652-I656 VanDerWaalsContact O-CG1 3.27Å; D652-I656 WeakPolarHBondContact O-CG1 3.44Å; D652-I656 PolarHBondContact O-N 2.98Å; I653-I656 PolarHBondContact O-N 3.46Å; I656-R660 HydrophobicContact CG2-CG 4.38Å; I656-R660 WeakPolarHBondContact O-CB 3.42Å; I656-R660 WeakPolarHBondContact O-CG 3.05Å; I656-R660 PolarHBondContact O-N 3.03Å; I656-M696 HydrophobicContact CG2-SD 4.38Å
657	H	85.6	Confident	85	Confident	131 Å²	131	82 Å²	82	61%	0.606	38%	0.375	S	S	*	.	H	α-helix	trans	-62.7	-44.5	175.4	-177	91.9	0	0	0	112.3	I653 R655 R660 K661	I653-H657 WeakPolarHBondContact O-CB 3.28Å; I653-H657 PolarHBondContact O-N 3.36Å; R655-H657 VanDerWaalsContact C-N 3.26Å; R655-H657 PolarHBondContact O-N 2.94Å; H657-R660 PolarHBondContact O-N 3.3Å; H657-K661 PolarHBondContact O-N 3.29Å
658	R	87.3	Confident	85.5	Confident	136 Å²	136	79.4 Å²	79.4	51%	0.513	36%	0.363	S	S	.	.	H	α-helix	trans	-62.9	-48.9	174.9	-70.7	-171.4	-56.3	-88	2.7	112.1	G654 R655 R660 K661 E662	G654-R658 WeakPolarHBondContact O-CG 3.44Å; G654-R658 PolarHBondContact O-N 3.33Å; G654-R658 PolarHBondContact O-NH1 3.31Å; R655-R658 PolarHBondContact O-N 3.32Å; R658-R660 PolarHBondContact O-N 3.02Å; R658-K661 CarbonylContact O-C 3.46Å; R658-K661 WeakPolarHBondContact O-CA 3.3Å; R658-K661 WeakPolarHBondContact O-CB 3.43Å; R658-K661 PolarHBondContact O-N 2.8Å; R658-E662 WeakPolarHBondContact O-CB 3.4Å; R658-E662 WeakPolarHBondContact O-CG 3.47Å; R658-E662 PolarHBondContact O-N 3.34Å
659	E	85.6	Confident	86.3	Confident	69 Å²	69	78.9 Å²	78.9	32%	0.322	37%	0.367	S	S	.	.	H	α-helix	trans	-58.4	-33.2	177.7	-69.7	165.5	176.8	0	0	112.8	R655 R663	R655-E659 WeakPolarHBondContact CD-OE1 3.28Å; R655-E659 HydrophobicContact CG-CG 4.22Å; R655-E659 WeakPolarHBondContact CG-OE1 3.43Å; R655-E659 IonicContact NE-OE1 3.63Å; R655-E659 PolarHBondContact NE-OE1 3.07Å; R655-E659 WeakPolarHBondContact O-CG 3.48Å; R655-E659 PolarHBondContact O-N 3.12Å; E659-R663 WeakPolarHBondContact O-CB 3.36Å; E659-R663 VanDerWaalsContact O-CG 3.31Å; E659-R663 WeakPolarHBondContact O-CG 3.38Å; E659-R663 PolarHBondContact O-N 3.46Å; E659-R663 PolarHBondContact O-NE 2.91Å
660	R	87.2	Confident	86.8	Confident	65 Å²	65	78 Å²	78	25%	0.245	37%	0.367	C	S	.	.	H	α-helix	trans	-73.7	-42.2	173.5	-71.2	-172.9	66.5	-166.2	-7.8	112	I656 H657 R658 R664 E692	I656-R660 HydrophobicContact CG2-CG 4.38Å; I656-R660 WeakPolarHBondContact O-CB 3.42Å; I656-R660 WeakPolarHBondContact O-CG 3.05Å; I656-R660 PolarHBondContact O-N 3.03Å; H657-R660 PolarHBondContact O-N 3.3Å; R658-R660 PolarHBondContact O-N 3.02Å; R660-R664 PolarHBondContact O-N 2.7Å; R660-E692 WeakPolarHBondContact CB-OE1 3.44Å; R660-E692 VanDerWaalsContact CG-OE1 3.23Å; R660-E692 WeakPolarHBondContact CG-OE1 3.48Å; R660-E692 IonicContact NE-OE1 3.35Å; R660-E692 PolarHBondContact NE-OE1 2.77Å; R660-E692 IonicContact NE-OE2 3.08Å
661	K	90.4	Very high	87.2	Confident	104 Å²	104	73.3 Å²	73.3	45%	0.452	34%	0.344	S	S	.	.	H	α-helix	trans	-59.7	-54.5	172.6	171.8	163.2	-176.4	178	0	110.8	H657 R658 R663 R664 D665	H657-K661 PolarHBondContact O-N 3.29Å; R658-K661 CarbonylContact O-C 3.46Å; R658-K661 WeakPolarHBondContact O-CA 3.3Å; R658-K661 WeakPolarHBondContact O-CB 3.43Å; R658-K661 PolarHBondContact O-N 2.8Å; K661-R663 VanDerWaalsContact C-N 3.29Å; K661-R663 PolarHBondContact O-N 2.99Å; K661-R664 PolarHBondContact O-N 3Å; K661-R664 VanDerWaalsContact O-N 3.07Å; K661-D665 WeakPolarHBondContact CE-OD2 3.46Å; K661-D665 WeakPolarHBondContact CG-OD2 3.46Å; K661-D665 WeakPolarHBondContact O-CB 3.36Å; K661-D665 PolarHBondContact O-N 3.4Å; K661-D665 VanDerWaalsContact O-OD1 3.06Å
662	E	90.8	Very high	87.7	Confident	110 Å²	110	74.4 Å²	74.4	51%	0.514	35%	0.348	S	S	.	.	H	α-helix	trans	-57.2	-37.9	-178.8	-70.9	164.3	-150.7	0	0	113.1	R658 R666	R658-E662 WeakPolarHBondContact O-CB 3.4Å; R658-E662 WeakPolarHBondContact O-CG 3.47Å; R658-E662 PolarHBondContact O-N 3.34Å; E662-R666 WeakPolarHBondContact O-CB 3.31Å; E662-R666 PolarHBondContact O-N 2.99Å
663	R	91.5	Very high	88.4	Confident	60 Å²	60	79.8 Å²	79.8	23%	0.226	37%	0.37	C	S	.	.	H	α-helix	trans	-71.7	-34.2	176.4	-76.8	-178.9	-66.3	128.6	-1	113.4	E659 K661 L667 E692	E659-R663 WeakPolarHBondContact O-CB 3.36Å; E659-R663 VanDerWaalsContact O-CG 3.31Å; E659-R663 WeakPolarHBondContact O-CG 3.38Å; E659-R663 PolarHBondContact O-N 3.46Å; E659-R663 PolarHBondContact O-NE 2.91Å; K661-R663 VanDerWaalsContact C-N 3.29Å; K661-R663 PolarHBondContact O-N 2.99Å; R663-L667 WeakPolarHBondContact O-CB 3.4Å; R663-L667 PolarHBondContact O-N 3.28Å; R663-E692 IonicContact CZ-OE1 3.96Å; R663-E692 IonicContact CZ-OE2 2.81Å; R663-E692 VanDerWaalsContact CZ-OE2 3.23Å; R663-E692 IonicContact NH1-OE1 2.74Å; R663-E692 PolarHBondContact NH1-OE1 3.47Å; R663-E692 IonicContact NH1-OE2 2.76Å; R663-E692 PolarHBondContact NH1-OE2 2.9Å; R663-E692 IonicContact NH2-OE1 2.66Å; R663-E692 PolarHBondContact NH2-OE1 3.43Å; R663-E692 VanDerWaalsContact NH2-OE1 3.16Å; R663-E692 IonicContact NH2-OE2 3.74Å; R663-E692 PolarHBondContact NH2-OE2 3.18Å
664	R	90	Very high	88.7	Confident	87 Å²	87	81.2 Å²	81.2	33%	0.328	38%	0.382	S	S	.	.	H	α-helix	trans	-69.7	-50.7	171.4	179.6	-167.1	60.9	-148.4	-6.4	111	R660 K661 R666 L667 E668 L688	R660-R664 PolarHBondContact O-N 2.7Å; K661-R664 PolarHBondContact O-N 3Å; K661-R664 VanDerWaalsContact O-N 3.07Å; R664-R666 VanDerWaalsContact C-N 3.26Å; R664-R666 PolarHBondContact O-N 3.19Å; R664-L667 WeakPolarHBondContact O-CA 3.4Å; R664-L667 WeakPolarHBondContact O-CB 3.27Å; R664-L667 PolarHBondContact O-N 3.44Å; R664-E668 PolarHBondContact O-N 3.39Å; R664-L688 HydrophobicContact CB-CD2 3.78Å; R664-L688 HydrophobicContact CG-CD2 4.15Å
665	D	91.8	Very high	88.9	Confident	66 Å²	66	82.6 Å²	82.6	35%	0.353	40%	0.396	S	S	.	.	H	α-helix	trans	-64.4	-33.2	-176.1	-59	5.5	0	0	0	110.8	K661 S669	K661-D665 WeakPolarHBondContact CE-OD2 3.46Å; K661-D665 WeakPolarHBondContact CG-OD2 3.46Å; K661-D665 WeakPolarHBondContact O-CB 3.36Å; K661-D665 PolarHBondContact O-N 3.4Å; K661-D665 VanDerWaalsContact O-OD1 3.06Å; D665-S669 PolarHBondContact O-N 3.45Å; D665-S669 VanDerWaalsContact O-N 3.15Å
666	R	91.4	Very high	89	Confident	171 Å²	171	80.4 Å²	80.4	65%	0.645	39%	0.392	S	S	*	.	H	α-helix	trans	-63.4	-44.6	167.2	-174.1	-174.5	-59.9	-166.6	1.5	112.3	E662 R664 S669 E670	E662-R666 WeakPolarHBondContact O-CB 3.31Å; E662-R666 PolarHBondContact O-N 2.99Å; R664-R666 VanDerWaalsContact C-N 3.26Å; R664-R666 PolarHBondContact O-N 3.19Å; R666-S669 WeakPolarHBondContact O-CB 3.47Å; R666-S669 PolarHBondContact O-N 3.49Å; R666-E670 PolarHBondContact O-N 3.18Å
667	L	90.3	Very high	89.4	Confident	38 Å²	38	83.3 Å²	83.3	20%	0.199	41%	0.407	C	S	.	.	H	α-helix	trans	-63.9	-43.7	-179.5	-172.1	62.6	0	0	0	111.7	R663 R664 S669 E670 M671 M684 L688	R663-L667 WeakPolarHBondContact O-CB 3.4Å; R663-L667 PolarHBondContact O-N 3.28Å; R664-L667 WeakPolarHBondContact O-CA 3.4Å; R664-L667 WeakPolarHBondContact O-CB 3.27Å; R664-L667 PolarHBondContact O-N 3.44Å; L667-S669 VanDerWaalsContact C-N 3.3Å; L667-S669 PolarHBondContact O-N 3.13Å; L667-E670 PolarHBondContact O-N 3.44Å; L667-M671 HydrophobicContact CG-CE 4.19Å; L667-M671 HydrophobicContact CG-CG 4.48Å; L667-M671 HydrophobicContact CG-SD 4.3Å; L667-M671 WeakPolarHBondContact O-CB 3.39Å; L667-M671 VanDerWaalsContact O-CG 3.25Å; L667-M671 WeakPolarHBondContact O-CG 3.4Å; L667-M671 PolarHBondContact O-N 3.28Å; L667-M684 HydrophobicContact CD1-CG 3.76Å; L667-M684 HydrophobicContact CD1-SD 4.1Å; L667-M684 HydrophobicContact CD2-CG 4.02Å; L667-M684 HydrophobicContact CG-CG 4.08Å; L667-L688 HydrophobicContact CB-CD2 4.44Å; L667-L688 HydrophobicContact CD2-CB 3.61Å; L667-L688 HydrophobicContact CD2-CD1 4.5Å; L667-L688 HydrophobicContact CD2-CD2 3.67Å; L667-L688 HydrophobicContact CD2-CG 4.1Å
668	E	91.4	Very high	89.6	Confident	51 Å²	51	81.3 Å²	81.3	24%	0.238	40%	0.398	C	S	.	.	H	α-helix	trans	-56.7	-44.9	171.8	-60.8	-58.8	146.9	0	0	110.8	R664 E670 M671 S672 R685	R664-E668 PolarHBondContact O-N 3.39Å; E668-E670 PolarHBondContact O-N 3.28Å; E668-M671 HydrophobicContact CB-CE 4.47Å; E668-M671 HydrophobicContact CG-CE 4.28Å; E668-M671 PolarHBondContact O-N 3.48Å; E668-M671 WeakPolarHBondContact OE1-CE 3.4Å; E668-M671 WeakPolarHBondContact OE2-CE 3.12Å; E668-S672 PolarHBondContact O-N 3.49Å; E668-S672 PolarHBondContact O-OG 3.43Å; E668-R685 WeakPolarHBondContact OE1-CD 3.43Å; E668-R685 WeakPolarHBondContact OE1-CG 3.11Å; E668-R685 IonicContact OE1-CZ 3.82Å; E668-R685 IonicContact OE1-NE 2.78Å; E668-R685 PolarHBondContact OE1-NE 3.47Å; E668-R685 IonicContact OE1-NH2 3.93Å; E668-R685 IonicContact OE2-CZ 2.71Å; E668-R685 IonicContact OE2-NE 3.95Å; E668-R685 PolarHBondContact OE2-NE 2.94Å; E668-R685 VanDerWaalsContact OE2-NE 3.13Å; E668-R685 IonicContact OE2-NH2 3.53Å; E668-R685 PolarHBondContact OE2-NH2 3.09Å
669	S	91	Very high	89.8	Confident	54 Å²	54	80.1 Å²	80.1	38%	0.378	40%	0.402	S	S	.	.	H	α-helix	trans	-59.2	-44.5	177.3	-169.8	0	0	0	0	113.3	D665 R666 L667 S672 K673	D665-S669 PolarHBondContact O-N 3.45Å; D665-S669 VanDerWaalsContact O-N 3.15Å; R666-S669 WeakPolarHBondContact O-CB 3.47Å; R666-S669 PolarHBondContact O-N 3.49Å; L667-S669 VanDerWaalsContact C-N 3.3Å; L667-S669 PolarHBondContact O-N 3.13Å; S669-S672 PolarHBondContact O-N 3.28Å; S669-K673 VanDerWaalsContact O-CG 3.32Å; S669-K673 WeakPolarHBondContact O-CG 3.4Å; S669-K673 PolarHBondContact O-N 3.07Å
670	E	89.9	Confident	90	Very high	84 Å²	84	78.1 Å²	78.1	39%	0.393	40%	0.397	S	S	.	.	H	α-helix	trans	-68.9	-39.3	176.6	-55.4	-44.5	136.7	0	0	112	R666 L667 E668 S672 K673 V674	R666-E670 PolarHBondContact O-N 3.18Å; L667-E670 PolarHBondContact O-N 3.44Å; E668-E670 PolarHBondContact O-N 3.28Å; E670-S672 VanDerWaalsContact C-N 3.27Å; E670-S672 PolarHBondContact O-N 2.94Å; E670-K673 PolarHBondContact O-N 3.1Å; E670-K673 IonicContact OE1-NZ 3.63Å; E670-K673 PolarHBondContact OE1-NZ 3.03Å; E670-K673 WeakPolarHBondContact OE2-CD 3.36Å; E670-K673 IonicContact OE2-NZ 2.74Å; E670-K673 PolarHBondContact OE2-NZ 3.43Å; E670-V674 WeakPolarHBondContact O-CG2 3.29Å; E670-V674 PolarHBondContact O-N 3.16Å
671	M	91.4	Very high	90.2	Very high	4 Å²	4	77.5 Å²	77.5	2%	0.02	40%	0.395	C	S	.	.	H	α-helix	trans	-65.1	-28.4	175.4	-68.7	-173.1	-55.9	0	0	113.4	L667 E668 L676 R681 M684 R685	L667-M671 HydrophobicContact CG-CE 4.19Å; L667-M671 HydrophobicContact CG-CG 4.48Å; L667-M671 HydrophobicContact CG-SD 4.3Å; L667-M671 WeakPolarHBondContact O-CB 3.39Å; L667-M671 VanDerWaalsContact O-CG 3.25Å; L667-M671 WeakPolarHBondContact O-CG 3.4Å; L667-M671 PolarHBondContact O-N 3.28Å; E668-M671 HydrophobicContact CB-CE 4.47Å; E668-M671 HydrophobicContact CG-CE 4.28Å; E668-M671 PolarHBondContact O-N 3.48Å; E668-M671 WeakPolarHBondContact OE1-CE 3.4Å; E668-M671 WeakPolarHBondContact OE2-CE 3.12Å; M671-L676 HydrophobicContact CB-CD1 4.31Å; M671-L676 HydrophobicContact CG-CD1 4.02Å; M671-R681 HydrophobicContact CB-CG 4.19Å; M671-R681 PolarHBondContact O-NE 2.84Å; M671-R681 HydrophobicContact SD-CB 4.06Å; M671-R681 HydrophobicContact SD-CG 4.17Å; M671-M684 HydrophobicContact CG-CG 4.11Å; M671-M684 HydrophobicContact SD-CB 3.57Å; M671-M684 VanDerWaalsContact SD-CB 3.57Å; M671-M684 HydrophobicContact SD-CG 3.57Å; M671-M684 VanDerWaalsContact SD-CG 3.57Å; M671-R685 HydrophobicContact CE-CG 3.93Å
672	S	89.8	Confident	90.3	Very high	83 Å²	83	76.1 Å²	76.1	58%	0.58	40%	0.395	S	S	*	.	H	α-helix	trans	-73.1	-45.3	170.3	-65.4	0	0	0	0	111.8	E668 S669 E670 V674 G675	E668-S672 PolarHBondContact O-N 3.49Å; E668-S672 PolarHBondContact O-OG 3.43Å; S669-S672 PolarHBondContact O-N 3.28Å; E670-S672 VanDerWaalsContact C-N 3.27Å; E670-S672 PolarHBondContact O-N 2.94Å; S672-V674 PolarHBondContact O-N 3.1Å; S672-G675 PolarHBondContact O-N 2.98Å
673	K	90.3	Very high	90.3	Very high	137 Å²	137	77.5 Å²	77.5	60%	0.596	40%	0.401	S	S	*	.	H	α-helix	trans	-62.3	-40	179.4	-70.6	171.9	-155.7	166.7	0	113.4	S669 E670 G675	S669-K673 VanDerWaalsContact O-CG 3.32Å; S669-K673 WeakPolarHBondContact O-CG 3.4Å; S669-K673 PolarHBondContact O-N 3.07Å; E670-K673 PolarHBondContact O-N 3.1Å; E670-K673 IonicContact OE1-NZ 3.63Å; E670-K673 PolarHBondContact OE1-NZ 3.03Å; E670-K673 WeakPolarHBondContact OE2-CD 3.36Å; E670-K673 IonicContact OE2-NZ 2.74Å; E670-K673 PolarHBondContact OE2-NZ 3.43Å; K673-G675 VanDerWaalsContact C-N 3.26Å; K673-G675 PolarHBondContact O-N 3.32Å
674	V	89.8	Confident	90.2	Very high	104 Å²	104	78.1 Å²	78.1	63%	0.63	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-11.7	-178.9	178.6	0	0	0	0	111.9	E670 S672 L676	E670-V674 WeakPolarHBondContact O-CG2 3.29Å; E670-V674 PolarHBondContact O-N 3.16Å; S672-V674 PolarHBondContact O-N 3.1Å; V674-L676 VanDerWaalsContact C-N 3.28Å; V674-L676 HydrophobicContact CB-CG 4.21Å; V674-L676 HydrophobicContact CG1-CD2 3.73Å; V674-L676 HydrophobicContact CG1-CG 3.92Å; V674-L676 PolarHBondContact O-N 2.85Å
675	G	86.6	Confident	90.3	Very high	55 Å²	55	77.3 Å²	77.3	57%	0.567	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.5	23.7	175.8	0	0	0	0	0	114.6	S672 K673	S672-G675 PolarHBondContact O-N 2.98Å; K673-G675 VanDerWaalsContact C-N 3.26Å; K673-G675 PolarHBondContact O-N 3.32Å
676	L	86.6	Confident	90.3	Very high	54 Å²	54	77.5 Å²	77.5	28%	0.283	41%	0.41	S	S	.	.			trans	-53.1	154.4	-176.2	-66.4	176.3	0	0	0	113.4	M671 V674 A680 R681	M671-L676 HydrophobicContact CB-CD1 4.31Å; M671-L676 HydrophobicContact CG-CD1 4.02Å; V674-L676 VanDerWaalsContact C-N 3.28Å; V674-L676 HydrophobicContact CB-CG 4.21Å; V674-L676 HydrophobicContact CG1-CD2 3.73Å; V674-L676 HydrophobicContact CG1-CG 3.92Å; V674-L676 PolarHBondContact O-N 2.85Å; L676-A680 HydrophobicContact CB-CB 4.2Å; L676-A680 HydrophobicContact CD1-CB 4.42Å; L676-A680 HydrophobicContact CD2-CB 4.43Å; L676-R681 HydrophobicContact CB-CG 4.18Å; L676-R681 PolarHBondContact O-NH1 3Å; L676-R681 PolarHBondContact O-NH2 2.76Å
677	D	89.4	Confident	90.3	Very high	86 Å²	86	73 Å²	73	46%	0.46	40%	0.398	S	S	.	.			trans	-69.1	161	168.9	97.6	-65.2	0	0	0	111.1	N679 A680 R681	D677-N679 VanDerWaalsContact C-N 3.27Å; D677-N679 PolarHBondContact O-N 2.95Å; D677-N679 WeakPolarHBondContact OD2-CB 3.06Å; D677-N679 PolarHBondContact OD2-N 3.33Å; D677-N679 PolarHBondContact OD2-ND2 3.05Å; D677-A680 PolarHBondContact O-N 3.25Å; D677-A680 WeakPolarHBondContact OD1-CB 3.04Å; D677-A680 PolarHBondContact OD1-N 3.17Å; D677-R681 WeakPolarHBondContact O-CG 3.26Å; D677-R681 PolarHBondContact O-N 3.46Å
678	E	90.1	Very high	90.3	Very high	89 Å²	89	72.5 Å²	72.5	42%	0.416	40%	0.396	S	S	.	.	H	α-helix	trans	-69.7	-25.3	-174.9	-162.3	55.7	-152	0	0	112.9	R681 V682 R685	E678-R681 PolarHBondContact O-N 3.09Å; E678-R681 WeakPolarHBondContact OE2-CD 3.4Å; E678-R681 IonicContact OE2-CZ 2.67Å; E678-R681 IonicContact OE2-NE 3.23Å; E678-R681 IonicContact OE2-NH1 2.63Å; E678-R681 PolarHBondContact OE2-NH1 2.84Å; E678-V682 WeakPolarHBondContact O-CB 3.38Å; E678-V682 VanDerWaalsContact O-CG2 3.3Å; E678-V682 WeakPolarHBondContact O-CG2 3.25Å; E678-V682 PolarHBondContact O-N 3.11Å; E678-R685 IonicContact OE1-CZ 2.73Å; E678-R685 IonicContact OE1-NH1 2.84Å; E678-R685 PolarHBondContact OE1-NH1 3.24Å; E678-R685 IonicContact OE1-NH2 3.02Å
679	N	90.9	Very high	90.1	Very high	112 Å²	112	76.9 Å²	76.9	60%	0.599	41%	0.41	S	S	*	.	H	α-helix	trans	-67.8	-45.4	173.5	-56.3	-72.9	0	0	0	110.8	D677 R681 V682 Q683	D677-N679 VanDerWaalsContact C-N 3.27Å; D677-N679 PolarHBondContact O-N 2.95Å; D677-N679 WeakPolarHBondContact OD2-CB 3.06Å; D677-N679 PolarHBondContact OD2-N 3.33Å; D677-N679 PolarHBondContact OD2-ND2 3.05Å; N679-R681 VanDerWaalsContact C-N 3.32Å; N679-R681 PolarHBondContact O-N 2.99Å; N679-V682 PolarHBondContact O-N 3.08Å; N679-Q683 WeakPolarHBondContact O-CB 3.22Å; N679-Q683 VanDerWaalsContact O-CG 3.29Å; N679-Q683 WeakPolarHBondContact O-CG 3.25Å; N679-Q683 PolarHBondContact O-N 2.83Å
680	A	90.1	Very high	90	Very high	26 Å²	26	80.6 Å²	80.6	22%	0.215	42%	0.42	C	S	.	.	H	α-helix	trans	-61.3	-38.7	172.6	0	0	0	0	0	111.9	L676 D677 Q683 M684	L676-A680 HydrophobicContact CB-CB 4.2Å; L676-A680 HydrophobicContact CD1-CB 4.42Å; L676-A680 HydrophobicContact CD2-CB 4.43Å; D677-A680 PolarHBondContact O-N 3.25Å; D677-A680 WeakPolarHBondContact OD1-CB 3.04Å; D677-A680 PolarHBondContact OD1-N 3.17Å; A680-Q683 PolarHBondContact O-N 3.48Å; A680-M684 WeakPolarHBondContact O-CB 3.17Å; A680-M684 PolarHBondContact O-N 2.69Å
681	R	90.6	Very high	89.8	Confident	53 Å²	53	82.1 Å²	82.1	20%	0.2	43%	0.425	C	S	.	.	H	α-helix	trans	-61.4	-47.3	172.7	-63.6	-157	-170.1	86.8	9.9	112.1	M671 L676 D677 E678 N679 Q683 M684 R685	M671-R681 HydrophobicContact CB-CG 4.19Å; M671-R681 PolarHBondContact O-NE 2.84Å; M671-R681 HydrophobicContact SD-CB 4.06Å; M671-R681 HydrophobicContact SD-CG 4.17Å; L676-R681 HydrophobicContact CB-CG 4.18Å; L676-R681 PolarHBondContact O-NH1 3Å; L676-R681 PolarHBondContact O-NH2 2.76Å; D677-R681 WeakPolarHBondContact O-CG 3.26Å; D677-R681 PolarHBondContact O-N 3.46Å; E678-R681 PolarHBondContact O-N 3.09Å; E678-R681 WeakPolarHBondContact OE2-CD 3.4Å; E678-R681 IonicContact OE2-CZ 2.67Å; E678-R681 IonicContact OE2-NE 3.23Å; E678-R681 IonicContact OE2-NH1 2.63Å; E678-R681 PolarHBondContact OE2-NH1 2.84Å; N679-R681 VanDerWaalsContact C-N 3.32Å; N679-R681 PolarHBondContact O-N 2.99Å; R681-Q683 PolarHBondContact O-N 3.45Å; R681-M684 PolarHBondContact O-N 3.31Å; R681-R685 WeakPolarHBondContact O-CB 3.35Å; R681-R685 VanDerWaalsContact O-CG 3.27Å; R681-R685 WeakPolarHBondContact O-CG 3.25Å; R681-R685 PolarHBondContact O-N 3.23Å
682	V	91.9	Very high	89.5	Confident	75 Å²	75	82.3 Å²	82.3	46%	0.455	43%	0.426	S	S	.	.	H	α-helix	trans	-62.7	-42.5	177.9	168.8	0	0	0	0	111.7	E678 N679 C686	E678-V682 WeakPolarHBondContact O-CB 3.38Å; E678-V682 VanDerWaalsContact O-CG2 3.3Å; E678-V682 WeakPolarHBondContact O-CG2 3.25Å; E678-V682 PolarHBondContact O-N 3.11Å; N679-V682 PolarHBondContact O-N 3.08Å; V682-C686 WeakPolarHBondContact O-CB 3.4Å; V682-C686 PolarHBondContact O-N 3.31Å
683	Q	91.1	Very high	89.3	Confident	138 Å²	138	81.8 Å²	81.8	65%	0.645	42%	0.422	S	S	*	.	H	α-helix	trans	-61.1	-45.1	174	-72.5	177.8	32.8	0	0	111.8	N679 A680 R681 C686 L687	N679-Q683 WeakPolarHBondContact O-CB 3.22Å; N679-Q683 VanDerWaalsContact O-CG 3.29Å; N679-Q683 WeakPolarHBondContact O-CG 3.25Å; N679-Q683 PolarHBondContact O-N 2.83Å; A680-Q683 PolarHBondContact O-N 3.48Å; R681-Q683 PolarHBondContact O-N 3.45Å; Q683-C686 CarbonylContact O-C 3.59Å; Q683-C686 WeakPolarHBondContact O-CA 3.39Å; Q683-C686 WeakPolarHBondContact O-CB 3.37Å; Q683-C686 PolarHBondContact O-N 3.5Å; Q683-C686 VanDerWaalsContact O-N 3.16Å; Q683-L687 PolarHBondContact O-N 3.47Å
684	M	89.7	Confident	88.8	Confident	73 Å²	73	78.7 Å²	78.7	36%	0.36	41%	0.412	S	S	.	.	H	α-helix	trans	-68.3	-39.7	-178.9	-172.7	60.3	72.8	0	0	112	L667 M671 A680 R681 C686 L687 L688	L667-M684 HydrophobicContact CD1-CG 3.76Å; L667-M684 HydrophobicContact CD1-SD 4.1Å; L667-M684 HydrophobicContact CD2-CG 4.02Å; L667-M684 HydrophobicContact CG-CG 4.08Å; M671-M684 HydrophobicContact CG-CG 4.11Å; M671-M684 HydrophobicContact SD-CB 3.57Å; M671-M684 VanDerWaalsContact SD-CB 3.57Å; M671-M684 HydrophobicContact SD-CG 3.57Å; M671-M684 VanDerWaalsContact SD-CG 3.57Å; A680-M684 WeakPolarHBondContact O-CB 3.17Å; A680-M684 PolarHBondContact O-N 2.69Å; R681-M684 PolarHBondContact O-N 3.31Å; M684-C686 VanDerWaalsContact C-N 3.34Å; M684-C686 PolarHBondContact O-N 2.89Å; M684-L687 PolarHBondContact O-N 3.19Å; M684-L687 HydrophobicContact SD-CD2 4.2Å; M684-L688 PolarHBondContact O-N 3.47Å
685	R	92.3	Very high	88.1	Confident	71 Å²	71	74.9 Å²	74.9	27%	0.268	39%	0.387	S	S	.	.	H	α-helix	trans	-61.3	-39	168	-70.2	173.5	-172.2	135.4	3.9	112.3	E668 M671 E678 R681 L688 R689	E668-R685 WeakPolarHBondContact OE1-CD 3.43Å; E668-R685 WeakPolarHBondContact OE1-CG 3.11Å; E668-R685 IonicContact OE1-CZ 3.82Å; E668-R685 IonicContact OE1-NE 2.78Å; E668-R685 PolarHBondContact OE1-NE 3.47Å; E668-R685 IonicContact OE1-NH2 3.93Å; E668-R685 IonicContact OE2-CZ 2.71Å; E668-R685 IonicContact OE2-NE 3.95Å; E668-R685 PolarHBondContact OE2-NE 2.94Å; E668-R685 VanDerWaalsContact OE2-NE 3.13Å; E668-R685 IonicContact OE2-NH2 3.53Å; E668-R685 PolarHBondContact OE2-NH2 3.09Å; M671-R685 HydrophobicContact CE-CG 3.93Å; E678-R685 IonicContact OE1-CZ 2.73Å; E678-R685 IonicContact OE1-NH1 2.84Å; E678-R685 PolarHBondContact OE1-NH1 3.24Å; E678-R685 IonicContact OE1-NH2 3.02Å; R681-R685 WeakPolarHBondContact O-CB 3.35Å; R681-R685 VanDerWaalsContact O-CG 3.27Å; R681-R685 WeakPolarHBondContact O-CG 3.25Å; R681-R685 PolarHBondContact O-N 3.23Å; R685-L688 PolarHBondContact O-N 3.21Å; R685-R689 WeakPolarHBondContact O-CG 3.3Å; R685-R689 PolarHBondContact O-N 3.45Å
686	C	92.6	Very high	87.6	Confident	70 Å²	70	74.4 Å²	74.4	47%	0.473	37%	0.371	S	S	.	.	H	α-helix	trans	-64.9	-43.9	174.9	-168.7	0	0	0	0	111.5	V682 Q683 M684 L688 R689 K690	V682-C686 WeakPolarHBondContact O-CB 3.4Å; V682-C686 PolarHBondContact O-N 3.31Å; Q683-C686 CarbonylContact O-C 3.59Å; Q683-C686 WeakPolarHBondContact O-CA 3.39Å; Q683-C686 WeakPolarHBondContact O-CB 3.37Å; Q683-C686 PolarHBondContact O-N 3.5Å; Q683-C686 VanDerWaalsContact O-N 3.16Å; M684-C686 VanDerWaalsContact C-N 3.34Å; M684-C686 PolarHBondContact O-N 2.89Å; C686-L688 VanDerWaalsContact C-N 3.33Å; C686-L688 PolarHBondContact O-N 3.49Å; C686-R689 PolarHBondContact O-N 3.46Å; C686-K690 WeakPolarHBondContact O-CB 3.47Å; C686-K690 PolarHBondContact O-N 2.71Å
687	L	90.1	Very high	87.3	Confident	75 Å²	75	80.4 Å²	80.4	39%	0.393	39%	0.39	S	S	.	.	H	α-helix	trans	-59.8	-41.5	174.9	-176.6	63.8	0	0	0	111.7	Q683 M684 K690 K691	Q683-L687 PolarHBondContact O-N 3.47Å; M684-L687 PolarHBondContact O-N 3.19Å; M684-L687 HydrophobicContact SD-CD2 4.2Å; L687-K690 PolarHBondContact O-N 2.79Å; L687-K691 HydrophobicContact CG-CD 4.42Å; L687-K691 WeakPolarHBondContact O-CB 3.29Å; L687-K691 WeakPolarHBondContact O-CG 3.49Å; L687-K691 PolarHBondContact O-N 3.13Å
688	L	90	Very high	86.4	Confident	28 Å²	28	80.1 Å²	80.1	15%	0.147	39%	0.387	C	S	.	.	H	α-helix	trans	-63	-49.3	172.9	-177.8	65	0	0	0	111.7	R664 L667 M684 R685 C686 K690 K691 E692	R664-L688 HydrophobicContact CB-CD2 3.78Å; R664-L688 HydrophobicContact CG-CD2 4.15Å; L667-L688 HydrophobicContact CB-CD2 4.44Å; L667-L688 HydrophobicContact CD2-CB 3.61Å; L667-L688 HydrophobicContact CD2-CD1 4.5Å; L667-L688 HydrophobicContact CD2-CD2 3.67Å; L667-L688 HydrophobicContact CD2-CG 4.1Å; M684-L688 PolarHBondContact O-N 3.47Å; R685-L688 PolarHBondContact O-N 3.21Å; C686-L688 VanDerWaalsContact C-N 3.33Å; C686-L688 PolarHBondContact O-N 3.49Å; L688-K690 VanDerWaalsContact C-N 3.25Å; L688-K690 PolarHBondContact O-N 3.34Å; L688-K691 PolarHBondContact O-N 2.9Å; L688-K691 VanDerWaalsContact O-N 3.12Å; L688-E692 HydrophobicContact CD1-CG 4.09Å; L688-E692 HydrophobicContact CG-CG 4.21Å; L688-E692 WeakPolarHBondContact O-CB 3.48Å; L688-E692 VanDerWaalsContact O-CG 3.28Å; L688-E692 WeakPolarHBondContact O-CG 3.35Å; L688-E692 PolarHBondContact O-N 3.19Å
689	R	88.1	Confident	85.5	Confident	144 Å²	144	79.4 Å²	79.4	54%	0.543	38%	0.383	S	S	.	.	H	α-helix	trans	-58.2	-37.1	177.1	-74.3	-171.8	-74	-169	-0.2	112.1	R685 C686 S693	R685-R689 WeakPolarHBondContact O-CG 3.3Å; R685-R689 PolarHBondContact O-N 3.45Å; C686-R689 PolarHBondContact O-N 3.46Å; R689-S693 VanDerWaalsContact O-CB 3.28Å; R689-S693 WeakPolarHBondContact O-CB 3.37Å; R689-S693 PolarHBondContact O-N 3.29Å; R689-S693 PolarHBondContact O-OG 2.83Å
690	K	88.2	Confident	84.6	Confident	131 Å²	131	82 Å²	82	57%	0.57	39%	0.385	S	S	*	.	H	α-helix	trans	-66.5	-45.9	173.5	-169.6	173.8	-178.6	178.1	0	112	C686 L687 L688 S693 N694	C686-K690 WeakPolarHBondContact O-CB 3.47Å; C686-K690 PolarHBondContact O-N 2.71Å; L687-K690 PolarHBondContact O-N 2.79Å; L688-K690 VanDerWaalsContact C-N 3.25Å; L688-K690 PolarHBondContact O-N 3.34Å; K690-S693 PolarHBondContact O-N 2.81Å; K690-N694 WeakPolarHBondContact O-CB 3.48Å; K690-N694 PolarHBondContact O-N 3.48Å
691	K	86.2	Confident	83.8	Confident	117 Å²	117	83.1 Å²	83.1	51%	0.509	39%	0.394	S	S	.	.	H	α-helix	trans	-60.2	-46.6	175.1	-76.1	176.6	177.7	-178.7	0	111.7	L687 L688 N694 H695	L687-K691 HydrophobicContact CG-CD 4.42Å; L687-K691 WeakPolarHBondContact O-CB 3.29Å; L687-K691 WeakPolarHBondContact O-CG 3.49Å; L687-K691 PolarHBondContact O-N 3.13Å; L688-K691 PolarHBondContact O-N 2.9Å; L688-K691 VanDerWaalsContact O-N 3.12Å; K691-N694 PolarHBondContact O-N 3.31Å; K691-H695 WeakPolarHBondContact O-CB 3.31Å; K691-H695 PolarHBondContact O-N 3.34Å
692	E	85.2	Confident	83.2	Confident	7 Å²	7	88.6 Å²	88.6	3%	0.033	42%	0.419	C	S	.	.	H	α-helix	trans	-65.1	-41.6	178.4	-66.5	-78.7	-130.2	0	0	112.7	R660 R663 L688 H695 M696	R660-E692 WeakPolarHBondContact CB-OE1 3.44Å; R660-E692 VanDerWaalsContact CG-OE1 3.23Å; R660-E692 WeakPolarHBondContact CG-OE1 3.48Å; R660-E692 IonicContact NE-OE1 3.35Å; R660-E692 PolarHBondContact NE-OE1 2.77Å; R660-E692 IonicContact NE-OE2 3.08Å; R663-E692 IonicContact CZ-OE1 3.96Å; R663-E692 IonicContact CZ-OE2 2.81Å; R663-E692 VanDerWaalsContact CZ-OE2 3.23Å; R663-E692 IonicContact NH1-OE1 2.74Å; R663-E692 PolarHBondContact NH1-OE1 3.47Å; R663-E692 IonicContact NH1-OE2 2.76Å; R663-E692 PolarHBondContact NH1-OE2 2.9Å; R663-E692 IonicContact NH2-OE1 2.66Å; R663-E692 PolarHBondContact NH2-OE1 3.43Å; R663-E692 VanDerWaalsContact NH2-OE1 3.16Å; R663-E692 IonicContact NH2-OE2 3.74Å; R663-E692 PolarHBondContact NH2-OE2 3.18Å; L688-E692 HydrophobicContact CD1-CG 4.09Å; L688-E692 HydrophobicContact CG-CG 4.21Å; L688-E692 WeakPolarHBondContact O-CB 3.48Å; L688-E692 VanDerWaalsContact O-CG 3.28Å; L688-E692 WeakPolarHBondContact O-CG 3.35Å; L688-E692 PolarHBondContact O-N 3.19Å; E692-H695 PolarHBondContact O-N 3.5Å; E692-M696 WeakPolarHBondContact O-CG 3.03Å; E692-M696 PolarHBondContact O-N 2.77Å
693	S	86.1	Confident	82.7	Confident	73 Å²	73	86.1 Å²	86.1	51%	0.51	40%	0.403	S	S	.	.	H	α-helix	trans	-64.2	-41.4	176.8	-61	0	0	0	0	111.7	R689 K690 R697	R689-S693 VanDerWaalsContact O-CB 3.28Å; R689-S693 WeakPolarHBondContact O-CB 3.37Å; R689-S693 PolarHBondContact O-N 3.29Å; R689-S693 PolarHBondContact O-OG 2.83Å; K690-S693 PolarHBondContact O-N 2.81Å; S693-R697 VanDerWaalsContact O-CB 3.3Å; S693-R697 WeakPolarHBondContact O-CB 3.28Å; S693-R697 PolarHBondContact O-N 2.87Å
694	N	79.9	Confident	82.6	Confident	72 Å²	72	82.1 Å²	82.1	39%	0.385	39%	0.386	S	S	.	.	H	α-helix	trans	-65.8	-43.8	174.5	-75.6	-14.8	0	0	0	111.8	K690 K691 R697 M698	K690-N694 WeakPolarHBondContact O-CB 3.48Å; K690-N694 PolarHBondContact O-N 3.48Å; K691-N694 PolarHBondContact O-N 3.31Å; N694-R697 PolarHBondContact O-N 3.03Å; N694-M698 WeakPolarHBondContact O-CB 3.47Å; N694-M698 VanDerWaalsContact O-CG 3.31Å; N694-M698 WeakPolarHBondContact O-CG 3.42Å; N694-M698 PolarHBondContact O-N 2.82Å
695	H	75	Confident	82.6	Confident	23 Å²	23	81.7 Å²	81.7	11%	0.106	38%	0.383	C	S	.	.	H	α-helix	trans	-55.9	-52.5	174.3	175.5	86.7	0	0	0	111.4	K691 E692 R697 M698 Q699 F1129	K691-H695 WeakPolarHBondContact O-CB 3.31Å; K691-H695 PolarHBondContact O-N 3.34Å; E692-H695 PolarHBondContact O-N 3.5Å; H695-R697 VanDerWaalsContact C-N 3.33Å; H695-R697 PolarHBondContact O-N 2.9Å; H695-M698 PolarHBondContact O-N 3.42Å; H695-Q699 PolarHBondContact NE2-NE2 3.16Å; H695-Q699 WeakPolarHBondContact O-CG 3.35Å; H695-Q699 PolarHBondContact O-N 3.2Å; H695-F1129 AromaticContact CE1-CD2 3.27Å; H695-F1129 WeakPolarHBondContact CE1-CD2 3.39Å; H695-F1129 AromaticContact CE1-CE2 3.77Å; H695-F1129 AromaticContact CE1-CG 3.65Å; H695-F1129 WeakPolarHBondContact ND1-CB 3.29Å; H695-F1129 AromaticContact ND1-CD1 3.74Å; H695-F1129 AromaticContact ND1-CD2 3.37Å; H695-F1129 WeakPolarHBondContact ND1-CD2 3.17Å; H695-F1129 AromaticContact ND1-CE2 3.94Å; H695-F1129 AromaticContact ND1-CG 3.23Å; H695-F1129 WeakPolarHBondContact ND1-CG 3.46Å
696	M	76.8	Confident	82.6	Confident	45 Å²	45	81.7 Å²	81.7	22%	0.222	39%	0.394	C	S	.	.	H	α-helix	trans	-62.6	-36.2	177.2	-67	-61.2	-64.4	0	0	112.8	I656 E692 R700	I656-M696 HydrophobicContact CG2-SD 4.38Å; E692-M696 WeakPolarHBondContact O-CG 3.03Å; E692-M696 PolarHBondContact O-N 2.77Å; M696-R700 VanDerWaalsContact O-CG 3.3Å; M696-R700 WeakPolarHBondContact O-CG 3.48Å; M696-R700 PolarHBondContact O-N 3.43Å
697	R	79.5	Confident	82.6	Confident	181 Å²	181	81.7 Å²	81.7	68%	0.683	39%	0.388	S	S	*	.	H	α-helix	trans	-66.5	-43.5	174.5	-175.2	-177.1	-71.1	-177.1	-3.3	111.5	S693 N694 H695 R700 A701	S693-R697 VanDerWaalsContact O-CB 3.3Å; S693-R697 WeakPolarHBondContact O-CB 3.28Å; S693-R697 PolarHBondContact O-N 2.87Å; N694-R697 PolarHBondContact O-N 3.03Å; H695-R697 VanDerWaalsContact C-N 3.33Å; H695-R697 PolarHBondContact O-N 2.9Å; R697-R700 PolarHBondContact O-N 3.02Å; R697-A701 PolarHBondContact O-N 2.75Å; R697-A701 VanDerWaalsContact O-N 3.14Å
698	M	70.7	Confident	82.8	Confident	79 Å²	79	78.6 Å²	78.6	39%	0.389	37%	0.372	S	S	.	.	H	α-helix	trans	-74.4	-27.2	-179.6	-69.7	174.8	63.8	0	0	113.2	N694 H695 K1127 F1129	N694-M698 WeakPolarHBondContact O-CB 3.47Å; N694-M698 VanDerWaalsContact O-CG 3.31Å; N694-M698 WeakPolarHBondContact O-CG 3.42Å; N694-M698 PolarHBondContact O-N 2.82Å; H695-M698 PolarHBondContact O-N 3.42Å; M698-K1127 PolarHBondContact O-NZ 2.76Å; M698-F1129 HydrophobicContact CB-CD1 4.49Å; M698-F1129 HydrophobicContact CB-CE1 3.61Å; M698-F1129 HydrophobicContact CB-CZ 4.4Å; M698-F1129 HydrophobicContact CE-CD1 4.49Å; M698-F1129 HydrophobicContact CE-CE1 4.35Å
699	Q	70.3	Confident	83.1	Confident	74 Å²	74	83.7 Å²	83.7	35%	0.346	39%	0.39	S	S	.	.	H	α-helix	trans	-60.9	-43.4	165.7	-76.1	-168.5	14.4	0	0	111.6	H695 F1129	H695-Q699 PolarHBondContact NE2-NE2 3.16Å; H695-Q699 WeakPolarHBondContact O-CG 3.35Å; H695-Q699 PolarHBondContact O-N 3.2Å; Q699-F1129 HydrophobicContact CB-CZ 4.4Å; Q699-F1129 HydrophobicContact CG-CE2 3.75Å; Q699-F1129 HydrophobicContact CG-CZ 3.64Å
700	R	72	Confident	83.4	Confident	166 Å²	166	82.5 Å²	82.5	63%	0.626	39%	0.385	S	S	*	.	H	α-helix	trans	-69.2	-31.9	-179.4	-67.4	168.4	-172.3	-168.1	1.2	113.2	M696 R697 K702	M696-R700 VanDerWaalsContact O-CG 3.3Å; M696-R700 WeakPolarHBondContact O-CG 3.48Å; M696-R700 PolarHBondContact O-N 3.43Å; R697-R700 PolarHBondContact O-N 3.02Å; R700-K702 PolarHBondContact O-N 3.48Å
701	A	73.3	Confident	83.6	Confident	50 Å²	50	79.6 Å²	79.6	41%	0.413	38%	0.375	S	S	.	.	S	Bend	trans	-62.3	124	176.7	0	0	0	0	0	110.5	R697 K1127	R697-A701 PolarHBondContact O-N 2.75Å; R697-A701 VanDerWaalsContact O-N 3.14Å; A701-K1127 WeakPolarHBondContact O-CE 3.25Å; A701-K1127 PolarHBondContact O-NZ 2.73Å
702	K	77.8	Confident	83.9	Confident	168 Å²	168	78 Å²	78	73%	0.73	37%	0.368	S	S	*	.			trans	-68.6	150.9	173.9	-66.5	-179	179.5	177.6	0	110.3	R700 M707	R700-K702 PolarHBondContact O-N 3.48Å; K702-M707 WeakPolarHBondContact O-CE 3.23Å
703	M	82.9	Confident	84.2	Confident	23 Å²	23	78 Å²	78	11%	0.113	37%	0.368	C	S	.	.			trans	-111.4	142	168.8	-168.8	71.1	78.8	0	0	107.5	M707 F708 F773 F775	M703-M707 HydrophobicContact SD-CB 4.43Å; M703-M707 HydrophobicContact SD-SD 3.58Å; M703-F708 HydrophobicContact CG-CE2 4.22Å; M703-F708 HydrophobicContact SD-CE2 4Å; M703-F708 HydrophobicContact SD-CZ 4.14Å; M703-F773 HydrophobicContact CE-CB 4.29Å; M703-F773 HydrophobicContact CE-CD1 3.55Å; M703-F773 HydrophobicContact CE-CD2 3.94Å; M703-F773 HydrophobicContact CE-CE1 3.78Å; M703-F773 HydrophobicContact CE-CE2 4.16Å; M703-F773 HydrophobicContact CE-CG 3.64Å; M703-F773 HydrophobicContact CE-CZ 4.08Å; M703-F775 HydrophobicContact CB-CB 4.06Å; M703-F775 HydrophobicContact CB-CD1 4.04Å; M703-F775 HydrophobicContact CB-CG 4.07Å; M703-F775 HydrophobicContact CG-CB 4.47Å; M703-F775 HydrophobicContact CG-CD1 3.49Å; M703-F775 VanDerWaalsContact CG-CD1 3.49Å; M703-F775 HydrophobicContact CG-CE1 3.78Å; M703-F775 HydrophobicContact CG-CG 3.99Å
704	D	87.2	Confident	84.4	Confident	55 Å²	55	75.2 Å²	75.2	29%	0.294	35%	0.348	S	S	.	.			trans	-146	159.1	179.4	175.2	54.4	0	0	0	110.7	S706 M707	D704-S706 PolarHBondContact O-N 3.17Å; D704-S706 WeakPolarHBondContact OD2-CB 3.41Å; D704-S706 PolarHBondContact OD2-N 3.08Å; D704-S706 PolarHBondContact OD2-OG 3.4Å; D704-M707 WeakPolarHBondContact O-CB 3.34Å; D704-M707 WeakPolarHBondContact O-CG 3.3Å; D704-M707 PolarHBondContact O-N 2.77Å; D704-M707 VanDerWaalsContact O-N 3.11Å
705	Q	90.6	Very high	84.6	Confident	64 Å²	64	72.7 Å²	72.7	30%	0.299	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-61.1	-26.8	179.1	64.4	178.2	-23.2	0	0	113.4	M707 F708 F775 D777 Y782	Q705-M707 PolarHBondContact O-N 3.06Å; Q705-M707 VanDerWaalsContact O-N 3.13Å; Q705-F708 PolarHBondContact O-N 2.74Å; Q705-F775 HydrophobicContact CB-CE2 4.32Å; Q705-D777 PolarHBondContact NE2-OD2 2.82Å; Q705-Y782 HydrophobicContact CB-CE1 3.87Å; Q705-Y782 PolarHBondContact NE2-OH 3.01Å; Q705-Y782 PolarHBondContact OE1-OH 2.99Å
706	S	91.6	Very high	84.6	Confident	71 Å²	71	74.7 Å²	74.7	50%	0.497	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-62.2	-16.2	175.4	60.5	0	0	0	0	113.9	D704 F708 K728	D704-S706 PolarHBondContact O-N 3.17Å; D704-S706 WeakPolarHBondContact OD2-CB 3.41Å; D704-S706 PolarHBondContact OD2-N 3.08Å; D704-S706 PolarHBondContact OD2-OG 3.4Å; S706-F708 PolarHBondContact O-N 3.03Å; S706-K728 WeakPolarHBondContact O-CD 3.35Å; S706-K728 WeakPolarHBondContact O-CE 3.27Å; S706-K728 PolarHBondContact O-NZ 2.9Å
707	M	92.2	Very high	84.2	Confident	69 Å²	69	74 Å²	74	34%	0.34	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-80.5	4.3	177.4	-56.1	-172.9	177.5	0	0	114	K702 M703 D704 Q705 K728	K702-M707 WeakPolarHBondContact O-CE 3.23Å; M703-M707 HydrophobicContact SD-CB 4.43Å; M703-M707 HydrophobicContact SD-SD 3.58Å; D704-M707 WeakPolarHBondContact O-CB 3.34Å; D704-M707 WeakPolarHBondContact O-CG 3.3Å; D704-M707 PolarHBondContact O-N 2.77Å; D704-M707 VanDerWaalsContact O-N 3.11Å; Q705-M707 PolarHBondContact O-N 3.06Å; Q705-M707 VanDerWaalsContact O-N 3.13Å; M707-K728 WeakPolarHBondContact O-CG 3.29Å; M707-K728 PolarHBondContact O-N 3.45Å
708	F	95.4	Very high	83.4	Confident	11 Å²	11	68.2 Å²	68.2	5%	0.048	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	146.9	-177.1	-58.9	-96.6	0	0	0	111.1	M703 Q705 S706 V725 R726 K727 K728 Y734 M736 F773 F775 V784	M703-F708 HydrophobicContact CG-CE2 4.22Å; M703-F708 HydrophobicContact SD-CE2 4Å; M703-F708 HydrophobicContact SD-CZ 4.14Å; Q705-F708 PolarHBondContact O-N 2.74Å; S706-F708 PolarHBondContact O-N 3.03Å; F708-V725 HydrophobicContact CB-CB 4.3Å; F708-V725 HydrophobicContact CD1-CB 4.34Å; F708-V725 HydrophobicContact CD1-CG2 3.71Å; F708-V725 HydrophobicContact CE1-CG2 4.36Å; F708-V725 HydrophobicContact CG-CG2 4.45Å; F708-R726 CarbonylContact C-O 3.6Å; F708-R726 WeakPolarHBondContact CA-O 3.48Å; F708-K727 HydrophobicContact CD1-CB 3.77Å; F708-K727 HydrophobicContact CD1-CG 3.83Å; F708-K727 HydrophobicContact CE1-CB 3.77Å; F708-K727 HydrophobicContact CE1-CD 3.95Å; F708-K727 HydrophobicContact CE1-CG 3.53Å; F708-K727 HydrophobicContact CZ-CD 4.21Å; F708-K727 HydrophobicContact CZ-CG 4.01Å; F708-K728 VanDerWaalsContact O-CE 3.31Å; F708-K728 WeakPolarHBondContact O-CE 3.33Å; F708-Y734 HydrophobicContact CE1-CD2 4.34Å; F708-M736 HydrophobicContact CB-CE 4.08Å; F708-M736 HydrophobicContact CD1-CE 3.86Å; F708-M736 HydrophobicContact CD2-CE 3.53Å; F708-M736 HydrophobicContact CE1-CE 4.13Å; F708-M736 HydrophobicContact CE2-CE 3.85Å; F708-M736 HydrophobicContact CG-CE 3.55Å; F708-M736 HydrophobicContact CZ-CE 4.13Å; F708-F773 HydrophobicContact CZ-CD2 4.41Å; F708-F775 HydrophobicContact CD2-CZ 4.45Å; F708-F775 AromaticContact CE2-CE1 3.83Å; F708-F775 HydrophobicContact CE2-CE1 3.83Å; F708-F775 AromaticContact CE2-CZ 4Å; F708-F775 HydrophobicContact CE2-CZ 4Å; F708-F775 HydrophobicContact CZ-CE1 4.31Å; F708-V784 HydrophobicContact CE1-CG1 3.93Å; F708-V784 HydrophobicContact CE1-CG2 4.34Å; F708-V784 HydrophobicContact CZ-CG1 4.26Å; F708-V784 HydrophobicContact CZ-CG2 4.03Å
709	Y	95.3	Very high	83	Confident	134 Å²	134	66.6 Å²	66.6	53%	0.525	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	129.2	160.6	-63.6	-65.1	0	0	0	108.2	V725 R726 K728	Y709-V725 CarbonylContact O-C 3.51Å; Y709-V725 WeakPolarHBondContact O-CA 3.41Å; Y709-V725 WeakPolarHBondContact O-CB 3.47Å; Y709-R726 PolarHBondContact N-O 3.03Å; Y709-R726 PolarHBondContact O-N 2.77Å; Y709-K728 HydrophobicContact CD2-CD 4.46Å; Y709-K728 HydrophobicContact CD2-CG 3.79Å; Y709-K728 HydrophobicContact CE1-CD 4.19Å; Y709-K728 HydrophobicContact CE2-CB 4.43Å; Y709-K728 HydrophobicContact CE2-CD 4.06Å; Y709-K728 HydrophobicContact CE2-CG 3.59Å; Y709-K728 HydrophobicContact CG-CG 4.34Å
710	R	94.4	Very high	83.3	Confident	119 Å²	119	64.1 Å²	64.1	45%	0.449	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	133.4	169.7	-60.2	-175.2	-167.9	169.5	6	108.5	W723 V725	R710-W723 HydrophobicContact CB-CE3 3.83Å; R710-W723 HydrophobicContact CB-CZ3 4.29Å; R710-W723 HydrophobicContact CG-CE3 4.43Å; R710-V725 HydrophobicContact CG-CG1 4.17Å
711	I	93.7	Very high	84.1	Confident	71 Å²	71	59.1 Å²	59.1	36%	0.364	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	-58.3	-174.3	-62	178.7	0	0	0	110.3	L724 R726 L733 L1086	I711-L724 HydrophobicContact CB-CB 4.48Å; I711-L724 HydrophobicContact CB-CD2 4.4Å; I711-L724 HydrophobicContact CB-CG 4.23Å; I711-L724 HydrophobicContact CG2-CD2 4.18Å; I711-L724 PolarHBondContact N-O 3.16Å; I711-R726 HydrophobicContact CD1-CB 3.77Å; I711-L733 HydrophobicContact CD1-CD2 3.57Å; I711-L1086 HydrophobicContact CD1-CD2 3.83Å; I711-L1086 HydrophobicContact CG2-CD2 4.45Å
712	K	92.8	Very high	85	Confident	83 Å²	83	58.3 Å²	58.3	36%	0.361	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	147	-178.4	-179	170.1	165.5	-174.4	0	111.2	W723 L724 T1088	K712-W723 CarbonylContact O-C 3.6Å; K712-W723 WeakPolarHBondContact O-CA 3.46Å; K712-L724 PolarHBondContact O-N 3Å; K712-T1088 HydrophobicContact CD-CG2 4.22Å; K712-T1088 WeakPolarHBondContact CD-OG1 3.4Å; K712-T1088 PolarHBondContact NZ-OG1 3.37Å
713	H	91	Very high	85.8	Confident	6 Å²	6	52.7 Å²	52.7	3%	0.028	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	120.1	171.3	-164.9	-167.6	0	0	0	108.6	K721 V722 W723 V1094 D1096	H713-K721 WeakPolarHBondContact NE2-CB 3.48Å; H713-K721 WeakPolarHBondContact NE2-CG 3.45Å; H713-V722 PolarHBondContact CD2-O 2.76Å; H713-W723 HydrophobicContact CB-CD2 4.33Å; H713-W723 HydrophobicContact CB-CE3 4.31Å; H713-W723 HydrophobicContact CB-CH2 4Å; H713-W723 HydrophobicContact CB-CZ2 4Å; H713-W723 HydrophobicContact CB-CZ3 4.16Å; H713-W723 AromaticContact CD2-CE2 3.8Å; H713-W723 AromaticContact CD2-NE1 3.6Å; H713-W723 AromaticContact CG-CZ2 3.96Å; H713-V1094 WeakPolarHBondContact ND1-CG1 3.21Å; H713-D1096 IonicContact CE1-OD1 3.38Å; H713-D1096 IonicContact CG-OD1 2.7Å; H713-D1096 IonicContact ND1-OD1 3.36Å; H713-D1096 PolarHBondContact ND1-OD1 3Å
714	L	89.3	Confident	86.4	Confident	15 Å²	15	51.6 Å²	51.6	8%	0.079	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-24.9	-176.3	-66.8	177	0	0	0	113	V722 L724 Y787 T1088 F1091	L714-V722 HydrophobicContact CB-CB 4.46Å; L714-V722 HydrophobicContact CB-CG1 4.24Å; L714-V722 HydrophobicContact CD1-CG1 4.33Å; L714-V722 PolarHBondContact N-O 3.09Å; L714-L724 HydrophobicContact CD1-CB 3.98Å; L714-L724 HydrophobicContact CD2-CB 4.13Å; L714-L724 HydrophobicContact CG-CB 4.01Å; L714-Y787 HydrophobicContact CD1-CD2 3.99Å; L714-Y787 HydrophobicContact CD1-CE2 3.8Å; L714-Y787 HydrophobicContact CD2-CE2 4.17Å; L714-T1088 HydrophobicContact CD2-CG2 3.52Å; L714-F1091 HydrophobicContact CB-CD1 4.19Å; L714-F1091 HydrophobicContact CB-CE1 4.26Å; L714-F1091 HydrophobicContact CD1-CE1 4.4Å; L714-F1091 HydrophobicContact CD1-CZ 4.43Å; L714-F1091 HydrophobicContact CD2-CD1 4.15Å; L714-F1091 HydrophobicContact CD2-CD2 4.13Å; L714-F1091 HydrophobicContact CD2-CE1 4.2Å; L714-F1091 HydrophobicContact CD2-CE2 4.18Å; L714-F1091 HydrophobicContact CD2-CG 4.11Å; L714-F1091 HydrophobicContact CD2-CZ 4.21Å
715	G	83.9	Confident	86.9	Confident	20 Å²	20	49 Å²	49	21%	0.206	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170	166	180	0	0	0	0	0	113.6	V722	G715-V722 PolarHBondContact N-O 3.46Å; G715-V722 PolarHBondContact O-N 2.61Å
716	V	76.6	Confident	87.2	Confident	65 Å²	65	49.1 Å²	49.1	39%	0.394	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	116.5	177.6	-176.1	0	0	0	0	108.5	V1094	V716-V1094 HydrophobicContact CG2-CG1 4.12Å
717	G	67.4	Low	87.3	Confident	31 Å²	31	46.3 Å²	46.3	32%	0.32	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	171	172.6	0	0	0	0	0	111.8	F719 G720	G717-F719 PolarHBondContact O-N 2.9Å; G717-G720 PolarHBondContact N-O 2.71Å; G717-G720 PolarHBondContact O-N 2.84Å; G717-G720 VanDerWaalsContact O-N 3.16Å; G717-G720 VanDerWaalsContact O-O 3.05Å
718	A	62.4	Low	87.4	Confident	59 Å²	59	47.4 Å²	47.4	49%	0.488	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-18.2	-173.6	0	0	0	0	0	115.7	R747	A718-R747 PolarHBondContact O-NH1 3.15Å
719	F	63.7	Low	87.1	Confident	44 Å²	44	52.1 Å²	52.1	19%	0.193	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.8	7.5	-175.8	-51.7	-55.5	0	0	0	114.2	G717 L739 N740 Q749	G717-F719 PolarHBondContact O-N 2.9Å; F719-L739 HydrophobicContact CB-CD2 3.82Å; F719-L739 WeakPolarHBondContact O-CA 3.45Å; F719-N740 PolarHBondContact O-N 2.87Å; F719-Q749 HydrophobicContact CD1-CG 4.37Å; F719-Q749 HydrophobicContact CE1-CB 4.34Å; F719-Q749 HydrophobicContact CE1-CG 3.61Å; F719-Q749 HydrophobicContact CZ-CB 4.33Å; F719-Q749 HydrophobicContact CZ-CG 3.77Å
720	G	76.6	Confident	86.8	Confident	22 Å²	22	49 Å²	49	23%	0.227	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.2	-149.2	179.8	0	0	0	0	0	114.2	G717 L738	G717-G720 PolarHBondContact N-O 2.71Å; G717-G720 PolarHBondContact O-N 2.84Å; G717-G720 VanDerWaalsContact O-N 3.16Å; G717-G720 VanDerWaalsContact O-O 3.05Å; G720-L738 CarbonylContact C-O 3.56Å; G720-L738 VanDerWaalsContact CA-O 3.29Å; G720-L738 WeakPolarHBondContact CA-O 3.34Å
721	K	88.7	Confident	86.7	Confident	61 Å²	61	48 Å²	48	27%	0.265	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	141	-159.2	-63.7	-176.6	177.4	-173.4	0	112.5	H713 L738 T1099	H713-K721 WeakPolarHBondContact NE2-CB 3.48Å; H713-K721 WeakPolarHBondContact NE2-CG 3.45Å; K721-L738 PolarHBondContact N-O 2.92Å; K721-L738 WeakPolarHBondContact O-CD1 3.41Å; K721-L738 PolarHBondContact O-N 2.6Å; K721-T1099 PolarHBondContact NZ-OG1 3.2Å
722	V	91.6	Very high	86.7	Confident	33 Å²	33	48.9 Å²	48.9	20%	0.2	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	125.7	175.9	-172.9	0	0	0	0	109.4	H713 L714 G715 A735 M736 K737	H713-V722 PolarHBondContact CD2-O 2.76Å; L714-V722 HydrophobicContact CB-CB 4.46Å; L714-V722 HydrophobicContact CB-CG1 4.24Å; L714-V722 HydrophobicContact CD1-CG1 4.33Å; L714-V722 PolarHBondContact N-O 3.09Å; G715-V722 PolarHBondContact N-O 3.46Å; G715-V722 PolarHBondContact O-N 2.61Å; V722-A735 HydrophobicContact CG1-CB 4.39Å; V722-M736 CarbonylContact C-O 3.59Å; V722-M736 WeakPolarHBondContact CA-O 3.08Å; V722-K737 HydrophobicContact CG2-CB 4.42Å; V722-K737 HydrophobicContact CG2-CG 4.18Å
723	W	94.8	Very high	86.8	Confident	50 Å²	50	46 Å²	46	19%	0.189	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138.3	-178.4	-73	72.8	0	0	0	111.3	R710 K712 H713 V725 M736 L738	R710-W723 HydrophobicContact CB-CE3 3.83Å; R710-W723 HydrophobicContact CB-CZ3 4.29Å; R710-W723 HydrophobicContact CG-CE3 4.43Å; K712-W723 CarbonylContact O-C 3.6Å; K712-W723 WeakPolarHBondContact O-CA 3.46Å; H713-W723 HydrophobicContact CB-CD2 4.33Å; H713-W723 HydrophobicContact CB-CE3 4.31Å; H713-W723 HydrophobicContact CB-CH2 4Å; H713-W723 HydrophobicContact CB-CZ2 4Å; H713-W723 HydrophobicContact CB-CZ3 4.16Å; H713-W723 AromaticContact CD2-CE2 3.8Å; H713-W723 AromaticContact CD2-NE1 3.6Å; H713-W723 AromaticContact CG-CZ2 3.96Å; W723-V725 HydrophobicContact CB-CG1 4.02Å; W723-M736 PolarHBondContact N-O 2.62Å; W723-M736 PolarHBondContact O-N 3.17Å; W723-L738 HydrophobicContact CG-CD1 4.33Å
724	L	96	Very high	87.1	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	125.4	159.5	-179.6	59.2	0	0	0	107.8	I711 K712 L714 L733 Y787 L1086 T1088	I711-L724 HydrophobicContact CB-CB 4.48Å; I711-L724 HydrophobicContact CB-CD2 4.4Å; I711-L724 HydrophobicContact CB-CG 4.23Å; I711-L724 HydrophobicContact CG2-CD2 4.18Å; I711-L724 PolarHBondContact N-O 3.16Å; K712-L724 PolarHBondContact O-N 3Å; L714-L724 HydrophobicContact CD1-CB 3.98Å; L714-L724 HydrophobicContact CD2-CB 4.13Å; L714-L724 HydrophobicContact CG-CB 4.01Å; L724-L733 HydrophobicContact CD1-CB 4.3Å; L724-L733 HydrophobicContact CD1-CD2 4.11Å; L724-L733 HydrophobicContact CG-CD2 4.43Å; L724-Y787 HydrophobicContact CD1-CD1 3.77Å; L724-Y787 HydrophobicContact CD1-CD2 3.73Å; L724-Y787 HydrophobicContact CD1-CE1 4.01Å; L724-Y787 HydrophobicContact CD1-CE2 3.98Å; L724-Y787 HydrophobicContact CD1-CG 3.64Å; L724-L1086 HydrophobicContact CD2-CD2 4.25Å; L724-T1088 HydrophobicContact CD2-CG2 4.06Å
725	V	96.8	Very high	87.4	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	145.1	179.8	-55.5	0	0	0	0	111.5	F708 Y709 R710 W723 L733 Y734 M736	F708-V725 HydrophobicContact CB-CB 4.3Å; F708-V725 HydrophobicContact CD1-CB 4.34Å; F708-V725 HydrophobicContact CD1-CG2 3.71Å; F708-V725 HydrophobicContact CE1-CG2 4.36Å; F708-V725 HydrophobicContact CG-CG2 4.45Å; Y709-V725 CarbonylContact O-C 3.51Å; Y709-V725 WeakPolarHBondContact O-CA 3.41Å; Y709-V725 WeakPolarHBondContact O-CB 3.47Å; R710-V725 HydrophobicContact CG-CG1 4.17Å; W723-V725 HydrophobicContact CB-CG1 4.02Å; V725-L733 CarbonylContact O-C 3.55Å; V725-L733 WeakPolarHBondContact O-CA 3.23Å; V725-Y734 WeakPolarHBondContact CG2-O 3.42Å; V725-Y734 PolarHBondContact N-O 3.25Å; V725-Y734 PolarHBondContact O-N 2.88Å; V725-M736 HydrophobicContact CG1-CB 3.75Å; V725-M736 HydrophobicContact CG1-CE 4.43Å; V725-M736 HydrophobicContact CG1-SD 4.2Å; V725-M736 HydrophobicContact CG2-CB 3.94Å; V725-M736 HydrophobicContact CG2-CE 4.27Å
726	R	96.4	Very high	87.9	Confident	68 Å²	68	44.9 Å²	44.9	26%	0.257	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.3	166.6	173.8	164.2	-86.2	157.3	-3.3	109.2	F708 Y709 I711 N731 Q732 L733 E1085	F708-R726 CarbonylContact C-O 3.6Å; F708-R726 WeakPolarHBondContact CA-O 3.48Å; Y709-R726 PolarHBondContact N-O 3.03Å; Y709-R726 PolarHBondContact O-N 2.77Å; I711-R726 HydrophobicContact CD1-CB 3.77Å; R726-N731 WeakPolarHBondContact CD-O 3.48Å; R726-N731 HydrophobicContact CG-CB 4.41Å; R726-N731 WeakPolarHBondContact CG-O 3.31Å; R726-N731 PolarHBondContact NE-O 2.93Å; R726-Q732 WeakPolarHBondContact CA-O 3.34Å; R726-L733 HydrophobicContact CB-CD2 3.9Å; R726-E1085 IonicContact NH2-OE2 2.7Å; R726-E1085 PolarHBondContact NH2-OE2 2.94Å
727	K	94.6	Very high	88.7	Confident	11 Å²	11	42.6 Å²	42.6	5%	0.048	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	138.1	179.1	-165.1	-171.7	-174.2	-67.4	0	110.2	F708 D729 N730 N731 Q732 Y734 F773	F708-K727 HydrophobicContact CD1-CB 3.77Å; F708-K727 HydrophobicContact CD1-CG 3.83Å; F708-K727 HydrophobicContact CE1-CB 3.77Å; F708-K727 HydrophobicContact CE1-CD 3.95Å; F708-K727 HydrophobicContact CE1-CG 3.53Å; F708-K727 HydrophobicContact CZ-CD 4.21Å; F708-K727 HydrophobicContact CZ-CG 4.01Å; K727-D729 WeakPolarHBondContact CD-OD1 3.48Å; K727-D729 VanDerWaalsContact CG-OD1 3.26Å; K727-D729 WeakPolarHBondContact CG-OD1 3.28Å; K727-D729 IonicContact NZ-OD1 3.07Å; K727-D729 PolarHBondContact NZ-OD1 3.44Å; K727-D729 IonicContact NZ-OD2 2.62Å; K727-D729 PolarHBondContact NZ-OD2 3.07Å; K727-D729 PolarHBondContact O-N 3.41Å; K727-N730 WeakPolarHBondContact CB-OD1 3.37Å; K727-N731 VanDerWaalsContact O-CA 3.25Å; K727-N731 WeakPolarHBondContact O-CA 3.44Å; K727-N731 PolarHBondContact O-N 2.97Å; K727-Q732 PolarHBondContact N-O 3.22Å; K727-Y734 HydrophobicContact CB-CD2 3.96Å; K727-Y734 HydrophobicContact CB-CE2 3.54Å; K727-Y734 HydrophobicContact CD-CE2 3.92Å; K727-Y734 HydrophobicContact CG-CE2 4.35Å; K727-F773 HydrophobicContact CD-CE2 3.95Å; K727-F773 HydrophobicContact CD-CZ 4.44Å
728	K	93.4	Very high	89.9	Confident	92 Å²	92	42.1 Å²	42.1	40%	0.4	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-16.7	-162.2	-66.1	-173.5	-177.7	178.5	0	116.5	S706 M707 F708 Y709	S706-K728 WeakPolarHBondContact O-CD 3.35Å; S706-K728 WeakPolarHBondContact O-CE 3.27Å; S706-K728 PolarHBondContact O-NZ 2.9Å; M707-K728 WeakPolarHBondContact O-CG 3.29Å; M707-K728 PolarHBondContact O-N 3.45Å; F708-K728 VanDerWaalsContact O-CE 3.31Å; F708-K728 WeakPolarHBondContact O-CE 3.33Å; Y709-K728 HydrophobicContact CD2-CD 4.46Å; Y709-K728 HydrophobicContact CD2-CG 3.79Å; Y709-K728 HydrophobicContact CE1-CD 4.19Å; Y709-K728 HydrophobicContact CE2-CB 4.43Å; Y709-K728 HydrophobicContact CE2-CD 4.06Å; Y709-K728 HydrophobicContact CE2-CG 3.59Å; Y709-K728 HydrophobicContact CG-CG 4.34Å
729	D	89.3	Confident	91.1	Very high	110 Å²	110	39.4 Å²	39.4	59%	0.588	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-27.5	-174.6	58.9	-30.9	0	0	0	113.7	K727	K727-D729 WeakPolarHBondContact CD-OD1 3.48Å; K727-D729 VanDerWaalsContact CG-OD1 3.26Å; K727-D729 WeakPolarHBondContact CG-OD1 3.28Å; K727-D729 IonicContact NZ-OD1 3.07Å; K727-D729 PolarHBondContact NZ-OD1 3.44Å; K727-D729 IonicContact NZ-OD2 2.62Å; K727-D729 PolarHBondContact NZ-OD2 3.07Å; K727-D729 PolarHBondContact O-N 3.41Å
730	N	90.3	Very high	92.3	Very high	68 Å²	68	39.9 Å²	39.9	36%	0.364	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121	-1.3	177.7	71.3	-15.8	0	0	0	114.1	K727 Q732 Y734	K727-N730 WeakPolarHBondContact CB-OD1 3.37Å; N730-Q732 WeakPolarHBondContact ND2-CB 3.37Å; N730-Q732 PolarHBondContact ND2-OE1 3.04Å; N730-Q732 VanDerWaalsContact ND2-OE1 3.15Å; N730-Q732 PolarHBondContact O-N 2.92Å; N730-Q732 PolarHBondContact OD1-N 2.95Å; N730-Y734 PolarHBondContact ND2-OH 3.01Å
731	N	92	Very high	92.9	Very high	99 Å²	99	39.2 Å²	39.2	53%	0.529	19%	0.191	S	C	.	.			trans	54.7	13.8	-175.3	-67.3	-40.3	0	0	0	115.6	R726 K727	R726-N731 WeakPolarHBondContact CD-O 3.48Å; R726-N731 HydrophobicContact CG-CB 4.41Å; R726-N731 WeakPolarHBondContact CG-O 3.31Å; R726-N731 PolarHBondContact NE-O 2.93Å; K727-N731 VanDerWaalsContact O-CA 3.25Å; K727-N731 WeakPolarHBondContact O-CA 3.44Å; K727-N731 PolarHBondContact O-N 2.97Å
732	Q	93.5	Very high	92.8	Very high	90 Å²	90	43.7 Å²	43.7	42%	0.421	21%	0.206	S	C	.	.			trans	-76.5	147.9	178.7	-167.3	172.5	18.8	0	0	111	R726 K727 N730 Y734	R726-Q732 WeakPolarHBondContact CA-O 3.34Å; K727-Q732 PolarHBondContact N-O 3.22Å; N730-Q732 WeakPolarHBondContact ND2-CB 3.37Å; N730-Q732 PolarHBondContact ND2-OE1 3.04Å; N730-Q732 VanDerWaalsContact ND2-OE1 3.15Å; N730-Q732 PolarHBondContact O-N 2.92Å; N730-Q732 PolarHBondContact OD1-N 2.95Å; Q732-Y734 HydrophobicContact CB-CE2 3.84Å; Q732-Y734 HydrophobicContact CG-CE1 4.34Å; Q732-Y734 HydrophobicContact CG-CE2 4.22Å; Q732-Y734 WeakPolarHBondContact O-CD2 3.31Å; Q732-Y734 WeakPolarHBondContact O-CE2 3.3Å; Q732-Y734 PolarHBondContact OE1-OH 3.18Å
733	L	95.7	Very high	92.4	Very high	23 Å²	23	44.4 Å²	44.4	12%	0.12	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	144.4	178	-66.7	165.3	0	0	0	111.7	I711 L724 V725 R726 E1085 L1086	I711-L733 HydrophobicContact CD1-CD2 3.57Å; L724-L733 HydrophobicContact CD1-CB 4.3Å; L724-L733 HydrophobicContact CD1-CD2 4.11Å; L724-L733 HydrophobicContact CG-CD2 4.43Å; V725-L733 CarbonylContact O-C 3.55Å; V725-L733 WeakPolarHBondContact O-CA 3.23Å; R726-L733 HydrophobicContact CB-CD2 3.9Å; L733-E1085 HydrophobicContact CD1-CB 3.55Å; L733-E1085 WeakPolarHBondContact CD1-O 3.4Å; L733-L1086 HydrophobicContact CD1-CD2 3.74Å; L733-L1086 HydrophobicContact CD2-CD2 3.68Å; L733-L1086 HydrophobicContact CG-CD2 4.37Å
734	Y	96.1	Very high	91.8	Very high	4 Å²	4	42 Å²	42	2%	0.016	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	156.9	-179.4	-57.7	-80.8	0	0	0	110.9	F708 V725 K727 N730 Q732 F772 V784 M785	F708-Y734 HydrophobicContact CE1-CD2 4.34Å; V725-Y734 WeakPolarHBondContact CG2-O 3.42Å; V725-Y734 PolarHBondContact N-O 3.25Å; V725-Y734 PolarHBondContact O-N 2.88Å; K727-Y734 HydrophobicContact CB-CD2 3.96Å; K727-Y734 HydrophobicContact CB-CE2 3.54Å; K727-Y734 HydrophobicContact CD-CE2 3.92Å; K727-Y734 HydrophobicContact CG-CE2 4.35Å; N730-Y734 PolarHBondContact ND2-OH 3.01Å; Q732-Y734 HydrophobicContact CB-CE2 3.84Å; Q732-Y734 HydrophobicContact CG-CE1 4.34Å; Q732-Y734 HydrophobicContact CG-CE2 4.22Å; Q732-Y734 WeakPolarHBondContact O-CD2 3.31Å; Q732-Y734 WeakPolarHBondContact O-CE2 3.3Å; Q732-Y734 PolarHBondContact OE1-OH 3.18Å; Y734-F772 AromaticContact CD1-CD2 3.65Å; Y734-F772 HydrophobicContact CD1-CD2 3.65Å; Y734-F772 HydrophobicContact CD1-CE2 4.05Å; Y734-F772 HydrophobicContact CD1-CG 4.26Å; Y734-F772 HydrophobicContact CE1-CB 4.27Å; Y734-F772 HydrophobicContact CE1-CD1 4.32Å; Y734-F772 AromaticContact CE1-CD2 3.54Å; Y734-F772 HydrophobicContact CE1-CD2 3.54Å; Y734-F772 AromaticContact CE1-CE2 3.85Å; Y734-F772 HydrophobicContact CE1-CE2 3.85Å; Y734-F772 AromaticContact CE1-CG 3.79Å; Y734-F772 HydrophobicContact CE1-CG 3.79Å; Y734-F772 HydrophobicContact CE1-CZ 4.37Å; Y734-V784 HydrophobicContact CD1-CG1 4.06Å; Y734-V784 HydrophobicContact CD2-CG1 4.29Å; Y734-V784 HydrophobicContact CG-CG1 3.71Å; Y734-M785 CarbonylContact C-O 3.54Å; Y734-M785 WeakPolarHBondContact CA-O 2.94Å; Y734-M785 VanDerWaalsContact CB-O 3.3Å; Y734-M785 WeakPolarHBondContact CB-O 3.33Å
735	A	95.4	Very high	91.2	Very high	10 Å²	10	42.7 Å²	42.7	8%	0.083	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	121.7	163.9	0	0	0	0	0	109.8	V722 M785	V722-A735 HydrophobicContact CG1-CB 4.39Å; A735-M785 HydrophobicContact CB-CE 4.4Å; A735-M785 PolarHBondContact N-O 2.74Å; A735-M785 PolarHBondContact O-N 2.95Å
736	M	94.8	Very high	90.4	Very high	2 Å²	2	50 Å²	50	1%	0.01	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	110.8	177.8	-178.1	-178.8	-78.6	0	0	110.5	F708 V722 W723 V725 L738 F775 Y782 L783 V784	F708-M736 HydrophobicContact CB-CE 4.08Å; F708-M736 HydrophobicContact CD1-CE 3.86Å; F708-M736 HydrophobicContact CD2-CE 3.53Å; F708-M736 HydrophobicContact CE1-CE 4.13Å; F708-M736 HydrophobicContact CE2-CE 3.85Å; F708-M736 HydrophobicContact CG-CE 3.55Å; F708-M736 HydrophobicContact CZ-CE 4.13Å; V722-M736 CarbonylContact C-O 3.59Å; V722-M736 WeakPolarHBondContact CA-O 3.08Å; W723-M736 PolarHBondContact N-O 2.62Å; W723-M736 PolarHBondContact O-N 3.17Å; V725-M736 HydrophobicContact CG1-CB 3.75Å; V725-M736 HydrophobicContact CG1-CE 4.43Å; V725-M736 HydrophobicContact CG1-SD 4.2Å; V725-M736 HydrophobicContact CG2-CB 3.94Å; V725-M736 HydrophobicContact CG2-CE 4.27Å; M736-L738 HydrophobicContact CG-CD1 3.92Å; M736-L738 HydrophobicContact CG-CG 4.39Å; M736-L738 HydrophobicContact SD-CD1 4.18Å; M736-L738 HydrophobicContact SD-CG 4.48Å; M736-F775 HydrophobicContact CE-CE1 4.29Å; M736-F775 HydrophobicContact CE-CZ 4Å; M736-Y782 HydrophobicContact CE-CD1 4.48Å; M736-Y782 HydrophobicContact CG-CD1 4.23Å; M736-Y782 HydrophobicContact SD-CD1 3.72Å; M736-Y782 HydrophobicContact SD-CE1 4.21Å; M736-L783 CarbonylContact C-O 3.6Å; M736-L783 WeakPolarHBondContact CA-O 3.3Å; M736-V784 HydrophobicContact CE-CG2 3.83Å; M736-V784 HydrophobicContact CG-CG2 4.32Å
737	K	92.5	Very high	89.4	Confident	17 Å²	17	51.8 Å²	51.8	7%	0.074	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	117.7	170.8	-167.5	-173.7	-161.2	-175	0	108.7	V722 L739 E756 Y782 L783 M785 D849	V722-K737 HydrophobicContact CG2-CB 4.42Å; V722-K737 HydrophobicContact CG2-CG 4.18Å; K737-L739 HydrophobicContact CD-CD2 4.07Å; K737-L739 HydrophobicContact CG-CD2 4.04Å; K737-E756 WeakPolarHBondContact CD-OE1 3.2Å; K737-E756 IonicContact NZ-OE1 3.72Å; K737-E756 PolarHBondContact NZ-OE1 3.37Å; K737-E756 IonicContact NZ-OE2 3.35Å; K737-E756 PolarHBondContact NZ-OE2 3.45Å; K737-Y782 WeakPolarHBondContact O-CA 3.47Å; K737-L783 HydrophobicContact CB-CB 4.27Å; K737-L783 HydrophobicContact CD-CD1 4.29Å; K737-L783 PolarHBondContact N-O 3.22Å; K737-L783 PolarHBondContact O-N 3.47Å; K737-M785 HydrophobicContact CB-CE 3.9Å; K737-D849 IonicContact NZ-OD1 3.8Å; K737-D849 PolarHBondContact NZ-OD1 2.93Å
738	L	92.7	Very high	88.7	Confident	22 Å²	22	57 Å²	57	12%	0.115	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	126.7	174.5	-63.2	88.3	0	0	0	109.1	G720 K721 W723 M736 L781 Y782	G720-L738 CarbonylContact C-O 3.56Å; G720-L738 VanDerWaalsContact CA-O 3.29Å; G720-L738 WeakPolarHBondContact CA-O 3.34Å; K721-L738 PolarHBondContact N-O 2.92Å; K721-L738 WeakPolarHBondContact O-CD1 3.41Å; K721-L738 PolarHBondContact O-N 2.6Å; W723-L738 HydrophobicContact CG-CD1 4.33Å; M736-L738 HydrophobicContact CG-CD1 3.92Å; M736-L738 HydrophobicContact CG-CG 4.39Å; M736-L738 HydrophobicContact SD-CD1 4.18Å; M736-L738 HydrophobicContact SD-CG 4.48Å; L738-L781 WeakPolarHBondContact CA-O 3.32Å; L738-Y782 HydrophobicContact CD2-CD1 4.1Å; L738-Y782 HydrophobicContact CD2-CE1 3.51Å; L738-Y782 HydrophobicContact CG-CD1 3.89Å; L738-Y782 HydrophobicContact CG-CE1 3.84Å
739	L	89.5	Confident	88	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.7	178.4	-48.5	165.9	0	0	0	109.1	F719 K737 K741 V744 V753 A780 L781	F719-L739 HydrophobicContact CB-CD2 3.82Å; F719-L739 WeakPolarHBondContact O-CA 3.45Å; K737-L739 HydrophobicContact CD-CD2 4.07Å; K737-L739 HydrophobicContact CG-CD2 4.04Å; L739-K741 PolarHBondContact O-N 3.05Å; L739-V744 HydrophobicContact CB-CG2 4.14Å; L739-V753 HydrophobicContact CD1-CB 4.48Å; L739-V753 HydrophobicContact CD1-CG1 3.67Å; L739-V753 HydrophobicContact CD1-CG2 4Å; L739-A780 CarbonylContact O-C 3.34Å; L739-A780 VanDerWaalsContact O-CA 3.24Å; L739-A780 WeakPolarHBondContact O-CA 3.46Å; L739-L781 HydrophobicContact CB-CB 4.22Å; L739-L781 HydrophobicContact CD1-CB 4.46Å; L739-L781 PolarHBondContact N-O 3.48Å; L739-L781 PolarHBondContact O-N 3.06Å
740	N	88.5	Confident	87.6	Confident	55 Å²	55	50 Å²	50	29%	0.294	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	125.6	-179.6	179.3	-2.8	0	0	0	110.8	F719 R742 D743 V744 R779	F719-N740 PolarHBondContact O-N 2.87Å; N740-R742 VanDerWaalsContact C-N 3.27Å; N740-R742 PolarHBondContact O-N 3.19Å; N740-R742 PolarHBondContact OD1-N 2.82Å; N740-D743 HydrophobicContact CB-CB 4.16Å; N740-D743 VanDerWaalsContact CB-OD2 3.24Å; N740-D743 WeakPolarHBondContact CB-OD2 3.22Å; N740-D743 VanDerWaalsContact CG-CG 3.48Å; N740-D743 PolarHBondContact ND2-OD1 2.99Å; N740-D743 PolarHBondContact ND2-OD2 3.49Å; N740-D743 PolarHBondContact O-N 2.87Å; N740-V744 WeakPolarHBondContact O-CB 3.46Å; N740-V744 VanDerWaalsContact O-CG2 3.29Å; N740-V744 WeakPolarHBondContact O-CG2 3.38Å; N740-V744 PolarHBondContact O-N 3.28Å; N740-R779 PolarHBondContact OD1-O 3.3Å
741	K	88.1	Confident	86.9	Confident	8 Å²	8	47 Å²	47	4%	0.035	21%	0.214	C	C	.	.	H	α-helix	trans	-62.4	-32.1	-178	-75.6	-176.3	164.9	-172.4	0	113.4	L739 V745 D777 R779 A780 L781 F1121	L739-K741 PolarHBondContact O-N 3.05Å; K741-V745 WeakPolarHBondContact O-CG2 3.48Å; K741-V745 PolarHBondContact O-N 2.95Å; K741-D777 PolarHBondContact NZ-O 3.06Å; K741-R779 WeakPolarHBondContact CB-O 3.48Å; K741-R779 PolarHBondContact N-O 3.41Å; K741-A780 WeakPolarHBondContact CE-O 3.42Å; K741-L781 HydrophobicContact CD-CD2 4.43Å; K741-L781 HydrophobicContact CG-CD2 4.17Å; K741-L781 HydrophobicContact CG-CG 4.01Å; K741-F1121 HydrophobicContact CB-CE2 3.92Å; K741-F1121 HydrophobicContact CD-CD2 4.05Å; K741-F1121 HydrophobicContact CD-CE2 4Å; K741-F1121 HydrophobicContact CG-CD2 4.11Å; K741-F1121 HydrophobicContact CG-CE2 3.66Å; K741-F1121 HydrophobicContact CG-CZ 4.38Å
742	R	86.1	Confident	86.1	Confident	155 Å²	155	44.3 Å²	44.3	59%	0.585	20%	0.198	S	C	*	.	H	α-helix	trans	-66.6	-56.8	177.5	-67.8	-177.7	172.5	-168.9	-5.9	109.4	N740 V744 V745 E746	N740-R742 VanDerWaalsContact C-N 3.27Å; N740-R742 PolarHBondContact O-N 3.19Å; N740-R742 PolarHBondContact OD1-N 2.82Å; R742-V744 VanDerWaalsContact C-N 3.31Å; R742-V744 PolarHBondContact O-N 3.07Å; R742-V745 PolarHBondContact O-N 3.38Å; R742-E746 WeakPolarHBondContact O-CB 3.49Å; R742-E746 PolarHBondContact O-N 3.38Å
743	D	83.9	Confident	85.7	Confident	48 Å²	48	40.1 Å²	40.1	26%	0.257	18%	0.179	S	C	.	.	H	α-helix	trans	-61	-37.6	-176.5	-45	-6.6	0	0	0	112	N740 R747	N740-D743 HydrophobicContact CB-CB 4.16Å; N740-D743 VanDerWaalsContact CB-OD2 3.24Å; N740-D743 WeakPolarHBondContact CB-OD2 3.22Å; N740-D743 VanDerWaalsContact CG-CG 3.48Å; N740-D743 PolarHBondContact ND2-OD1 2.99Å; N740-D743 PolarHBondContact ND2-OD2 3.49Å; N740-D743 PolarHBondContact O-N 2.87Å; D743-R747 WeakPolarHBondContact O-CB 3.42Å; D743-R747 WeakPolarHBondContact O-CG 3.45Å; D743-R747 PolarHBondContact O-N 2.67Å
744	V	83	Confident	85	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.6	-38.3	175	169.5	0	0	0	0	112.2	L739 N740 R742 R748 Q749 L750 V753 F1121	L739-V744 HydrophobicContact CB-CG2 4.14Å; N740-V744 WeakPolarHBondContact O-CB 3.46Å; N740-V744 VanDerWaalsContact O-CG2 3.29Å; N740-V744 WeakPolarHBondContact O-CG2 3.38Å; N740-V744 PolarHBondContact O-N 3.28Å; R742-V744 VanDerWaalsContact C-N 3.31Å; R742-V744 PolarHBondContact O-N 3.07Å; V744-R748 PolarHBondContact O-N 3.32Å; V744-Q749 HydrophobicContact CG1-CB 4.39Å; V744-Q749 PolarHBondContact O-N 3.46Å; V744-L750 HydrophobicContact CG1-CG 4.34Å; V744-V753 HydrophobicContact CG1-CB 4.47Å; V744-V753 HydrophobicContact CG1-CG2 3.88Å; V744-V753 HydrophobicContact CG2-CG2 4.07Å; V744-F1121 HydrophobicContact CB-CZ 4.37Å; V744-F1121 HydrophobicContact CG1-CE1 3.79Å; V744-F1121 HydrophobicContact CG1-CZ 3.89Å
745	V	82.5	Confident	84.1	Confident	13 Å²	13	39.6 Å²	39.6	8%	0.079	18%	0.176	C	C	.	.	H	α-helix	trans	-77	-46.7	177.8	172.1	0	0	0	0	111.3	K741 R742 R747 R748 L750 I871 L1119 F1121	K741-V745 WeakPolarHBondContact O-CG2 3.48Å; K741-V745 PolarHBondContact O-N 2.95Å; R742-V745 PolarHBondContact O-N 3.38Å; V745-R747 VanDerWaalsContact C-N 3.32Å; V745-R747 PolarHBondContact O-N 2.87Å; V745-R748 PolarHBondContact O-N 2.82Å; V745-L750 HydrophobicContact CG2-CD1 4.14Å; V745-L750 HydrophobicContact CG2-CD2 4.39Å; V745-L750 HydrophobicContact CG2-CG 4.42Å; V745-I871 HydrophobicContact CG1-CD1 3.69Å; V745-L1119 HydrophobicContact CB-CD1 4.46Å; V745-L1119 HydrophobicContact CG1-CD2 4.41Å; V745-L1119 HydrophobicContact CG2-CD1 4.08Å; V745-L1119 HydrophobicContact CG2-CD2 4.36Å; V745-F1121 HydrophobicContact CG2-CE2 4.16Å; V745-F1121 HydrophobicContact CG2-CZ 3.77Å
746	E	80.8	Confident	83.6	Confident	155 Å²	155	39.3 Å²	39.3	72%	0.724	17%	0.173	S	C	*	.	H	α-helix	trans	-58.6	-43.1	179.7	-177	173.6	-164	0	0	112	R742 R748	R742-E746 WeakPolarHBondContact O-CB 3.49Å; R742-E746 PolarHBondContact O-N 3.38Å; E746-R748 VanDerWaalsContact C-N 3.25Å; E746-R748 PolarHBondContact O-N 2.79Å
747	R	75.6	Confident	83.2	Confident	104 Å²	104	40.6 Å²	40.6	39%	0.392	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	1.1	177.1	-60.3	172.6	-179.3	-155.3	-2.2	113.5	A718 D743 V745 Q749	A718-R747 PolarHBondContact O-NH1 3.15Å; D743-R747 WeakPolarHBondContact O-CB 3.42Å; D743-R747 WeakPolarHBondContact O-CG 3.45Å; D743-R747 PolarHBondContact O-N 2.67Å; V745-R747 VanDerWaalsContact C-N 3.32Å; V745-R747 PolarHBondContact O-N 2.87Å; R747-Q749 HydrophobicContact CB-CG 3.66Å; R747-Q749 WeakPolarHBondContact O-CG 3.13Å; R747-Q749 PolarHBondContact O-NE2 3.3Å
748	R	79	Confident	82.8	Confident	122 Å²	122	40.4 Å²	40.4	46%	0.46	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	42.1	-175.2	-57.5	-169.9	-177.3	-133.7	1.2	115.1	V744 V745 E746 D866	V744-R748 PolarHBondContact O-N 3.32Å; V745-R748 PolarHBondContact O-N 2.82Å; E746-R748 VanDerWaalsContact C-N 3.25Å; E746-R748 PolarHBondContact O-N 2.79Å; R748-D866 IonicContact CZ-OD1 3.28Å; R748-D866 IonicContact NH1-OD1 2.74Å; R748-D866 PolarHBondContact NH1-OD1 3.21Å
749	Q	78.6	Confident	82.2	Confident	39 Å²	39	39.4 Å²	39.4	18%	0.182	17%	0.172	C	C	.	.			trans	-100.7	10.5	-171.7	-57.5	-63.6	-48.9	0	0	114.5	F719 V744 R747 A751 H752 V753	F719-Q749 HydrophobicContact CD1-CG 4.37Å; F719-Q749 HydrophobicContact CE1-CB 4.34Å; F719-Q749 HydrophobicContact CE1-CG 3.61Å; F719-Q749 HydrophobicContact CZ-CB 4.33Å; F719-Q749 HydrophobicContact CZ-CG 3.77Å; V744-Q749 HydrophobicContact CG1-CB 4.39Å; V744-Q749 PolarHBondContact O-N 3.46Å; R747-Q749 HydrophobicContact CB-CG 3.66Å; R747-Q749 WeakPolarHBondContact O-CG 3.13Å; R747-Q749 PolarHBondContact O-NE2 3.3Å; Q749-A751 VanDerWaalsContact C-N 3.28Å; Q749-A751 PolarHBondContact O-N 3.28Å; Q749-H752 WeakPolarHBondContact O-CB 3.2Å; Q749-H752 PolarHBondContact O-N 3.38Å; Q749-H752 VanDerWaalsContact O-N 3.1Å; Q749-H752 PolarHBondContact OE1-ND1 3.09Å; Q749-V753 PolarHBondContact O-N 3.32Å
750	L	80.8	Confident	82	Confident	14 Å²	14	39.3 Å²	39.3	7%	0.073	17%	0.172	C	C	.	.	H	α-helix	trans	-58	-39.4	-177.1	-60.8	82.8	0	0	0	112.5	V744 V745 H752 V753 Q754 W865 F869 F1121	V744-L750 HydrophobicContact CG1-CG 4.34Å; V745-L750 HydrophobicContact CG2-CD1 4.14Å; V745-L750 HydrophobicContact CG2-CD2 4.39Å; V745-L750 HydrophobicContact CG2-CG 4.42Å; L750-H752 VanDerWaalsContact C-N 3.33Å; L750-H752 PolarHBondContact O-N 3.45Å; L750-V753 PolarHBondContact O-N 3.26Å; L750-Q754 WeakPolarHBondContact O-CB 3.43Å; L750-Q754 PolarHBondContact O-N 3.08Å; L750-W865 HydrophobicContact CB-CD2 4.21Å; L750-W865 HydrophobicContact CB-CG 4.12Å; L750-W865 HydrophobicContact CD2-CE3 4.32Å; L750-F869 HydrophobicContact CD2-CD2 4.14Å; L750-F869 HydrophobicContact CD2-CE2 3.41Å; L750-F869 VanDerWaalsContact CD2-CE2 3.41Å; L750-F869 HydrophobicContact CD2-CZ 3.81Å; L750-F1121 HydrophobicContact CB-CE1 4.47Å; L750-F1121 HydrophobicContact CD2-CD1 4.42Å; L750-F1121 HydrophobicContact CD2-CE1 3.92Å; L750-F1121 HydrophobicContact CD2-CZ 4.34Å; L750-F1121 HydrophobicContact CG-CE1 3.82Å; L750-F1121 HydrophobicContact CG-CZ 4.31Å
751	A	75.2	Confident	81.9	Confident	5 Å²	5	37.5 Å²	37.5	4%	0.041	16%	0.164	C	C	.	.	H	α-helix	trans	-60.9	-40.6	177.4	0	0	0	0	0	112.7	Q749 A755	Q749-A751 VanDerWaalsContact C-N 3.28Å; Q749-A751 PolarHBondContact O-N 3.28Å; A751-A755 WeakPolarHBondContact O-CB 3.28Å; A751-A755 PolarHBondContact O-N 2.94Å
752	H	76	Confident	81.5	Confident	43 Å²	43	41.6 Å²	41.6	20%	0.199	18%	0.184	C	C	.	.	H	α-helix	trans	-71.3	-43.5	179	-67.7	138.4	0	0	0	111.8	Q749 L750 Q754 A755 E756 G851	Q749-H752 WeakPolarHBondContact O-CB 3.2Å; Q749-H752 PolarHBondContact O-N 3.38Å; Q749-H752 VanDerWaalsContact O-N 3.1Å; Q749-H752 PolarHBondContact OE1-ND1 3.09Å; L750-H752 VanDerWaalsContact C-N 3.33Å; L750-H752 PolarHBondContact O-N 3.45Å; H752-Q754 VanDerWaalsContact C-N 3.33Å; H752-Q754 PolarHBondContact O-N 2.83Å; H752-A755 PolarHBondContact O-N 3.22Å; H752-E756 PolarHBondContact O-N 3.03Å; H752-G851 WeakPolarHBondContact CA-O 3.29Å; H752-G851 WeakPolarHBondContact CB-O 3.4Å; H752-G851 PolarHBondContact CD2-O 3.31Å; H752-G851 VanDerWaalsContact CG-O 3.3Å
753	V	83.9	Confident	81.3	Confident	3 Å²	3	34.4 Å²	34.4	2%	0.018	16%	0.158	C	C	.	.	H	α-helix	trans	-65.9	-34.9	174.9	174.8	0	0	0	0	112	L739 V744 Q749 L750 R757 L781 F1124	L739-V753 HydrophobicContact CD1-CB 4.48Å; L739-V753 HydrophobicContact CD1-CG1 3.67Å; L739-V753 HydrophobicContact CD1-CG2 4Å; V744-V753 HydrophobicContact CG1-CB 4.47Å; V744-V753 HydrophobicContact CG1-CG2 3.88Å; V744-V753 HydrophobicContact CG2-CG2 4.07Å; Q749-V753 PolarHBondContact O-N 3.32Å; L750-V753 PolarHBondContact O-N 3.26Å; V753-R757 WeakPolarHBondContact O-CB 3.23Å; V753-R757 PolarHBondContact O-N 2.95Å; V753-R757 VanDerWaalsContact O-N 3.09Å; V753-L781 HydrophobicContact CG1-CD1 3.7Å; V753-F1124 HydrophobicContact CG1-CD2 4.26Å; V753-F1124 HydrophobicContact CG1-CE2 3.62Å; V753-F1124 HydrophobicContact CG1-CZ 4.47Å
754	Q	81.6	Confident	81.2	Confident	16 Å²	16	37 Å²	37	8%	0.075	17%	0.171	C	C	.	.	H	α-helix	trans	-70.8	-39.4	172.8	-169.3	66.3	39.4	0	0	111.8	L750 H752 R757 D758 W865	L750-Q754 WeakPolarHBondContact O-CB 3.43Å; L750-Q754 PolarHBondContact O-N 3.08Å; H752-Q754 VanDerWaalsContact C-N 3.33Å; H752-Q754 PolarHBondContact O-N 2.83Å; Q754-R757 PolarHBondContact O-N 2.9Å; Q754-D758 PolarHBondContact NE2-OD1 3.49Å; Q754-D758 VanDerWaalsContact O-CB 3.29Å; Q754-D758 WeakPolarHBondContact O-CB 3.34Å; Q754-D758 PolarHBondContact O-N 3.39Å; Q754-W865 HydrophobicContact CB-CZ2 4.25Å; Q754-W865 HydrophobicContact CG-CZ2 4.19Å
755	A	78.1	Confident	81.4	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.7	-46.7	175.4	0	0	0	0	0	111.8	A751 H752 R757 D758 I759 H860	A751-A755 WeakPolarHBondContact O-CB 3.28Å; A751-A755 PolarHBondContact O-N 2.94Å; H752-A755 PolarHBondContact O-N 3.22Å; A755-R757 PolarHBondContact O-N 3.19Å; A755-D758 PolarHBondContact O-N 2.84Å; A755-I759 WeakPolarHBondContact O-CB 3.43Å; A755-I759 WeakPolarHBondContact O-CD1 3.21Å; A755-I759 VanDerWaalsContact O-CG1 3.26Å; A755-I759 WeakPolarHBondContact O-CG1 3.2Å; A755-I759 PolarHBondContact O-N 3.25Å; A755-H860 VanDerWaalsContact CA-CD2 3.49Å; A755-H860 WeakPolarHBondContact CA-CD2 3.29Å; A755-H860 HydrophobicContact CB-CB 4.2Å
756	E	84.7	Confident	81.8	Confident	3 Å²	3	43.9 Å²	43.9	1%	0.014	20%	0.204	C	C	.	.	H	α-helix	trans	-56.8	-50	173.8	-177	177.7	-172.6	0	0	111.2	K737 H752 D758 I759 L760 L783 F850	K737-E756 WeakPolarHBondContact CD-OE1 3.2Å; K737-E756 IonicContact NZ-OE1 3.72Å; K737-E756 PolarHBondContact NZ-OE1 3.37Å; K737-E756 IonicContact NZ-OE2 3.35Å; K737-E756 PolarHBondContact NZ-OE2 3.45Å; H752-E756 PolarHBondContact O-N 3.03Å; E756-D758 VanDerWaalsContact C-N 3.35Å; E756-D758 PolarHBondContact O-N 2.96Å; E756-I759 PolarHBondContact O-N 3.16Å; E756-L760 HydrophobicContact CG-CD1 3.58Å; E756-L760 HydrophobicContact CG-CG 4.32Å; E756-L760 WeakPolarHBondContact O-CB 3.29Å; E756-L760 WeakPolarHBondContact O-CG 3.49Å; E756-L760 PolarHBondContact O-N 2.98Å; E756-L783 HydrophobicContact CG-CD1 3.87Å; E756-F850 HydrophobicContact CG-CB 4.39Å
757	R	86.8	Confident	82.5	Confident	29 Å²	29	38 Å²	38	11%	0.109	18%	0.175	C	C	.	.	H	α-helix	trans	-64.3	-35.4	179.5	-173.8	-116.5	68.9	83.4	-12.4	113.2	V753 Q754 A755 A761 L783 F1124 F1126	V753-R757 WeakPolarHBondContact O-CB 3.23Å; V753-R757 PolarHBondContact O-N 2.95Å; V753-R757 VanDerWaalsContact O-N 3.09Å; Q754-R757 PolarHBondContact O-N 2.9Å; A755-R757 PolarHBondContact O-N 3.19Å; R757-A761 WeakPolarHBondContact O-CB 3.44Å; R757-A761 PolarHBondContact O-N 3.01Å; R757-L783 HydrophobicContact CB-CD2 4.29Å; R757-L783 HydrophobicContact CG-CD2 4.23Å; R757-F1124 HydrophobicContact CB-CD2 4.23Å; R757-F1124 HydrophobicContact CB-CE2 3.9Å; R757-F1124 WeakPolarHBondContact CD-O 3.26Å; R757-F1124 HydrophobicContact CG-CD2 4Å; R757-F1124 HydrophobicContact CG-CE2 3.9Å; R757-F1124 HydrophobicContact CG-CZ 4.47Å; R757-F1126 VanDerWaalsContact NH1-CB 3.29Å
758	D	82.6	Confident	83.4	Confident	13 Å²	13	33.2 Å²	33.2	7%	0.07	16%	0.157	C	C	.	.	H	α-helix	trans	-70.9	-49.5	177.6	-73.9	-2.8	0	0	0	111.1	Q754 A755 E756 A761 E762 H860	Q754-D758 PolarHBondContact NE2-OD1 3.49Å; Q754-D758 VanDerWaalsContact O-CB 3.29Å; Q754-D758 WeakPolarHBondContact O-CB 3.34Å; Q754-D758 PolarHBondContact O-N 3.39Å; A755-D758 PolarHBondContact O-N 2.84Å; E756-D758 VanDerWaalsContact C-N 3.35Å; E756-D758 PolarHBondContact O-N 2.96Å; D758-A761 PolarHBondContact O-N 3.49Å; D758-E762 PolarHBondContact O-N 3.46Å; D758-H860 WeakPolarHBondContact CB-NE2 3.09Å; D758-H860 IonicContact OD1-NE2 3.08Å; D758-H860 IonicContact OD2-CD2 2.74Å; D758-H860 IonicContact OD2-NE2 2.77Å; D758-H860 PolarHBondContact OD2-NE2 3.42Å
759	I	80.9	Confident	84.1	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-64.5	-50	-177.6	-66.2	162.6	0	0	0	111	A755 E756 A761 E762 A763 F827 F850 C853	A755-I759 WeakPolarHBondContact O-CB 3.43Å; A755-I759 WeakPolarHBondContact O-CD1 3.21Å; A755-I759 VanDerWaalsContact O-CG1 3.26Å; A755-I759 WeakPolarHBondContact O-CG1 3.2Å; A755-I759 PolarHBondContact O-N 3.25Å; E756-I759 PolarHBondContact O-N 3.16Å; I759-A761 PolarHBondContact O-N 3.39Å; I759-A761 VanDerWaalsContact O-N 3.13Å; I759-E762 PolarHBondContact O-N 3.03Å; I759-A763 VanDerWaalsContact O-CB 3.25Å; I759-A763 WeakPolarHBondContact O-CB 3.47Å; I759-A763 PolarHBondContact O-N 3.17Å; I759-F827 HydrophobicContact CD1-CB 4.45Å; I759-F827 HydrophobicContact CD1-CD1 3.55Å; I759-F827 HydrophobicContact CD1-CE1 3.93Å; I759-F827 HydrophobicContact CD1-CG 4.01Å; I759-F827 HydrophobicContact CG1-CD1 3.41Å; I759-F827 VanDerWaalsContact CG1-CD1 3.41Å; I759-F827 HydrophobicContact CG1-CD2 4.08Å; I759-F827 HydrophobicContact CG1-CE1 3.33Å; I759-F827 HydrophobicContact CG1-CE2 4.01Å; I759-F827 HydrophobicContact CG1-CG 3.8Å; I759-F827 HydrophobicContact CG1-CZ 3.65Å; I759-F850 HydrophobicContact CB-CB 4.41Å; I759-F850 HydrophobicContact CB-CD1 4.3Å; I759-F850 HydrophobicContact CB-CG 4.47Å; I759-F850 HydrophobicContact CD1-CB 4.14Å; I759-F850 HydrophobicContact CD1-CD1 4.16Å; I759-F850 HydrophobicContact CG2-CB 4.43Å; I759-F850 HydrophobicContact CG2-CD1 3.47Å; I759-F850 VanDerWaalsContact CG2-CD1 3.47Å; I759-F850 HydrophobicContact CG2-CE1 3.85Å; I759-F850 HydrophobicContact CG2-CG 3.97Å; I759-C853 HydrophobicContact CD1-CB 3.3Å
760	L	86	Confident	84.7	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-67.2	-14.3	-179.6	-58.8	170.1	0	0	0	112.7	E756 V768 V769 L771 L783 M785 F850 R1128	E756-L760 HydrophobicContact CG-CD1 3.58Å; E756-L760 HydrophobicContact CG-CG 4.32Å; E756-L760 WeakPolarHBondContact O-CB 3.29Å; E756-L760 WeakPolarHBondContact O-CG 3.49Å; E756-L760 PolarHBondContact O-N 2.98Å; L760-V768 HydrophobicContact CD2-CG1 3.98Å; L760-V769 VanDerWaalsContact CD2-O 3.26Å; L760-V769 WeakPolarHBondContact CD2-O 3.36Å; L760-L771 HydrophobicContact CB-CB 3.72Å; L760-L771 HydrophobicContact CB-CD2 4.29Å; L760-L771 VanDerWaalsContact O-CB 3.22Å; L760-L771 WeakPolarHBondContact O-CB 3.49Å; L760-L783 HydrophobicContact CD1-CD1 4.37Å; L760-M785 HydrophobicContact CD1-SD 4.08Å; L760-F850 HydrophobicContact CD2-CD2 3.54Å; L760-F850 HydrophobicContact CD2-CE2 3.8Å; L760-F850 HydrophobicContact CD2-CG 4.43Å; L760-F850 HydrophobicContact CG-CD2 4.26Å; L760-R1128 PolarHBondContact O-NH2 2.82Å
761	A	85.3	Confident	85.3	Confident	16 Å²	16	27.1 Å²	27.1	13%	0.132	13%	0.134	C	C	.	.	H	α-helix	trans	-92.3	-32.7	174.3	0	0	0	0	0	113.6	R757 D758 I759 L771 F1126	R757-A761 WeakPolarHBondContact O-CB 3.44Å; R757-A761 PolarHBondContact O-N 3.01Å; D758-A761 PolarHBondContact O-N 3.49Å; I759-A761 PolarHBondContact O-N 3.39Å; I759-A761 VanDerWaalsContact O-N 3.13Å; A761-L771 HydrophobicContact CB-CD2 4.34Å; A761-F1126 HydrophobicContact CB-CD1 3.97Å; A761-F1126 HydrophobicContact CB-CD2 4.03Å; A761-F1126 HydrophobicContact CB-CE1 3.77Å; A761-F1126 HydrophobicContact CB-CE2 3.82Å; A761-F1126 HydrophobicContact CB-CG 4.1Å; A761-F1126 HydrophobicContact CB-CZ 3.68Å
762	E	80.6	Confident	86	Confident	94 Å²	94	28.4 Å²	28.4	44%	0.439	14%	0.138	S	C	.	.	H	α-helix	trans	-84.6	-28.7	176.2	-72.8	-177.8	174.7	0	0	113	D758 I759 D764 R857	D758-E762 PolarHBondContact O-N 3.46Å; I759-E762 PolarHBondContact O-N 3.03Å; E762-D764 PolarHBondContact O-N 3.45Å; E762-R857 VanDerWaalsContact CD-NH2 3.3Å; E762-R857 IonicContact OE1-CZ 2.71Å; E762-R857 IonicContact OE1-NH1 2.7Å; E762-R857 PolarHBondContact OE1-NH1 2.83Å; E762-R857 IonicContact OE1-NH2 3.37Å; E762-R857 PolarHBondContact OE1-NH2 3.16Å; E762-R857 VanDerWaalsContact OE1-NH2 3.08Å; E762-R857 IonicContact OE2-CZ 3.83Å; E762-R857 IonicContact OE2-NH1 3.5Å; E762-R857 PolarHBondContact OE2-NH1 3.39Å; E762-R857 IonicContact OE2-NH2 2.62Å; E762-R857 PolarHBondContact OE2-NH2 2.89Å
763	A	82	Confident	86.7	Confident	5 Å²	5	27.5 Å²	27.5	4%	0.041	13%	0.134	C	C	.	.			trans	-68.7	120.6	176.6	0	0	0	0	0	111.1	I759 V768 M825 R1128	I759-A763 VanDerWaalsContact O-CB 3.25Å; I759-A763 WeakPolarHBondContact O-CB 3.47Å; I759-A763 PolarHBondContact O-N 3.17Å; A763-V768 HydrophobicContact CB-CB 3.85Å; A763-V768 HydrophobicContact CB-CG1 3.62Å; A763-V768 HydrophobicContact CB-CG2 4.17Å; A763-M825 HydrophobicContact CB-CE 3.99Å; A763-M825 HydrophobicContact CB-SD 4.02Å; A763-R1128 VanDerWaalsContact O-CZ 3.28Å; A763-R1128 PolarHBondContact O-NH1 3.03Å; A763-R1128 PolarHBondContact O-NH2 3.5Å
764	D	81.4	Confident	87.1	Confident	101 Å²	101	27.4 Å²	27.4	54%	0.54	13%	0.133	S	C	.	.			trans	-135.7	73.3	171.9	-153.2	29.9	0	0	0	108.4	E762 K770 R1128	E762-D764 PolarHBondContact O-N 3.45Å; D764-K770 VanDerWaalsContact OD1-CE 3.3Å; D764-K770 WeakPolarHBondContact OD1-CE 3.38Å; D764-K770 IonicContact OD1-NZ 3.89Å; D764-K770 PolarHBondContact OD1-NZ 3.38Å; D764-R1128 IonicContact OD1-CZ 2.63Å; D764-R1128 IonicContact OD1-NH1 1.94Å; D764-R1128 PolarHBondContact OD1-NH1 3.22Å
765	N	87	Confident	87.5	Confident	38 Å²	38	26.8 Å²	26.8	20%	0.203	13%	0.13	C	C	.	.	S	Bend	trans	-154.9	165.7	-176.6	65.9	74.1	0	0	0	110	W767 S821 M825	N765-W767 VanDerWaalsContact C-N 3.26Å; N765-W767 PolarHBondContact O-N 2.95Å; N765-W767 WeakPolarHBondContact OD1-CB 3.27Å; N765-W767 PolarHBondContact OD1-N 3.13Å; N765-S821 PolarHBondContact ND2-OG 2.95Å; N765-M825 WeakPolarHBondContact ND2-CE 3.4Å
766	E	91.3	Very high	88.1	Confident	120 Å²	120	29.3 Å²	29.3	56%	0.561	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-15.9	-174.4	-65.7	-46.3	133.8	0	0	115.6	K846	E766-K846 WeakPolarHBondContact O-CG 3.44Å; E766-K846 PolarHBondContact O-NZ 3.02Å; E766-K846 IonicContact OE2-NZ 3.81Å; E766-K846 PolarHBondContact OE2-NZ 3.11Å
767	W	94.7	Very high	88.3	Confident	31 Å²	31	30.7 Å²	30.7	12%	0.117	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-8.2	-169.7	-56.1	112.6	0	0	0	114.8	N765 E814 L817 A818 L847 V1072	N765-W767 VanDerWaalsContact C-N 3.26Å; N765-W767 PolarHBondContact O-N 2.95Å; N765-W767 WeakPolarHBondContact OD1-CB 3.27Å; N765-W767 PolarHBondContact OD1-N 3.13Å; W767-E814 HydrophobicContact CH2-CB 4.38Å; W767-E814 HydrophobicContact CH2-CG 4.44Å; W767-E814 HydrophobicContact CZ3-CB 3.92Å; W767-E814 HydrophobicContact CZ3-CG 4.25Å; W767-L817 HydrophobicContact CD2-CB 4.43Å; W767-L817 HydrophobicContact CH2-CB 3.85Å; W767-L817 HydrophobicContact CH2-CD1 3.84Å; W767-L817 HydrophobicContact CH2-CG 4.44Å; W767-L817 HydrophobicContact CZ2-CB 3.4Å; W767-L817 HydrophobicContact CZ2-CD1 3.55Å; W767-L817 HydrophobicContact CZ2-CG 4.11Å; W767-A818 HydrophobicContact CB-CB 3.74Å; W767-A818 HydrophobicContact CD2-CB 4.02Å; W767-A818 HydrophobicContact CE3-CB 3.91Å; W767-A818 HydrophobicContact CG-CB 3.98Å; W767-L847 WeakPolarHBondContact O-CB 3.45Å; W767-L847 PolarHBondContact O-N 2.95Å; W767-V1072 HydrophobicContact CH2-CG2 3.69Å; W767-V1072 HydrophobicContact CZ2-CG2 3.49Å; W767-V1072 VanDerWaalsContact CZ2-CG2 3.49Å
768	V	93.9	Very high	88.3	Confident	4 Å²	4	33.8 Å²	33.8	2%	0.024	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-125.2	133.5	-172.6	177.1	0	0	0	0	109.8	L760 A763 K770 V822 M825 F850	L760-V768 HydrophobicContact CD2-CG1 3.98Å; A763-V768 HydrophobicContact CB-CB 3.85Å; A763-V768 HydrophobicContact CB-CG1 3.62Å; A763-V768 HydrophobicContact CB-CG2 4.17Å; V768-K770 PolarHBondContact O-N 2.98Å; V768-V822 HydrophobicContact CG2-CG2 4.05Å; V768-M825 HydrophobicContact CG2-CE 4.23Å; V768-F850 HydrophobicContact CB-CZ 4.3Å; V768-F850 HydrophobicContact CG1-CE1 4.5Å; V768-F850 HydrophobicContact CG1-CE2 3.73Å; V768-F850 HydrophobicContact CG1-CZ 3.64Å; V768-F850 HydrophobicContact CG2-CZ 3.92Å
769	V	93.7	Very high	88.6	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.018	21%	0.207	C	C	.	.			trans	-57	121.5	175.7	167.4	0	0	0	0	111	L760 L771 M785 E786 I788 L838 K846 L847	L760-V769 VanDerWaalsContact CD2-O 3.26Å; L760-V769 WeakPolarHBondContact CD2-O 3.36Å; V769-L771 PolarHBondContact O-N 3.14Å; V769-M785 HydrophobicContact CG1-CB 3.77Å; V769-M785 HydrophobicContact CG1-CG 4.24Å; V769-M785 HydrophobicContact CG1-SD 4.11Å; V769-E786 WeakPolarHBondContact CA-OE1 3.41Å; V769-E786 HydrophobicContact CG1-CG 4.02Å; V769-I788 HydrophobicContact CG2-CG1 4.3Å; V769-L838 HydrophobicContact CG2-CD1 4.09Å; V769-K846 HydrophobicContact CG2-CB 3.99Å; V769-L847 WeakPolarHBondContact CG2-O 3.12Å; V769-L847 PolarHBondContact N-O 2.86Å
770	K	92.3	Very high	89.1	Confident	45 Å²	45	42.9 Å²	42.9	20%	0.196	21%	0.211	C	C	.	.			trans	-78.6	115.2	-171.1	-166.3	152.6	177.5	153.6	0	112.5	D764 V768 M785 E786 D1131	D764-K770 VanDerWaalsContact OD1-CE 3.3Å; D764-K770 WeakPolarHBondContact OD1-CE 3.38Å; D764-K770 IonicContact OD1-NZ 3.89Å; D764-K770 PolarHBondContact OD1-NZ 3.38Å; V768-K770 PolarHBondContact O-N 2.98Å; K770-M785 CarbonylContact O-C 3.51Å; K770-M785 VanDerWaalsContact O-CA 3.26Å; K770-M785 WeakPolarHBondContact O-CA 3.44Å; K770-E786 HydrophobicContact CB-CG 4.18Å; K770-E786 WeakPolarHBondContact CB-OE1 3.21Å; K770-E786 PolarHBondContact N-OE1 3.06Å; K770-E786 PolarHBondContact O-N 3.49Å; K770-D1131 WeakPolarHBondContact CE-OD1 3.34Å; K770-D1131 IonicContact NZ-OD1 3.84Å; K770-D1131 PolarHBondContact NZ-OD1 3.3Å
771	L	92.5	Very high	89.3	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	119.9	169.7	-174.7	76.1	0	0	0	110.5	L760 A761 V769 F773 L783 M785 F1126 R1128	L760-L771 HydrophobicContact CB-CB 3.72Å; L760-L771 HydrophobicContact CB-CD2 4.29Å; L760-L771 VanDerWaalsContact O-CB 3.22Å; L760-L771 WeakPolarHBondContact O-CB 3.49Å; A761-L771 HydrophobicContact CB-CD2 4.34Å; V769-L771 PolarHBondContact O-N 3.14Å; L771-F773 WeakPolarHBondContact CD1-O 3.01Å; L771-L783 HydrophobicContact CD1-CB 3.78Å; L771-L783 HydrophobicContact CD1-CD2 3.95Å; L771-L783 HydrophobicContact CD1-CG 4.42Å; L771-L783 HydrophobicContact CD2-CD2 4.4Å; L771-M785 HydrophobicContact CD1-CG 3.9Å; L771-F1126 HydrophobicContact CD2-CD1 3.72Å; L771-F1126 HydrophobicContact CD2-CE1 4.02Å; L771-F1126 HydrophobicContact CG-CD1 4.3Å; L771-F1126 HydrophobicContact CG-CE1 4.33Å; L771-R1128 PolarHBondContact O-NE 3.12Å
772	F	90.9	Very high	89.7	Confident	31 Å²	31	42.3 Å²	42.3	14%	0.136	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-44.3	171.7	-71.1	-82.9	0	0	0	111.9	Y734 V784 E786 K1127 R1128 D1131	Y734-F772 AromaticContact CD1-CD2 3.65Å; Y734-F772 HydrophobicContact CD1-CD2 3.65Å; Y734-F772 HydrophobicContact CD1-CE2 4.05Å; Y734-F772 HydrophobicContact CD1-CG 4.26Å; Y734-F772 HydrophobicContact CE1-CB 4.27Å; Y734-F772 HydrophobicContact CE1-CD1 4.32Å; Y734-F772 AromaticContact CE1-CD2 3.54Å; Y734-F772 HydrophobicContact CE1-CD2 3.54Å; Y734-F772 AromaticContact CE1-CE2 3.85Å; Y734-F772 HydrophobicContact CE1-CE2 3.85Å; Y734-F772 AromaticContact CE1-CG 3.79Å; Y734-F772 HydrophobicContact CE1-CG 3.79Å; Y734-F772 HydrophobicContact CE1-CZ 4.37Å; F772-V784 PolarHBondContact N-O 3.39Å; F772-E786 HydrophobicContact CE2-CB 3.96Å; F772-K1127 CarbonylContact O-C 3.57Å; F772-K1127 WeakPolarHBondContact O-CA 3.49Å; F772-R1128 PolarHBondContact O-N 2.89Å; F772-D1131 HydrophobicContact CE1-CB 4.31Å
773	F	90.8	Very high	90.3	Very high	24 Å²	24	37.9 Å²	37.9	11%	0.105	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	145.5	-176.4	-41.7	-69.6	0	0	0	111.3	M703 F708 K727 L771 V784 F1126 K1127	M703-F773 HydrophobicContact CE-CB 4.29Å; M703-F773 HydrophobicContact CE-CD1 3.55Å; M703-F773 HydrophobicContact CE-CD2 3.94Å; M703-F773 HydrophobicContact CE-CE1 3.78Å; M703-F773 HydrophobicContact CE-CE2 4.16Å; M703-F773 HydrophobicContact CE-CG 3.64Å; M703-F773 HydrophobicContact CE-CZ 4.08Å; F708-F773 HydrophobicContact CZ-CD2 4.41Å; K727-F773 HydrophobicContact CD-CE2 3.95Å; K727-F773 HydrophobicContact CD-CZ 4.44Å; L771-F773 WeakPolarHBondContact CD1-O 3.01Å; F773-V784 HydrophobicContact CB-CB 4.16Å; F773-V784 HydrophobicContact CB-CG2 4.47Å; F773-V784 HydrophobicContact CD2-CB 4.09Å; F773-V784 HydrophobicContact CD2-CG1 3.99Å; F773-V784 PolarHBondContact N-O 3Å; F773-V784 VanDerWaalsContact N-O 3.17Å; F773-V784 PolarHBondContact O-N 2.8Å; F773-F1126 WeakPolarHBondContact CA-O 3.32Å; F773-K1127 HydrophobicContact CD1-CB 3.99Å; F773-K1127 HydrophobicContact CD1-CD 4.29Å; F773-K1127 HydrophobicContact CD1-CG 3.93Å
774	S	91.5	Very high	90.9	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.007	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	141	159.6	60.9	0	0	0	0	110.5	Y782 F1124 T1125 F1126	S774-Y782 CarbonylContact C-O 3.48Å; S774-Y782 WeakPolarHBondContact CA-O 3.05Å; S774-Y782 WeakPolarHBondContact CB-O 3.33Å; S774-F1124 WeakPolarHBondContact CB-O 3.41Å; S774-F1124 PolarHBondContact OG-O 3.22Å; S774-T1125 CarbonylContact O-C 3.6Å; S774-T1125 VanDerWaalsContact O-CA 3.29Å; S774-T1125 WeakPolarHBondContact O-CA 3.33Å; S774-F1126 PolarHBondContact N-O 3.16Å; S774-F1126 PolarHBondContact O-N 2.95Å; S774-F1126 VanDerWaalsContact O-O 3.14Å; S774-F1126 WeakPolarHBondContact OG-CB 3.35Å; S774-F1126 PolarHBondContact OG-N 2.97Å; S774-F1126 VanDerWaalsContact OG-N 3.07Å
775	F	91.2	Very high	91.5	Very high	3 Å²	3	33.3 Å²	33.3	1%	0.013	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	177.3	-178.9	65.1	-89.6	0	0	0	111.3	M703 Q705 F708 M736 Y782 V784 F1124	M703-F775 HydrophobicContact CB-CB 4.06Å; M703-F775 HydrophobicContact CB-CD1 4.04Å; M703-F775 HydrophobicContact CB-CG 4.07Å; M703-F775 HydrophobicContact CG-CB 4.47Å; M703-F775 HydrophobicContact CG-CD1 3.49Å; M703-F775 VanDerWaalsContact CG-CD1 3.49Å; M703-F775 HydrophobicContact CG-CE1 3.78Å; M703-F775 HydrophobicContact CG-CG 3.99Å; Q705-F775 HydrophobicContact CB-CE2 4.32Å; F708-F775 HydrophobicContact CD2-CZ 4.45Å; F708-F775 AromaticContact CE2-CE1 3.83Å; F708-F775 HydrophobicContact CE2-CE1 3.83Å; F708-F775 AromaticContact CE2-CZ 4Å; F708-F775 HydrophobicContact CE2-CZ 4Å; F708-F775 HydrophobicContact CZ-CE1 4.31Å; M736-F775 HydrophobicContact CE-CE1 4.29Å; M736-F775 HydrophobicContact CE-CZ 4Å; F775-Y782 AromaticContact CD2-CD2 3.67Å; F775-Y782 HydrophobicContact CD2-CD2 3.67Å; F775-Y782 HydrophobicContact CD2-CE2 4.37Å; F775-Y782 AromaticContact CD2-CG 3.87Å; F775-Y782 HydrophobicContact CD2-CG 3.87Å; F775-Y782 HydrophobicContact CE1-CG 4.23Å; F775-Y782 AromaticContact CE2-CD1 3.78Å; F775-Y782 HydrophobicContact CE2-CD1 3.78Å; F775-Y782 AromaticContact CE2-CD2 3.45Å; F775-Y782 HydrophobicContact CE2-CD2 3.45Å; F775-Y782 VanDerWaalsContact CE2-CD2 3.45Å; F775-Y782 HydrophobicContact CE2-CE1 4.23Å; F775-Y782 AromaticContact CE2-CE2 3.97Å; F775-Y782 HydrophobicContact CE2-CE2 3.97Å; F775-Y782 AromaticContact CE2-CG 3.36Å; F775-Y782 HydrophobicContact CE2-CG 3.36Å; F775-Y782 HydrophobicContact CG-CG 4.47Å; F775-Y782 AromaticContact CZ-CD1 3.73Å; F775-Y782 HydrophobicContact CZ-CD1 3.73Å; F775-Y782 HydrophobicContact CZ-CD2 4.17Å; F775-Y782 HydrophobicContact CZ-CE1 4.43Å; F775-Y782 AromaticContact CZ-CG 3.57Å; F775-Y782 HydrophobicContact CZ-CG 3.57Å; F775-Y782 PolarHBondContact N-O 3.22Å; F775-Y782 PolarHBondContact O-N 2.84Å; F775-V784 HydrophobicContact CD1-CG2 4.43Å; F775-V784 HydrophobicContact CE1-CG2 3.74Å; F775-F1124 VanDerWaalsContact O-CE1 3.3Å; F775-F1124 WeakPolarHBondContact O-CE1 3.43Å
776	Q	90.5	Very high	91.8	Very high	54 Å²	54	33.4 Å²	33.4	25%	0.252	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	148.9	-173.7	61.3	179.6	-65.6	0	0	111.4	A780 L781 F1121 F1124	Q776-A780 WeakPolarHBondContact CA-O 3.37Å; Q776-L781 HydrophobicContact CB-CD2 3.69Å; Q776-F1121 PolarHBondContact NE2-O 2.86Å; Q776-F1124 HydrophobicContact CB-CD1 4.47Å
777	D	88.8	Confident	92	Very high	32 Å²	32	29.1 Å²	29.1	17%	0.171	14%	0.138	C	C	.	.			trans	-117.3	-151.5	171.3	77.4	-6.8	0	0	0	110.7	Q705 K741 R779 A780 Y782	Q705-D777 PolarHBondContact NE2-OD2 2.82Å; K741-D777 PolarHBondContact NZ-O 3.06Å; D777-R779 WeakPolarHBondContact OD1-CA 3.37Å; D777-R779 PolarHBondContact OD1-N 3.06Å; D777-A780 PolarHBondContact N-O 3.36Å; D777-A780 VanDerWaalsContact N-O 3.11Å; D777-A780 PolarHBondContact OD1-N 2.79Å; D777-Y782 HydrophobicContact CB-CE2 4.34Å; D777-Y782 PolarHBondContact OD2-OH 2.76Å
778	S	87.2	Confident	92	Very high	93 Å²	93	28 Å²	28	65%	0.65	13%	0.134	S	C	*	.	S	Bend	trans	-80.4	-15.3	176	56.1	0	0	0	0	114.5
779	R	88.3	Confident	92	Very high	194 Å²	194	28.7 Å²	28.7	73%	0.732	14%	0.139	S	C	*	.	S	Bend	trans	-120	-35.7	-171.5	-63.2	-179.2	178.1	-172.3	-1	113.3	N740 K741 D777	N740-R779 PolarHBondContact OD1-O 3.3Å; K741-R779 WeakPolarHBondContact CB-O 3.48Å; K741-R779 PolarHBondContact N-O 3.41Å; D777-R779 WeakPolarHBondContact OD1-CA 3.37Å; D777-R779 PolarHBondContact OD1-N 3.06Å
780	A	90.7	Very high	92	Very high	11 Å²	11	28.9 Å²	28.9	9%	0.091	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	162.8	-169.3	0	0	0	0	0	113.7	L739 K741 Q776 D777 Y782	L739-A780 CarbonylContact O-C 3.34Å; L739-A780 VanDerWaalsContact O-CA 3.24Å; L739-A780 WeakPolarHBondContact O-CA 3.46Å; K741-A780 WeakPolarHBondContact CE-O 3.42Å; Q776-A780 WeakPolarHBondContact CA-O 3.37Å; D777-A780 PolarHBondContact N-O 3.36Å; D777-A780 VanDerWaalsContact N-O 3.11Å; D777-A780 PolarHBondContact OD1-N 2.79Å; A780-Y782 HydrophobicContact CB-CD2 4.43Å; A780-Y782 HydrophobicContact CB-CE2 3.75Å
781	L	91.6	Very high	92.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	146.4	163.4	-54.1	172.7	0	0	0	108.1	L738 L739 K741 V753 Q776 F1121 F1124	L738-L781 WeakPolarHBondContact CA-O 3.32Å; L739-L781 HydrophobicContact CB-CB 4.22Å; L739-L781 HydrophobicContact CD1-CB 4.46Å; L739-L781 PolarHBondContact N-O 3.48Å; L739-L781 PolarHBondContact O-N 3.06Å; K741-L781 HydrophobicContact CD-CD2 4.43Å; K741-L781 HydrophobicContact CG-CD2 4.17Å; K741-L781 HydrophobicContact CG-CG 4.01Å; V753-L781 HydrophobicContact CG1-CD1 3.7Å; Q776-L781 HydrophobicContact CB-CD2 3.69Å; L781-F1121 HydrophobicContact CD1-CD1 3.71Å; L781-F1121 HydrophobicContact CD1-CE1 3.67Å; L781-F1121 HydrophobicContact CD1-CG 4.17Å; L781-F1121 HydrophobicContact CD1-CZ 4.09Å; L781-F1121 HydrophobicContact CD2-CB 3.96Å; L781-F1121 HydrophobicContact CD2-CD1 4.19Å; L781-F1121 HydrophobicContact CD2-CD2 4.04Å; L781-F1121 HydrophobicContact CD2-CG 3.81Å; L781-F1124 HydrophobicContact CB-CD1 4.3Å; L781-F1124 HydrophobicContact CB-CE1 3.69Å; L781-F1124 HydrophobicContact CB-CE2 4.35Å; L781-F1124 HydrophobicContact CB-CZ 3.72Å; L781-F1124 HydrophobicContact CD1-CD2 4.37Å; L781-F1124 HydrophobicContact CD1-CE2 4.19Å; L781-F1124 HydrophobicContact CD1-CZ 4.38Å; L781-F1124 HydrophobicContact CD2-CD1 3.86Å; L781-F1124 HydrophobicContact CD2-CE1 4.14Å; L781-F1124 HydrophobicContact CD2-CG 4.07Å; L781-F1124 HydrophobicContact CG-CE1 4.4Å; L781-F1124 HydrophobicContact CG-CZ 4.45Å
782	Y	93.1	Very high	92.1	Very high	5 Å²	5	28.1 Å²	28.1	2%	0.02	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	125.5	-175	-61.2	-102.3	0	0	0	109.3	Q705 M736 K737 L738 S774 F775 D777 A780	Q705-Y782 HydrophobicContact CB-CE1 3.87Å; Q705-Y782 PolarHBondContact NE2-OH 3.01Å; Q705-Y782 PolarHBondContact OE1-OH 2.99Å; M736-Y782 HydrophobicContact CE-CD1 4.48Å; M736-Y782 HydrophobicContact CG-CD1 4.23Å; M736-Y782 HydrophobicContact SD-CD1 3.72Å; M736-Y782 HydrophobicContact SD-CE1 4.21Å; K737-Y782 WeakPolarHBondContact O-CA 3.47Å; L738-Y782 HydrophobicContact CD2-CD1 4.1Å; L738-Y782 HydrophobicContact CD2-CE1 3.51Å; L738-Y782 HydrophobicContact CG-CD1 3.89Å; L738-Y782 HydrophobicContact CG-CE1 3.84Å; S774-Y782 CarbonylContact C-O 3.48Å; S774-Y782 WeakPolarHBondContact CA-O 3.05Å; S774-Y782 WeakPolarHBondContact CB-O 3.33Å; F775-Y782 AromaticContact CD2-CD2 3.67Å; F775-Y782 HydrophobicContact CD2-CD2 3.67Å; F775-Y782 HydrophobicContact CD2-CE2 4.37Å; F775-Y782 AromaticContact CD2-CG 3.87Å; F775-Y782 HydrophobicContact CD2-CG 3.87Å; F775-Y782 HydrophobicContact CE1-CG 4.23Å; F775-Y782 AromaticContact CE2-CD1 3.78Å; F775-Y782 HydrophobicContact CE2-CD1 3.78Å; F775-Y782 AromaticContact CE2-CD2 3.45Å; F775-Y782 HydrophobicContact CE2-CD2 3.45Å; F775-Y782 VanDerWaalsContact CE2-CD2 3.45Å; F775-Y782 HydrophobicContact CE2-CE1 4.23Å; F775-Y782 AromaticContact CE2-CE2 3.97Å; F775-Y782 HydrophobicContact CE2-CE2 3.97Å; F775-Y782 AromaticContact CE2-CG 3.36Å; F775-Y782 HydrophobicContact CE2-CG 3.36Å; F775-Y782 HydrophobicContact CG-CG 4.47Å; F775-Y782 AromaticContact CZ-CD1 3.73Å; F775-Y782 HydrophobicContact CZ-CD1 3.73Å; F775-Y782 HydrophobicContact CZ-CD2 4.17Å; F775-Y782 HydrophobicContact CZ-CE1 4.43Å; F775-Y782 AromaticContact CZ-CG 3.57Å; F775-Y782 HydrophobicContact CZ-CG 3.57Å; F775-Y782 PolarHBondContact N-O 3.22Å; F775-Y782 PolarHBondContact O-N 2.84Å; D777-Y782 HydrophobicContact CB-CE2 4.34Å; D777-Y782 PolarHBondContact OD2-OH 2.76Å; A780-Y782 HydrophobicContact CB-CD2 4.43Å; A780-Y782 HydrophobicContact CB-CE2 3.75Å
783	L	92.6	Very high	92.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	126.3	165.3	-59.3	177.9	0	0	0	108.1	M736 K737 E756 R757 L760 L771 F1124	M736-L783 CarbonylContact C-O 3.6Å; M736-L783 WeakPolarHBondContact CA-O 3.3Å; K737-L783 HydrophobicContact CB-CB 4.27Å; K737-L783 HydrophobicContact CD-CD1 4.29Å; K737-L783 PolarHBondContact N-O 3.22Å; K737-L783 PolarHBondContact O-N 3.47Å; E756-L783 HydrophobicContact CG-CD1 3.87Å; R757-L783 HydrophobicContact CB-CD2 4.29Å; R757-L783 HydrophobicContact CG-CD2 4.23Å; L760-L783 HydrophobicContact CD1-CD1 4.37Å; L771-L783 HydrophobicContact CD1-CB 3.78Å; L771-L783 HydrophobicContact CD1-CD2 3.95Å; L771-L783 HydrophobicContact CD1-CG 4.42Å; L771-L783 HydrophobicContact CD2-CD2 4.4Å; L783-F1124 HydrophobicContact CD2-CE1 4.25Å; L783-F1124 HydrophobicContact CD2-CE2 4.05Å; L783-F1124 HydrophobicContact CD2-CZ 3.44Å; L783-F1124 VanDerWaalsContact CD2-CZ 3.44Å; L783-F1124 HydrophobicContact CG-CZ 4.08Å
784	V	94.2	Very high	92.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	112.5	179.7	-174.6	0	0	0	0	108.8	F708 Y734 M736 F772 F773 F775	F708-V784 HydrophobicContact CE1-CG1 3.93Å; F708-V784 HydrophobicContact CE1-CG2 4.34Å; F708-V784 HydrophobicContact CZ-CG1 4.26Å; F708-V784 HydrophobicContact CZ-CG2 4.03Å; Y734-V784 HydrophobicContact CD1-CG1 4.06Å; Y734-V784 HydrophobicContact CD2-CG1 4.29Å; Y734-V784 HydrophobicContact CG-CG1 3.71Å; M736-V784 HydrophobicContact CE-CG2 3.83Å; M736-V784 HydrophobicContact CG-CG2 4.32Å; F772-V784 PolarHBondContact N-O 3.39Å; F773-V784 HydrophobicContact CB-CB 4.16Å; F773-V784 HydrophobicContact CB-CG2 4.47Å; F773-V784 HydrophobicContact CD2-CB 4.09Å; F773-V784 HydrophobicContact CD2-CG1 3.99Å; F773-V784 PolarHBondContact N-O 3Å; F773-V784 VanDerWaalsContact N-O 3.17Å; F773-V784 PolarHBondContact O-N 2.8Å; F775-V784 HydrophobicContact CD1-CG2 4.43Å; F775-V784 HydrophobicContact CE1-CG2 3.74Å
785	M	93.6	Very high	92	Very high	11 Å²	11	27 Å²	27	5%	0.054	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	166.6	-167.2	-58.4	170.1	-63.4	0	0	110.5	Y734 A735 K737 L760 V769 K770 L771	Y734-M785 CarbonylContact C-O 3.54Å; Y734-M785 WeakPolarHBondContact CA-O 2.94Å; Y734-M785 VanDerWaalsContact CB-O 3.3Å; Y734-M785 WeakPolarHBondContact CB-O 3.33Å; A735-M785 HydrophobicContact CB-CE 4.4Å; A735-M785 PolarHBondContact N-O 2.74Å; A735-M785 PolarHBondContact O-N 2.95Å; K737-M785 HydrophobicContact CB-CE 3.9Å; L760-M785 HydrophobicContact CD1-SD 4.08Å; V769-M785 HydrophobicContact CG1-CB 3.77Å; V769-M785 HydrophobicContact CG1-CG 4.24Å; V769-M785 HydrophobicContact CG1-SD 4.11Å; K770-M785 CarbonylContact O-C 3.51Å; K770-M785 VanDerWaalsContact O-CA 3.26Å; K770-M785 WeakPolarHBondContact O-CA 3.44Å; L771-M785 HydrophobicContact CD1-CG 3.9Å
786	E	93.9	Very high	92.1	Very high	40 Å²	40	27.1 Å²	27.1	19%	0.187	14%	0.139	C	C	.	.			trans	-54.2	147.5	166	60.9	-177.9	138.6	0	0	111.8	V769 K770 F772 I788 K846	V769-E786 WeakPolarHBondContact CA-OE1 3.41Å; V769-E786 HydrophobicContact CG1-CG 4.02Å; K770-E786 HydrophobicContact CB-CG 4.18Å; K770-E786 WeakPolarHBondContact CB-OE1 3.21Å; K770-E786 PolarHBondContact N-OE1 3.06Å; K770-E786 PolarHBondContact O-N 3.49Å; F772-E786 HydrophobicContact CE2-CB 3.96Å; E786-I788 HydrophobicContact CG-CD1 3.77Å; E786-I788 HydrophobicContact CG-CG1 4.19Å; E786-K846 WeakPolarHBondContact OE1-CD 3.35Å; E786-K846 IonicContact OE1-NZ 3.76Å; E786-K846 WeakPolarHBondContact OE2-CE 3.49Å
787	Y	95.1	Very high	92.1	Very high	29 Å²	29	24.7 Å²	24.7	11%	0.114	13%	0.127	C	C	.	.			trans	-91.6	126.9	173.4	173.6	-124.3	0	0	0	109.7	L714 L724 P789 D1087 T1088 F1091	L714-Y787 HydrophobicContact CD1-CD2 3.99Å; L714-Y787 HydrophobicContact CD1-CE2 3.8Å; L714-Y787 HydrophobicContact CD2-CE2 4.17Å; L724-Y787 HydrophobicContact CD1-CD1 3.77Å; L724-Y787 HydrophobicContact CD1-CD2 3.73Å; L724-Y787 HydrophobicContact CD1-CE1 4.01Å; L724-Y787 HydrophobicContact CD1-CE2 3.98Å; L724-Y787 HydrophobicContact CD1-CG 3.64Å; Y787-P789 HydrophobicContact CD1-CB 4.5Å; Y787-P789 HydrophobicContact CE1-CB 3.81Å; Y787-P789 WeakPolarHBondContact O-CD 3.29Å; Y787-D1087 PolarHBondContact OH-O 2.77Å; Y787-T1088 WeakPolarHBondContact OH-CG2 3.36Å; Y787-F1091 AromaticContact CE2-CE2 3.79Å; Y787-F1091 HydrophobicContact CE2-CE2 3.79Å; Y787-F1091 AromaticContact CE2-CZ 3.77Å; Y787-F1091 HydrophobicContact CE2-CZ 3.77Å; Y787-F1091 WeakPolarHBondContact OH-CE2 3.38Å
788	I	95.3	Very high	92	Very high	8 Å²	8	26.4 Å²	26.4	4%	0.041	14%	0.136	C	C	.	.			trans	-113.1	97	-174.7	-59.1	-57.9	0	0	0	109.3	V769 E786 G790 L838 I839 K846 F1091	V769-I788 HydrophobicContact CG2-CG1 4.3Å; E786-I788 HydrophobicContact CG-CD1 3.77Å; E786-I788 HydrophobicContact CG-CG1 4.19Å; I788-G790 PolarHBondContact O-N 3.39Å; I788-L838 HydrophobicContact CB-CB 4.24Å; I788-L838 HydrophobicContact CB-CD1 4.04Å; I788-L838 HydrophobicContact CG1-CD1 4.19Å; I788-L838 HydrophobicContact CG2-CB 3.59Å; I788-L838 HydrophobicContact CG2-CD1 4.32Å; I788-I839 VanDerWaalsContact CG2-C 3.45Å; I788-I839 WeakPolarHBondContact CG2-O 3.26Å; I788-K846 HydrophobicContact CD1-CD 3.87Å; I788-F1091 VanDerWaalsContact O-CZ 3.28Å; I788-F1091 WeakPolarHBondContact O-CZ 3.41Å
789	P	94.6	Very high	92.1	Very high	19 Å²	19	28.5 Å²	28.5	12%	0.123	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-9.7	-164.9	29.7	-37.6	0	0	0	116	Y787 G791 R841 I1082 N1090	Y787-P789 HydrophobicContact CD1-CB 4.5Å; Y787-P789 HydrophobicContact CE1-CB 3.81Å; Y787-P789 WeakPolarHBondContact O-CD 3.29Å; P789-G791 VanDerWaalsContact C-N 3.28Å; P789-G791 PolarHBondContact O-N 3.5Å; P789-R841 HydrophobicContact CG-CB 4.02Å; P789-I1082 HydrophobicContact CB-CD1 3.78Å; P789-I1082 HydrophobicContact CB-CG1 4.15Å; P789-I1082 HydrophobicContact CB-CG2 4.38Å; P789-I1082 HydrophobicContact CG-CD1 3.61Å; P789-I1082 HydrophobicContact CG-CG1 4.49Å; P789-N1090 PolarHBondContact O-ND2 3.28Å; P789-N1090 VanDerWaalsContact O-ND2 3.12Å
790	G	94.3	Very high	92.1	Very high	7 Å²	7	24 Å²	24	7%	0.072	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-1.3	179.6	0	0	0	0	0	114.9	I788 I839 N1090	I788-G790 PolarHBondContact O-N 3.39Å; G790-I839 WeakPolarHBondContact CA-O 3.5Å; G790-I839 PolarHBondContact N-O 3.17Å; G790-N1090 WeakPolarHBondContact O-CB 3.47Å
791	G	92.8	Very high	92	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.01	12%	0.118	C	C	.	.			trans	74	-152.5	-177.4	0	0	0	0	0	112.7	P789 L838 I839 N1090	P789-G791 VanDerWaalsContact C-N 3.28Å; P789-G791 PolarHBondContact O-N 3.5Å; G791-L838 CarbonylContact O-C 3.54Å; G791-L838 VanDerWaalsContact O-CA 3.29Å; G791-L838 WeakPolarHBondContact O-CA 3.22Å; G791-I839 PolarHBondContact O-N 3.28Å; G791-N1090 WeakPolarHBondContact CA-O 3.47Å
792	D	92.8	Very high	92	Very high	28 Å²	28	27.3 Å²	27.3	15%	0.15	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-114.1	161.6	-177.4	68.9	81.7	0	0	0	113.8	M794 S795 L796 I837 L838	D792-M794 VanDerWaalsContact C-N 3.27Å; D792-M794 PolarHBondContact O-N 3.39Å; D792-M794 VanDerWaalsContact OD1-CA 3.27Å; D792-M794 WeakPolarHBondContact OD1-CA 3.37Å; D792-M794 WeakPolarHBondContact OD1-CB 3.48Å; D792-M794 PolarHBondContact OD1-N 3.43Å; D792-S795 WeakPolarHBondContact O-CB 3.4Å; D792-S795 PolarHBondContact O-N 3.47Å; D792-S795 PolarHBondContact OD1-N 2.94Å; D792-S795 PolarHBondContact OD1-OG 2.88Å; D792-S795 PolarHBondContact OD2-OG 3.03Å; D792-L796 PolarHBondContact O-N 2.92Å; D792-I837 CarbonylContact C-O 3.58Å; D792-I837 WeakPolarHBondContact CA-O 3.45Å; D792-L838 HydrophobicContact CB-CD2 3.83Å
793	M	93.9	Very high	92.1	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-68	-24	-179	-170.3	63.9	64.4	0	0	112.8	L796 L797 F803 Y811 P834 I837 I839 I845 M998	M793-L796 PolarHBondContact O-N 2.97Å; M793-L796 HydrophobicContact SD-CD2 4.07Å; M793-L797 WeakPolarHBondContact O-CB 3.14Å; M793-L797 WeakPolarHBondContact O-CG 3.46Å; M793-L797 PolarHBondContact O-N 3.34Å; M793-F803 HydrophobicContact SD-CE2 3.7Å; M793-F803 HydrophobicContact SD-CZ 3.78Å; M793-Y811 HydrophobicContact CE-CD1 3.74Å; M793-Y811 HydrophobicContact CE-CD2 3.59Å; M793-Y811 HydrophobicContact CE-CE1 3.97Å; M793-Y811 HydrophobicContact CE-CE2 3.8Å; M793-Y811 HydrophobicContact CE-CG 3.55Å; M793-Y811 HydrophobicContact SD-CD2 3.92Å; M793-Y811 HydrophobicContact SD-CE2 4.15Å; M793-Y811 HydrophobicContact SD-CG 4.39Å; M793-P834 HydrophobicContact CB-CB 4.04Å; M793-P834 WeakPolarHBondContact CB-O 3.26Å; M793-P834 HydrophobicContact CG-CB 4.23Å; M793-P834 PolarHBondContact N-O 3.31Å; M793-I837 HydrophobicContact CB-CB 3.91Å; M793-I837 HydrophobicContact CB-CG2 4.06Å; M793-I837 HydrophobicContact CE-CG2 4.12Å; M793-I837 PolarHBondContact N-O 3.43Å; M793-I839 HydrophobicContact CE-CD1 3.88Å; M793-I839 HydrophobicContact CE-CG1 4.17Å; M793-I839 HydrophobicContact SD-CD1 4.35Å; M793-I845 HydrophobicContact CE-CG2 3.68Å; M793-M998 HydrophobicContact CG-CE 4.14Å; M793-M998 HydrophobicContact SD-CE 4.05Å
794	M	89.7	Confident	92.2	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.025	17%	0.17	C	C	.	.	H	α-helix	trans	-70.6	-42.7	176	-160.7	63.3	-146.8	0	0	110.7	D792 L796 L797 I798 P834 F956	D792-M794 VanDerWaalsContact C-N 3.27Å; D792-M794 PolarHBondContact O-N 3.39Å; D792-M794 VanDerWaalsContact OD1-CA 3.27Å; D792-M794 WeakPolarHBondContact OD1-CA 3.37Å; D792-M794 WeakPolarHBondContact OD1-CB 3.48Å; D792-M794 PolarHBondContact OD1-N 3.43Å; M794-L796 VanDerWaalsContact C-N 3.3Å; M794-L796 PolarHBondContact O-N 3.45Å; M794-L797 WeakPolarHBondContact O-CB 3.27Å; M794-L797 PolarHBondContact O-N 3.3Å; M794-L797 HydrophobicContact SD-CD1 4.24Å; M794-I798 HydrophobicContact CE-CG1 4.43Å; M794-I798 HydrophobicContact CG-CD1 4.44Å; M794-I798 VanDerWaalsContact O-CG1 3.3Å; M794-I798 WeakPolarHBondContact O-CG1 3.39Å; M794-I798 PolarHBondContact O-N 2.85Å; M794-P834 HydrophobicContact CB-CB 3.88Å; M794-P834 HydrophobicContact CG-CB 4.43Å; M794-P834 HydrophobicContact SD-CB 3.8Å; M794-P834 HydrophobicContact SD-CG 3.94Å; M794-F956 HydrophobicContact CB-CZ 4.22Å; M794-F956 HydrophobicContact CE-CE2 4.13Å; M794-F956 HydrophobicContact CG-CE2 3.62Å; M794-F956 HydrophobicContact CG-CZ 3.46Å; M794-F956 VanDerWaalsContact CG-CZ 3.46Å
795	S	88.6	Confident	92.2	Very high	25 Å²	25	35.9 Å²	35.9	18%	0.175	18%	0.176	C	C	.	.	H	α-helix	trans	-58.5	-40.8	171.7	-64.5	0	0	0	0	111.4	D792 K799	D792-S795 WeakPolarHBondContact O-CB 3.4Å; D792-S795 PolarHBondContact O-N 3.47Å; D792-S795 PolarHBondContact OD1-N 2.94Å; D792-S795 PolarHBondContact OD1-OG 2.88Å; D792-S795 PolarHBondContact OD2-OG 3.03Å; S795-K799 VanDerWaalsContact O-CB 3.27Å; S795-K799 WeakPolarHBondContact O-CB 3.5Å; S795-K799 PolarHBondContact O-N 3.28Å
796	L	92.1	Very high	92.2	Very high	6 Å²	6	39 Å²	39	3%	0.031	20%	0.197	C	C	.	.	H	α-helix	trans	-68.6	-40.8	173.8	-173.5	59.7	0	0	0	113.1	D792 M793 M794 I798 K799 K800 F803 Y811 I839 Y1078	D792-L796 PolarHBondContact O-N 2.92Å; M793-L796 PolarHBondContact O-N 2.97Å; M793-L796 HydrophobicContact SD-CD2 4.07Å; M794-L796 VanDerWaalsContact C-N 3.3Å; M794-L796 PolarHBondContact O-N 3.45Å; L796-I798 VanDerWaalsContact C-N 3.33Å; L796-I798 PolarHBondContact O-N 3.04Å; L796-K799 PolarHBondContact O-N 3.37Å; L796-K800 HydrophobicContact CD1-CD 3.99Å; L796-K800 HydrophobicContact CD1-CG 4.28Å; L796-K800 HydrophobicContact CG-CD 4.33Å; L796-K800 PolarHBondContact O-N 2.84Å; L796-F803 HydrophobicContact CB-CZ 4.26Å; L796-F803 HydrophobicContact CD2-CE1 4.49Å; L796-F803 HydrophobicContact CD2-CZ 3.82Å; L796-F803 HydrophobicContact CG-CE1 3.99Å; L796-F803 HydrophobicContact CG-CZ 3.69Å; L796-Y811 HydrophobicContact CD2-CE2 3.88Å; L796-I839 HydrophobicContact CB-CD1 4.27Å; L796-I839 HydrophobicContact CD2-CD1 3.63Å; L796-Y1078 HydrophobicContact CD1-CD1 3.8Å; L796-Y1078 HydrophobicContact CD1-CD2 4.45Å; L796-Y1078 HydrophobicContact CD1-CE1 3.5Å; L796-Y1078 VanDerWaalsContact CD1-CE1 3.5Å; L796-Y1078 HydrophobicContact CD1-CE2 4.22Å; L796-Y1078 HydrophobicContact CD1-CG 4.26Å; L796-Y1078 HydrophobicContact CD2-CD1 3.45Å; L796-Y1078 VanDerWaalsContact CD2-CD1 3.45Å; L796-Y1078 HydrophobicContact CD2-CE1 3.79Å; L796-Y1078 HydrophobicContact CD2-CG 4.2Å; L796-Y1078 HydrophobicContact CG-CD1 4.29Å; L796-Y1078 HydrophobicContact CG-CE1 4.25Å
797	L	90.8	Very high	92.4	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-61	-38.7	174.3	-82	167.5	0	0	0	112.3	M793 M794 G801 F803 P834 E997 M998	M793-L797 WeakPolarHBondContact O-CB 3.14Å; M793-L797 WeakPolarHBondContact O-CG 3.46Å; M793-L797 PolarHBondContact O-N 3.34Å; M794-L797 WeakPolarHBondContact O-CB 3.27Å; M794-L797 PolarHBondContact O-N 3.3Å; M794-L797 HydrophobicContact SD-CD1 4.24Å; L797-G801 WeakPolarHBondContact O-CA 3.32Å; L797-G801 PolarHBondContact O-N 2.82Å; L797-F803 HydrophobicContact CD2-CD1 4.05Å; L797-F803 HydrophobicContact CD2-CD2 4.5Å; L797-F803 HydrophobicContact CD2-CE1 3.76Å; L797-F803 HydrophobicContact CD2-CE2 4.24Å; L797-F803 HydrophobicContact CD2-CG 4.4Å; L797-F803 HydrophobicContact CD2-CZ 3.85Å; L797-F803 HydrophobicContact CG-CE1 4.12Å; L797-F803 HydrophobicContact CG-CZ 3.94Å; L797-P834 HydrophobicContact CD1-CB 3.7Å; L797-P834 HydrophobicContact CD1-CG 3.62Å; L797-E997 HydrophobicContact CD1-CG 4.39Å; L797-M998 HydrophobicContact CD2-CB 4.42Å; L797-M998 HydrophobicContact CD2-CG 3.88Å
798	I	87.6	Confident	92.5	Very high	69 Å²	69	36.2 Å²	36.2	35%	0.354	19%	0.185	S	C	.	.	H	α-helix	trans	-66.2	-48.4	173.1	-67.7	161.9	0	0	0	110.1	M794 L796 K800 G801 F956	M794-I798 HydrophobicContact CE-CG1 4.43Å; M794-I798 HydrophobicContact CG-CD1 4.44Å; M794-I798 VanDerWaalsContact O-CG1 3.3Å; M794-I798 WeakPolarHBondContact O-CG1 3.39Å; M794-I798 PolarHBondContact O-N 2.85Å; L796-I798 VanDerWaalsContact C-N 3.33Å; L796-I798 PolarHBondContact O-N 3.04Å; I798-K800 VanDerWaalsContact C-N 3.34Å; I798-K800 PolarHBondContact O-N 3.26Å; I798-G801 PolarHBondContact O-N 2.7Å; I798-F956 HydrophobicContact CD1-CD1 4.12Å; I798-F956 HydrophobicContact CD1-CD2 3.83Å; I798-F956 HydrophobicContact CD1-CE1 3.91Å; I798-F956 HydrophobicContact CD1-CE2 3.6Å; I798-F956 HydrophobicContact CD1-CG 4.1Å; I798-F956 HydrophobicContact CD1-CZ 3.66Å
799	K	88	Confident	92.6	Very high	136 Å²	136	37.6 Å²	37.6	59%	0.591	19%	0.19	S	C	*	.	H	α-helix	trans	-63.8	-31.5	-177	-174.8	173.3	-178.4	174.6	0	114.2	S795 L796	S795-K799 VanDerWaalsContact O-CB 3.27Å; S795-K799 WeakPolarHBondContact O-CB 3.5Å; S795-K799 PolarHBondContact O-N 3.28Å; L796-K799 PolarHBondContact O-N 3.37Å
800	K	89.7	Confident	92.7	Very high	100 Å²	100	37.1 Å²	37.1	44%	0.435	19%	0.186	S	C	.	.	H	α-helix	trans	-98.8	-20.7	176.2	-74.2	177.6	170.2	-76.1	0	114	L796 I798 I802 F803 L807	L796-K800 HydrophobicContact CD1-CD 3.99Å; L796-K800 HydrophobicContact CD1-CG 4.28Å; L796-K800 HydrophobicContact CG-CD 4.33Å; L796-K800 PolarHBondContact O-N 2.84Å; I798-K800 VanDerWaalsContact C-N 3.34Å; I798-K800 PolarHBondContact O-N 3.26Å; K800-I802 PolarHBondContact O-N 3.01Å; K800-F803 HydrophobicContact CB-CD1 3.89Å; K800-F803 HydrophobicContact CB-CE1 3.92Å; K800-F803 HydrophobicContact CD-CD1 3.89Å; K800-F803 HydrophobicContact CD-CE1 3.8Å; K800-F803 HydrophobicContact CG-CE1 4.39Å; K800-L807 HydrophobicContact CD-CD2 3.54Å
801	G	87.7	Confident	92.9	Very high	7 Å²	7	36.9 Å²	36.9	7%	0.072	18%	0.183	C	C	.	.	S	Bend	trans	75.3	-47.4	178.8	0	0	0	0	0	115	L797 I798 R952	L797-G801 WeakPolarHBondContact O-CA 3.32Å; L797-G801 PolarHBondContact O-N 2.82Å; I798-G801 PolarHBondContact O-N 2.7Å; G801-R952 PolarHBondContact O-NH1 2.67Å; G801-R952 PolarHBondContact O-NH2 3.17Å
802	I	91.8	Very high	93.1	Very high	74 Å²	74	36.9 Å²	36.9	38%	0.379	18%	0.183	S	C	.	.	S	Bend	trans	-143.5	142.5	170.3	-60.6	-179.5	0	0	0	107	K800	K800-I802 PolarHBondContact O-N 3.01Å
803	F	94.8	Very high	93.4	Very high	6 Å²	6	35.6 Å²	35.6	3%	0.026	18%	0.176	C	C	.	.			trans	-91.2	141.1	174	-74.6	9.2	0	0	0	111.3	M793 L796 L797 K800 L807 A808 Y811 M998	M793-F803 HydrophobicContact SD-CE2 3.7Å; M793-F803 HydrophobicContact SD-CZ 3.78Å; L796-F803 HydrophobicContact CB-CZ 4.26Å; L796-F803 HydrophobicContact CD2-CE1 4.49Å; L796-F803 HydrophobicContact CD2-CZ 3.82Å; L796-F803 HydrophobicContact CG-CE1 3.99Å; L796-F803 HydrophobicContact CG-CZ 3.69Å; L797-F803 HydrophobicContact CD2-CD1 4.05Å; L797-F803 HydrophobicContact CD2-CD2 4.5Å; L797-F803 HydrophobicContact CD2-CE1 3.76Å; L797-F803 HydrophobicContact CD2-CE2 4.24Å; L797-F803 HydrophobicContact CD2-CG 4.4Å; L797-F803 HydrophobicContact CD2-CZ 3.85Å; L797-F803 HydrophobicContact CG-CE1 4.12Å; L797-F803 HydrophobicContact CG-CZ 3.94Å; K800-F803 HydrophobicContact CB-CD1 3.89Å; K800-F803 HydrophobicContact CB-CE1 3.92Å; K800-F803 HydrophobicContact CD-CD1 3.89Å; K800-F803 HydrophobicContact CD-CE1 3.8Å; K800-F803 HydrophobicContact CG-CE1 4.39Å; F803-L807 HydrophobicContact CB-CD2 4.24Å; F803-L807 HydrophobicContact CD1-CD2 4.02Å; F803-L807 HydrophobicContact CD2-CD2 3.88Å; F803-L807 HydrophobicContact CD2-CG 3.98Å; F803-L807 HydrophobicContact CE1-CD2 4.35Å; F803-L807 HydrophobicContact CE2-CD2 4.22Å; F803-L807 HydrophobicContact CE2-CG 4.37Å; F803-L807 HydrophobicContact CG-CD2 3.79Å; F803-L807 HydrophobicContact CG-CG 4.3Å; F803-L807 HydrophobicContact CZ-CD2 4.46Å; F803-A808 HydrophobicContact CB-CB 4.25Å; F803-Y811 AromaticContact CE2-CD2 3.97Å; F803-Y811 HydrophobicContact CE2-CD2 3.97Å; F803-Y811 HydrophobicContact CE2-CE2 4.4Å; F803-M998 HydrophobicContact CB-CB 4.21Å; F803-M998 HydrophobicContact CD2-CB 4.12Å; F803-M998 HydrophobicContact CD2-CE 4.27Å; F803-M998 HydrophobicContact CD2-CG 3.67Å; F803-M998 HydrophobicContact CD2-SD 3.99Å; F803-M998 HydrophobicContact CE2-CE 3.92Å; F803-M998 HydrophobicContact CE2-CG 4.03Å; F803-M998 HydrophobicContact CE2-SD 4.26Å; F803-M998 HydrophobicContact CG-CB 4.35Å; F803-M998 HydrophobicContact CG-CG 4.29Å; F803-M998 PolarHBondContact N-O 3.26Å
804	E	94.2	Very high	93.6	Very high	153 Å²	153	35.5 Å²	35.5	72%	0.715	18%	0.175	S	C	*	.			trans	-65.5	147.7	163.6	-62.5	179.6	-169.1	0	0	110.5	P806 L807 A808	E804-P806 VanDerWaalsContact C-CD 3.46Å; E804-L807 WeakPolarHBondContact O-CB 3.48Å; E804-L807 PolarHBondContact O-N 3.33Å; E804-A808 PolarHBondContact O-N 3.44Å
805	E	94.4	Very high	93.9	Very high	25 Å²	25	35.3 Å²	35.3	12%	0.117	18%	0.175	C	C	.	.	H	α-helix	trans	-57.3	-36.7	-175.6	-164.4	-165.6	85.2	0	0	115	L807 A808 R809 L999 K1033 F1062	E805-L807 VanDerWaalsContact C-N 3.33Å; E805-L807 PolarHBondContact O-N 2.89Å; E805-A808 PolarHBondContact O-N 3.46Å; E805-R809 WeakPolarHBondContact O-CB 3.42Å; E805-R809 PolarHBondContact O-N 3.25Å; E805-R809 PolarHBondContact O-NH1 3.1Å; E805-R809 IonicContact OE1-CZ 3.47Å; E805-R809 IonicContact OE1-NH1 2.7Å; E805-R809 PolarHBondContact OE1-NH1 3.45Å; E805-R809 VanDerWaalsContact OE1-NH1 3.08Å; E805-R809 IonicContact OE1-NH2 3.25Å; E805-R809 PolarHBondContact OE1-NH2 2.93Å; E805-L999 HydrophobicContact CB-CD2 4.32Å; E805-L999 HydrophobicContact CG-CD2 4.5Å; E805-K1033 VanDerWaalsContact CD-NZ 3.29Å; E805-K1033 IonicContact OE1-NZ 3.9Å; E805-K1033 PolarHBondContact OE1-NZ 3.11Å; E805-K1033 WeakPolarHBondContact OE2-CD 3.33Å; E805-K1033 WeakPolarHBondContact OE2-CE 3.42Å; E805-K1033 VanDerWaalsContact OE2-CG 3.26Å; E805-K1033 WeakPolarHBondContact OE2-CG 3.49Å; E805-K1033 IonicContact OE2-NZ 2.67Å; E805-K1033 PolarHBondContact OE2-NZ 2.81Å; E805-F1062 HydrophobicContact CG-CE2 3.88Å
806	P	95.1	Very high	94.4	Very high	76 Å²	76	34.1 Å²	34.1	49%	0.494	17%	0.166	S	C	.	.	H	α-helix	trans	-61.3	-38.5	173.6	-23.9	36.1	0	0	0	113.3	E804 F810	E804-P806 VanDerWaalsContact C-CD 3.46Å; P806-F810 PolarHBondContact O-N 2.89Å
807	L	96.3	Very high	94.6	Very high	12 Å²	12	35 Å²	35	6%	0.063	17%	0.17	C	C	.	.	H	α-helix	trans	-70.5	-44.8	177.9	-176.7	68.6	0	0	0	111.2	K800 F803 E804 E805 F810 Y811 P1077	K800-L807 HydrophobicContact CD-CD2 3.54Å; F803-L807 HydrophobicContact CB-CD2 4.24Å; F803-L807 HydrophobicContact CD1-CD2 4.02Å; F803-L807 HydrophobicContact CD2-CD2 3.88Å; F803-L807 HydrophobicContact CD2-CG 3.98Å; F803-L807 HydrophobicContact CE1-CD2 4.35Å; F803-L807 HydrophobicContact CE2-CD2 4.22Å; F803-L807 HydrophobicContact CE2-CG 4.37Å; F803-L807 HydrophobicContact CG-CD2 3.79Å; F803-L807 HydrophobicContact CG-CG 4.3Å; F803-L807 HydrophobicContact CZ-CD2 4.46Å; E804-L807 WeakPolarHBondContact O-CB 3.48Å; E804-L807 PolarHBondContact O-N 3.33Å; E805-L807 VanDerWaalsContact C-N 3.33Å; E805-L807 PolarHBondContact O-N 2.89Å; L807-F810 PolarHBondContact O-N 3.03Å; L807-Y811 HydrophobicContact CD1-CD2 4.06Å; L807-Y811 HydrophobicContact CD1-CE2 3.59Å; L807-Y811 HydrophobicContact CG-CD2 4.2Å; L807-Y811 HydrophobicContact CG-CE2 4.1Å; L807-Y811 PolarHBondContact O-N 3.38Å; L807-Y811 VanDerWaalsContact O-N 3.17Å; L807-P1077 HydrophobicContact CD1-CB 3.96Å
808	A	97.1	Very high	94.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.2	-41.9	175.3	0	0	0	0	0	111.8	F803 E804 E805 F810 Y811 I812 M998 L999	F803-A808 HydrophobicContact CB-CB 4.25Å; E804-A808 PolarHBondContact O-N 3.44Å; E805-A808 PolarHBondContact O-N 3.46Å; A808-F810 PolarHBondContact O-N 2.92Å; A808-Y811 PolarHBondContact O-N 2.89Å; A808-I812 WeakPolarHBondContact O-CB 3.44Å; A808-I812 VanDerWaalsContact O-CG1 3.23Å; A808-I812 WeakPolarHBondContact O-CG1 3.31Å; A808-I812 PolarHBondContact O-N 2.93Å; A808-M998 HydrophobicContact CB-CB 3.99Å; A808-M998 HydrophobicContact CB-SD 4Å; A808-L999 HydrophobicContact CB-CD2 3.76Å; A808-L999 HydrophobicContact CB-CG 4.22Å
809	R	97.5	Very high	95.2	Very high	37 Å²	37	31.6 Å²	31.6	14%	0.14	15%	0.153	C	C	.	.	H	α-helix	trans	-58.2	-46.7	174.9	174	-174.9	-73.3	100	2	111.8	E805 A813 F1062 F1063 S1065 V1066	E805-R809 WeakPolarHBondContact O-CB 3.42Å; E805-R809 PolarHBondContact O-N 3.25Å; E805-R809 PolarHBondContact O-NH1 3.1Å; E805-R809 IonicContact OE1-CZ 3.47Å; E805-R809 IonicContact OE1-NH1 2.7Å; E805-R809 PolarHBondContact OE1-NH1 3.45Å; E805-R809 VanDerWaalsContact OE1-NH1 3.08Å; E805-R809 IonicContact OE1-NH2 3.25Å; E805-R809 PolarHBondContact OE1-NH2 2.93Å; R809-A813 VanDerWaalsContact O-CB 3.28Å; R809-A813 WeakPolarHBondContact O-CB 3.38Å; R809-A813 PolarHBondContact O-N 2.74Å; R809-F1062 HydrophobicContact CB-CE1 4.08Å; R809-F1062 HydrophobicContact CB-CZ 3.91Å; R809-F1062 HydrophobicContact CG-CE1 4.36Å; R809-F1062 PolarHBondContact NE-O 2.89Å; R809-F1062 PolarHBondContact NH2-O 3.46Å; R809-F1062 VanDerWaalsContact NH2-O 3.17Å; R809-F1063 HydrophobicContact CG-CD1 4.46Å; R809-S1065 VanDerWaalsContact CD-OG 3.27Å; R809-S1065 WeakPolarHBondContact CD-OG 3.32Å; R809-V1066 HydrophobicContact CG-CG2 3.78Å
810	F	97.4	Very high	95.5	Very high	9 Å²	9	28.5 Å²	28.5	4%	0.039	14%	0.141	C	C	.	.	H	α-helix	trans	-59	-55.6	178.3	-176.6	-90.1	0	0	0	111.2	P806 L807 A808 I812 A813 E814 L1071 P1076 P1077	P806-F810 PolarHBondContact O-N 2.89Å; L807-F810 PolarHBondContact O-N 3.03Å; A808-F810 PolarHBondContact O-N 2.92Å; F810-I812 PolarHBondContact O-N 2.92Å; F810-A813 WeakPolarHBondContact O-CB 3.21Å; F810-A813 PolarHBondContact O-N 2.63Å; F810-A813 VanDerWaalsContact O-N 3.14Å; F810-E814 HydrophobicContact CD1-CG 4.28Å; F810-E814 HydrophobicContact CE1-CG 3.88Å; F810-E814 WeakPolarHBondContact CE1-OE2 3.38Å; F810-E814 HydrophobicContact CZ-CG 4.18Å; F810-E814 PolarHBondContact O-N 1.94Å; F810-L1071 HydrophobicContact CD2-CD1 3.7Å; F810-L1071 HydrophobicContact CE2-CD1 3.5Å; F810-L1071 VanDerWaalsContact CE2-CD1 3.5Å; F810-L1071 HydrophobicContact CE2-CG 4.46Å; F810-L1071 HydrophobicContact CZ-CD1 4.28Å; F810-P1076 HydrophobicContact CE1-CB 3.72Å; F810-P1076 HydrophobicContact CE1-CG 4.04Å; F810-P1076 HydrophobicContact CZ-CB 3.83Å; F810-P1076 HydrophobicContact CZ-CG 3.84Å; F810-P1077 HydrophobicContact CB-CG 3.93Å; F810-P1077 HydrophobicContact CD1-CG 4.49Å; F810-P1077 HydrophobicContact CD2-CG 4.09Å; F810-P1077 HydrophobicContact CG-CG 3.92Å
811	Y	98	Very high	95.7	Very high	2 Å²	2	25 Å²	25	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-68.9	-30.9	-176.6	-71.8	-45.9	0	0	0	114.5	M793 L796 F803 L807 A808 L815 G843 I845 Y1078	M793-Y811 HydrophobicContact CE-CD1 3.74Å; M793-Y811 HydrophobicContact CE-CD2 3.59Å; M793-Y811 HydrophobicContact CE-CE1 3.97Å; M793-Y811 HydrophobicContact CE-CE2 3.8Å; M793-Y811 HydrophobicContact CE-CG 3.55Å; M793-Y811 HydrophobicContact SD-CD2 3.92Å; M793-Y811 HydrophobicContact SD-CE2 4.15Å; M793-Y811 HydrophobicContact SD-CG 4.39Å; L796-Y811 HydrophobicContact CD2-CE2 3.88Å; F803-Y811 AromaticContact CE2-CD2 3.97Å; F803-Y811 HydrophobicContact CE2-CD2 3.97Å; F803-Y811 HydrophobicContact CE2-CE2 4.4Å; L807-Y811 HydrophobicContact CD1-CD2 4.06Å; L807-Y811 HydrophobicContact CD1-CE2 3.59Å; L807-Y811 HydrophobicContact CG-CD2 4.2Å; L807-Y811 HydrophobicContact CG-CE2 4.1Å; L807-Y811 PolarHBondContact O-N 3.38Å; L807-Y811 VanDerWaalsContact O-N 3.17Å; A808-Y811 PolarHBondContact O-N 2.89Å; Y811-L815 WeakPolarHBondContact O-CB 3.48Å; Y811-L815 PolarHBondContact O-N 2.47Å; Y811-G843 WeakPolarHBondContact CE1-O 3.45Å; Y811-G843 PolarHBondContact OH-O 2.92Å; Y811-G843 VanDerWaalsContact OH-O 3.08Å; Y811-I845 HydrophobicContact CD1-CG2 3.53Å; Y811-I845 HydrophobicContact CE1-CG2 3.75Å; Y811-I845 HydrophobicContact CG-CG2 4.47Å; Y811-Y1078 PolarHBondContact OH-O 3.16Å
812	I	98.2	Very high	95.9	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-74.2	-29.9	173.8	-63.1	-65.9	0	0	0	111.2	A808 F810 L815 T816 V991 I994 L995 M998 F1063	A808-I812 WeakPolarHBondContact O-CB 3.44Å; A808-I812 VanDerWaalsContact O-CG1 3.23Å; A808-I812 WeakPolarHBondContact O-CG1 3.31Å; A808-I812 PolarHBondContact O-N 2.93Å; F810-I812 PolarHBondContact O-N 2.92Å; I812-L815 HydrophobicContact CD1-CD2 4.18Å; I812-T816 WeakPolarHBondContact O-CB 3.36Å; I812-T816 PolarHBondContact O-N 2.83Å; I812-T816 PolarHBondContact O-OG1 2.94Å; I812-V991 HydrophobicContact CD1-CG1 4.19Å; I812-V991 HydrophobicContact CG2-CG1 3.85Å; I812-I994 HydrophobicContact CD1-CB 4.5Å; I812-I994 HydrophobicContact CD1-CG2 4.05Å; I812-L995 HydrophobicContact CD1-CB 4.07Å; I812-L995 HydrophobicContact CG1-CB 4.14Å; I812-L995 HydrophobicContact CG1-CD1 4.09Å; I812-M998 HydrophobicContact CD1-CE 4.27Å; I812-M998 HydrophobicContact CD1-SD 3.94Å; I812-M998 HydrophobicContact CG1-SD 3.84Å; I812-F1063 HydrophobicContact CB-CE1 4.44Å; I812-F1063 HydrophobicContact CG2-CE1 4Å; I812-F1063 HydrophobicContact CG2-CZ 3.87Å
813	A	98.1	Very high	95.8	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67.3	-46.6	170.5	0	0	0	0	0	111.6	R809 F810 L815 T816 L817 F1063 V1066 W1068 L1071	R809-A813 VanDerWaalsContact O-CB 3.28Å; R809-A813 WeakPolarHBondContact O-CB 3.38Å; R809-A813 PolarHBondContact O-N 2.74Å; F810-A813 WeakPolarHBondContact O-CB 3.21Å; F810-A813 PolarHBondContact O-N 2.63Å; F810-A813 VanDerWaalsContact O-N 3.14Å; A813-L815 VanDerWaalsContact C-N 3.35Å; A813-L815 PolarHBondContact O-N 3.47Å; A813-T816 WeakPolarHBondContact O-CB 3.35Å; A813-T816 PolarHBondContact O-N 3.17Å; A813-T816 VanDerWaalsContact O-N 3.16Å; A813-L817 PolarHBondContact O-N 3.27Å; A813-L817 VanDerWaalsContact O-N 3.13Å; A813-F1063 HydrophobicContact CB-CD1 4.13Å; A813-F1063 HydrophobicContact CB-CE1 4.18Å; A813-V1066 HydrophobicContact CB-CG1 3.91Å; A813-V1066 HydrophobicContact CB-CG2 4.35Å; A813-W1068 HydrophobicContact CB-CH2 3.69Å; A813-W1068 HydrophobicContact CB-CZ2 4.5Å; A813-W1068 HydrophobicContact CB-CZ3 3.73Å; A813-W1068 WeakPolarHBondContact O-CZ3 3.35Å; A813-L1071 HydrophobicContact CB-CD2 3.68Å
814	E	97.7	Very high	95.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.4	-45.1	173	-67.4	-158.8	134	0	0	111.9	W767 F810 T816 L817 A818 H844 I845 L1071	W767-E814 HydrophobicContact CH2-CB 4.38Å; W767-E814 HydrophobicContact CH2-CG 4.44Å; W767-E814 HydrophobicContact CZ3-CB 3.92Å; W767-E814 HydrophobicContact CZ3-CG 4.25Å; F810-E814 HydrophobicContact CD1-CG 4.28Å; F810-E814 HydrophobicContact CE1-CG 3.88Å; F810-E814 WeakPolarHBondContact CE1-OE2 3.38Å; F810-E814 HydrophobicContact CZ-CG 4.18Å; F810-E814 PolarHBondContact O-N 1.94Å; E814-T816 PolarHBondContact O-N 2.98Å; E814-L817 WeakPolarHBondContact O-CB 3.5Å; E814-L817 PolarHBondContact O-N 3.3Å; E814-A818 WeakPolarHBondContact O-CB 3.28Å; E814-A818 PolarHBondContact O-N 3.18Å; E814-H844 IonicContact OE1-CE1 3.23Å; E814-H844 IonicContact OE1-CG 2.76Å; E814-H844 IonicContact OE1-ND1 2.84Å; E814-H844 PolarHBondContact OE1-ND1 3.47Å; E814-I845 HydrophobicContact CB-CD1 3.69Å; E814-I845 HydrophobicContact CB-CG1 3.78Å; E814-I845 PolarHBondContact OE2-N 2.92Å; E814-L1071 HydrophobicContact CG-CD2 4.01Å; E814-L1071 HydrophobicContact CG-CG 4.19Å
815	L	97.9	Very high	95.2	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.01	12%	0.119	C	C	.	.	H	α-helix	trans	-61.8	-31.1	177.9	-175.2	58.4	0	0	0	112.1	Y811 I812 A813 L819 I832 I837 I845 L847 V991 I994	Y811-L815 WeakPolarHBondContact O-CB 3.48Å; Y811-L815 PolarHBondContact O-N 2.47Å; I812-L815 HydrophobicContact CD1-CD2 4.18Å; A813-L815 VanDerWaalsContact C-N 3.35Å; A813-L815 PolarHBondContact O-N 3.47Å; L815-L819 HydrophobicContact CD1-CD1 4.42Å; L815-L819 HydrophobicContact CD1-CG 4.38Å; L815-L819 HydrophobicContact CG-CD1 4.36Å; L815-L819 WeakPolarHBondContact O-CB 3.35Å; L815-L819 PolarHBondContact O-N 2.84Å; L815-I832 HydrophobicContact CD2-CG2 4.49Å; L815-I837 HydrophobicContact CD1-CD1 4.01Å; L815-I837 HydrophobicContact CD1-CG1 4.5Å; L815-I837 HydrophobicContact CD2-CD1 3.96Å; L815-I845 HydrophobicContact CB-CD1 3.98Å; L815-I845 HydrophobicContact CD1-CD1 4.45Å; L815-L847 HydrophobicContact CD1-CD2 3.89Å; L815-V991 HydrophobicContact CD2-CG1 4.45Å; L815-V991 HydrophobicContact CD2-CG2 3.89Å; L815-V991 HydrophobicContact CG-CG2 4.1Å; L815-I994 HydrophobicContact CD2-CD1 4.34Å
816	T	97.8	Very high	94.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-67.7	-39.6	173.1	-61.2	0	0	0	0	111.8	I812 A813 E814 Q820 W988 I1057 K1058 W1068	I812-T816 WeakPolarHBondContact O-CB 3.36Å; I812-T816 PolarHBondContact O-N 2.83Å; I812-T816 PolarHBondContact O-OG1 2.94Å; A813-T816 WeakPolarHBondContact O-CB 3.35Å; A813-T816 PolarHBondContact O-N 3.17Å; A813-T816 VanDerWaalsContact O-N 3.16Å; E814-T816 PolarHBondContact O-N 2.98Å; T816-Q820 VanDerWaalsContact O-CB 3.3Å; T816-Q820 WeakPolarHBondContact O-CB 3.49Å; T816-Q820 PolarHBondContact O-N 2.9Å; T816-Q820 VanDerWaalsContact O-N 3.09Å; T816-W988 HydrophobicContact CG2-CH2 3.98Å; T816-W988 HydrophobicContact CG2-CZ3 4.06Å; T816-I1057 HydrophobicContact CG2-CG2 3.86Å; T816-K1058 HydrophobicContact CG2-CG 4.17Å; T816-W1068 HydrophobicContact CG2-CH2 4.24Å; T816-W1068 HydrophobicContact CG2-CZ3 4.28Å
817	L	96.5	Very high	94.2	Very high	23 Å²	23	17.8 Å²	17.8	12%	0.12	11%	0.11	C	C	.	.	H	α-helix	trans	-69.6	-42.4	173.7	-63.7	-173.5	0	0	0	111.8	W767 A813 E814 Q820 S821 W1068 L1071	W767-L817 HydrophobicContact CD2-CB 4.43Å; W767-L817 HydrophobicContact CH2-CB 3.85Å; W767-L817 HydrophobicContact CH2-CD1 3.84Å; W767-L817 HydrophobicContact CH2-CG 4.44Å; W767-L817 HydrophobicContact CZ2-CB 3.4Å; W767-L817 HydrophobicContact CZ2-CD1 3.55Å; W767-L817 HydrophobicContact CZ2-CG 4.11Å; A813-L817 PolarHBondContact O-N 3.27Å; A813-L817 VanDerWaalsContact O-N 3.13Å; E814-L817 WeakPolarHBondContact O-CB 3.5Å; E814-L817 PolarHBondContact O-N 3.3Å; L817-Q820 PolarHBondContact O-N 3.22Å; L817-S821 PolarHBondContact O-N 3.37Å; L817-W1068 HydrophobicContact CD1-CE3 4.45Å; L817-W1068 HydrophobicContact CD2-CE3 3.85Å; L817-W1068 HydrophobicContact CD2-CZ3 4.18Å; L817-W1068 HydrophobicContact CG-CE3 4.11Å; L817-W1068 HydrophobicContact CG-CZ3 4.2Å; L817-L1071 HydrophobicContact CD1-CB 4.44Å; L817-L1071 HydrophobicContact CD1-CD2 3.92Å
818	A	96	Very high	93.7	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-61.3	-48.9	179.3	0	0	0	0	0	112.1	W767 E814 S821 V822 L847	W767-A818 HydrophobicContact CB-CB 3.74Å; W767-A818 HydrophobicContact CD2-CB 4.02Å; W767-A818 HydrophobicContact CE3-CB 3.91Å; W767-A818 HydrophobicContact CG-CB 3.98Å; E814-A818 WeakPolarHBondContact O-CB 3.28Å; E814-A818 PolarHBondContact O-N 3.18Å; A818-S821 WeakPolarHBondContact O-CB 3.36Å; A818-S821 PolarHBondContact O-N 3.33Å; A818-V822 WeakPolarHBondContact O-CG2 3.33Å; A818-V822 PolarHBondContact O-N 2.86Å; A818-L847 HydrophobicContact CB-CD1 3.8Å; A818-L847 HydrophobicContact CB-CG 4.09Å
819	L	95.6	Very high	93.3	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-64.3	-41.4	174.9	-78.9	174.3	0	0	0	112.2	L815 S821 V822 H823 H829 I832 D987 W988 V991	L815-L819 HydrophobicContact CD1-CD1 4.42Å; L815-L819 HydrophobicContact CD1-CG 4.38Å; L815-L819 HydrophobicContact CG-CD1 4.36Å; L815-L819 WeakPolarHBondContact O-CB 3.35Å; L815-L819 PolarHBondContact O-N 2.84Å; L819-S821 PolarHBondContact O-N 3.44Å; L819-V822 PolarHBondContact O-N 3.43Å; L819-H823 VanDerWaalsContact O-CB 3.25Å; L819-H823 WeakPolarHBondContact O-CB 3.15Å; L819-H823 PolarHBondContact O-CD2 2.99Å; L819-H823 PolarHBondContact O-N 2.89Å; L819-H829 HydrophobicContact CD2-CB 4.38Å; L819-I832 HydrophobicContact CD2-CD1 3.77Å; L819-I832 HydrophobicContact CD2-CG1 3.97Å; L819-I832 HydrophobicContact CG-CD1 4.46Å; L819-D987 HydrophobicContact CD1-CB 4.02Å; L819-D987 HydrophobicContact CD2-CB 3.79Å; L819-W988 HydrophobicContact CB-CH2 3.71Å; L819-W988 HydrophobicContact CB-CZ2 3.96Å; L819-W988 HydrophobicContact CB-CZ3 4.3Å; L819-W988 HydrophobicContact CD1-CE3 4.22Å; L819-W988 HydrophobicContact CD1-CH2 4.27Å; L819-W988 HydrophobicContact CD1-CZ3 4.05Å; L819-V991 HydrophobicContact CD1-CG2 3.4Å; L819-V991 VanDerWaalsContact CD1-CG2 3.4Å
820	Q	94.3	Very high	92.9	Very high	72 Å²	72	17.9 Å²	17.9	34%	0.336	11%	0.11	S	C	.	.	H	α-helix	trans	-57.9	-36.9	174.2	-173.2	178.8	13.6	0	0	111.8	T816 L817 A824 P1054 K1058	T816-Q820 VanDerWaalsContact O-CB 3.3Å; T816-Q820 WeakPolarHBondContact O-CB 3.49Å; T816-Q820 PolarHBondContact O-N 2.9Å; T816-Q820 VanDerWaalsContact O-N 3.09Å; L817-Q820 PolarHBondContact O-N 3.22Å; Q820-A824 WeakPolarHBondContact O-CB 3.22Å; Q820-A824 PolarHBondContact O-N 3.4Å; Q820-P1054 HydrophobicContact CB-CB 4.39Å; Q820-P1054 HydrophobicContact CG-CB 4.16Å; Q820-P1054 HydrophobicContact CG-CG 4.3Å; Q820-K1058 VanDerWaalsContact OE1-CE 3.29Å
821	S	93.1	Very high	92.4	Very high	27 Å²	27	18.8 Å²	18.8	19%	0.189	12%	0.115	C	C	.	.	H	α-helix	trans	-67.6	-47.5	175.7	-168.5	0	0	0	0	112.4	N765 L817 A818 L819 H823 A824 M825	N765-S821 PolarHBondContact ND2-OG 2.95Å; L817-S821 PolarHBondContact O-N 3.37Å; A818-S821 WeakPolarHBondContact O-CB 3.36Å; A818-S821 PolarHBondContact O-N 3.33Å; L819-S821 PolarHBondContact O-N 3.44Å; S821-H823 VanDerWaalsContact C-N 3.34Å; S821-H823 PolarHBondContact O-N 3.37Å; S821-A824 PolarHBondContact O-N 3.48Å; S821-M825 WeakPolarHBondContact O-CG 3.42Å; S821-M825 PolarHBondContact O-N 2.87Å; S821-M825 VanDerWaalsContact O-N 3.08Å
822	V	91.1	Very high	92.2	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.5	-43.1	176.3	174.5	0	0	0	0	111.5	V768 A818 L819 M825 F827 L847 F850	V768-V822 HydrophobicContact CG2-CG2 4.05Å; A818-V822 WeakPolarHBondContact O-CG2 3.33Å; A818-V822 PolarHBondContact O-N 2.86Å; L819-V822 PolarHBondContact O-N 3.43Å; V822-M825 HydrophobicContact CG2-CE 4.38Å; V822-M825 PolarHBondContact O-N 2.7Å; V822-F827 HydrophobicContact CG1-CB 3.87Å; V822-F827 PolarHBondContact O-N 3.35Å; V822-F827 VanDerWaalsContact O-N 3.15Å; V822-L847 HydrophobicContact CG2-CD1 4.01Å; V822-F850 HydrophobicContact CG1-CE1 4.44Å; V822-F850 HydrophobicContact CG2-CE1 4.08Å
823	H	91.6	Very high	91.9	Very high	13 Å²	13	20.4 Å²	20.4	6%	0.06	12%	0.122	C	C	.	.	H	α-helix	trans	-66.1	-38.8	177.5	-68.9	179.8	0	0	0	112.2	L819 S821 M825 G826 F827 Q984 D987 W988	L819-H823 VanDerWaalsContact O-CB 3.25Å; L819-H823 WeakPolarHBondContact O-CB 3.15Å; L819-H823 PolarHBondContact O-CD2 2.99Å; L819-H823 PolarHBondContact O-N 2.89Å; S821-H823 VanDerWaalsContact C-N 3.34Å; S821-H823 PolarHBondContact O-N 3.37Å; H823-M825 VanDerWaalsContact C-N 3.32Å; H823-M825 PolarHBondContact O-N 2.95Å; H823-G826 PolarHBondContact O-N 3.26Å; H823-F827 WeakPolarHBondContact CA-O 3.39Å; H823-F827 PolarHBondContact CD2-O 2.71Å; H823-F827 VanDerWaalsContact CD2-O 3.32Å; H823-Q984 HydrophobicContact CB-CG 4.19Å; H823-Q984 PolarHBondContact CE1-O 2.66Å; H823-Q984 PolarHBondContact O-NE2 3.47Å; H823-Q984 VanDerWaalsContact O-NE2 3.16Å; H823-D987 IonicContact CD2-OD2 2.92Å; H823-D987 IonicContact CE1-OD2 3.81Å; H823-D987 IonicContact NE2-OD2 2.73Å; H823-D987 PolarHBondContact NE2-OD2 3.31Å; H823-W988 AromaticContact CE1-CE2 3.87Å; H823-W988 AromaticContact CE1-NE1 3.53Å; H823-W988 AromaticContact ND1-CZ2 3.93Å; H823-W988 AromaticContact ND1-NE1 3.74Å
824	A	90.1	Very high	91.6	Very high	76 Å²	76	20.4 Å²	20.4	63%	0.628	12%	0.122	S	C	*	.	H	α-helix	trans	-69	-27.1	175.9	0	0	0	0	0	113.5	Q820 S821 G826	Q820-A824 WeakPolarHBondContact O-CB 3.22Å; Q820-A824 PolarHBondContact O-N 3.4Å; S821-A824 PolarHBondContact O-N 3.48Å; A824-G826 PolarHBondContact O-N 3.08Å
825	M	84.8	Confident	91.1	Very high	57 Å²	57	22.2 Å²	22.2	28%	0.281	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-1.4	169.2	-66.6	-175.1	-64.9	0	0	113.2	A763 N765 V768 S821 V822 H823 F827	A763-M825 HydrophobicContact CB-CE 3.99Å; A763-M825 HydrophobicContact CB-SD 4.02Å; N765-M825 WeakPolarHBondContact ND2-CE 3.4Å; V768-M825 HydrophobicContact CG2-CE 4.23Å; S821-M825 WeakPolarHBondContact O-CG 3.42Å; S821-M825 PolarHBondContact O-N 2.87Å; S821-M825 VanDerWaalsContact O-N 3.08Å; V822-M825 HydrophobicContact CG2-CE 4.38Å; V822-M825 PolarHBondContact O-N 2.7Å; H823-M825 VanDerWaalsContact C-N 3.32Å; H823-M825 PolarHBondContact O-N 2.95Å; M825-F827 HydrophobicContact CB-CD2 3.74Å; M825-F827 HydrophobicContact CB-CE2 4.07Å; M825-F827 WeakPolarHBondContact O-CD2 3.46Å; M825-F827 WeakPolarHBondContact O-CE2 3.27Å
826	G	83.8	Confident	90.8	Very high	40 Å²	40	22.4 Å²	22.4	41%	0.412	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.9	13.3	177.8	0	0	0	0	0	114.9	H823 A824 G855	H823-G826 PolarHBondContact O-N 3.26Å; A824-G826 PolarHBondContact O-N 3.08Å; G826-G855 WeakPolarHBondContact O-CA 3.32Å
827	F	84.9	Confident	90.7	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.009	13%	0.133	C	C	.	.			trans	-104.5	153.6	-179.5	-61.6	-76.8	0	0	0	112.2	I759 V822 H823 M825 T854 H860	I759-F827 HydrophobicContact CD1-CB 4.45Å; I759-F827 HydrophobicContact CD1-CD1 3.55Å; I759-F827 HydrophobicContact CD1-CE1 3.93Å; I759-F827 HydrophobicContact CD1-CG 4.01Å; I759-F827 HydrophobicContact CG1-CD1 3.41Å; I759-F827 VanDerWaalsContact CG1-CD1 3.41Å; I759-F827 HydrophobicContact CG1-CD2 4.08Å; I759-F827 HydrophobicContact CG1-CE1 3.33Å; I759-F827 HydrophobicContact CG1-CE2 4.01Å; I759-F827 HydrophobicContact CG1-CG 3.8Å; I759-F827 HydrophobicContact CG1-CZ 3.65Å; V822-F827 HydrophobicContact CG1-CB 3.87Å; V822-F827 PolarHBondContact O-N 3.35Å; V822-F827 VanDerWaalsContact O-N 3.15Å; H823-F827 WeakPolarHBondContact CA-O 3.39Å; H823-F827 PolarHBondContact CD2-O 2.71Å; H823-F827 VanDerWaalsContact CD2-O 3.32Å; M825-F827 HydrophobicContact CB-CD2 3.74Å; M825-F827 HydrophobicContact CB-CE2 4.07Å; M825-F827 WeakPolarHBondContact O-CD2 3.46Å; M825-F827 WeakPolarHBondContact O-CE2 3.27Å; F827-T854 WeakPolarHBondContact CA-O 3.4Å; F827-H860 AromaticContact CE1-CE1 3.21Å; F827-H860 WeakPolarHBondContact CE1-CE1 3.48Å; F827-H860 AromaticContact CZ-CE1 3.92Å
828	V	86.9	Confident	90.7	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.012	14%	0.135	C	C	.	.	B	Isolated β-bridge	trans	-117.2	134.8	167	-173.6	0	0	0	0	107.5	R830 C853 T854 F856 Q984 C986	V828-R830 HydrophobicContact CB-CG 4.31Å; V828-R830 HydrophobicContact CG1-CG 3.8Å; V828-C853 VanDerWaalsContact O-CA 3.3Å; V828-C853 WeakPolarHBondContact O-CA 3.38Å; V828-C853 WeakPolarHBondContact O-CB 3.3Å; V828-T854 PolarHBondContact N-O 2.91Å; V828-T854 PolarHBondContact O-N 3.03Å; V828-F856 HydrophobicContact CG2-CE2 3.79Å; V828-F856 HydrophobicContact CG2-CZ 4.29Å; V828-Q984 HydrophobicContact CG2-CG 3.84Å; V828-C986 WeakPolarHBondContact CG1-SG 3.44Å
829	H	88.7	Confident	90.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.135	C	C	.	.			trans	-79.9	-42.4	-172.4	-166.2	-71	0	0	0	112.4	L819 D831 I832 N836 T848 F850 L852 C853 D987	L819-H829 HydrophobicContact CD2-CB 4.38Å; H829-D831 PolarHBondContact CE1-O 3.46Å; H829-D831 VanDerWaalsContact ND1-C 3.3Å; H829-D831 PolarHBondContact ND1-N 3.24Å; H829-D831 PolarHBondContact ND1-O 2.83Å; H829-D831 PolarHBondContact O-N 2.73Å; H829-I832 HydrophobicContact CB-CD1 3.85Å; H829-I832 HydrophobicContact CB-CG1 3.82Å; H829-I832 VanDerWaalsContact CG-CD1 3.43Å; H829-N836 PolarHBondContact CE1-ND2 3.48Å; H829-T848 PolarHBondContact CE1-O 3.35Å; H829-T848 PolarHBondContact NE2-O 3.4Å; H829-F850 AromaticContact CD2-CD1 3.9Å; H829-F850 AromaticContact CD2-CE1 3.67Å; H829-F850 AromaticContact NE2-CD1 3.93Å; H829-F850 AromaticContact NE2-CD2 3.88Å; H829-F850 AromaticContact NE2-CE1 3.82Å; H829-F850 AromaticContact NE2-CE2 3.79Å; H829-F850 AromaticContact NE2-CG 3.95Å; H829-F850 AromaticContact NE2-CZ 3.74Å; H829-L852 CarbonylContact O-C 3.55Å; H829-C853 VanDerWaalsContact CA-SG 3.54Å; H829-C853 WeakPolarHBondContact O-CA 3.33Å; H829-C853 PolarHBondContact O-SG 2.63Å; H829-D987 PolarHBondContact N-OD1 2.93Å; H829-D987 PolarHBondContact N-OD2 3.2Å
830	R	87.7	Confident	90.7	Very high	50 Å²	50	24.1 Å²	24.1	19%	0.189	14%	0.142	C	C	.	.	S	Bend	trans	63.6	-17.5	178.1	-51	-172.9	-64.3	171.7	3.8	116.6	V828 L852 C853 Y982 D987	V828-R830 HydrophobicContact CB-CG 4.31Å; V828-R830 HydrophobicContact CG1-CG 3.8Å; R830-L852 PolarHBondContact NE-O 2.97Å; R830-L852 PolarHBondContact NH2-O 2.78Å; R830-C853 PolarHBondContact NH2-O 3.04Å; R830-C853 VanDerWaalsContact NH2-O 3.17Å; R830-Y982 VanDerWaalsContact CD-CE2 3.43Å; R830-Y982 HydrophobicContact CG-CE2 4.33Å; R830-Y982 PolarHBondContact NH1-OH 2.98Å; R830-D987 WeakPolarHBondContact CA-OD1 3.47Å; R830-D987 PolarHBondContact N-OD1 2.93Å
831	D	87.1	Confident	90.7	Very high	28 Å²	28	27 Å²	27	15%	0.15	15%	0.149	C	C	.	.			trans	-131.7	53.3	179.1	-173.1	31.5	0	0	0	111.5	H829 K833 N836 L852	H829-D831 PolarHBondContact CE1-O 3.46Å; H829-D831 VanDerWaalsContact ND1-C 3.3Å; H829-D831 PolarHBondContact ND1-N 3.24Å; H829-D831 PolarHBondContact ND1-O 2.83Å; H829-D831 PolarHBondContact O-N 2.73Å; D831-K833 VanDerWaalsContact CG-NZ 3.3Å; D831-K833 PolarHBondContact O-N 3.42Å; D831-K833 IonicContact OD1-NZ 2.66Å; D831-K833 PolarHBondContact OD1-NZ 3Å; D831-K833 IonicContact OD2-NZ 2.69Å; D831-K833 PolarHBondContact OD2-NZ 3.02Å; D831-N836 PolarHBondContact O-ND2 3.11Å; D831-N836 PolarHBondContact OD2-ND2 3.25Å; D831-L852 HydrophobicContact CB-CB 3.8Å; D831-L852 HydrophobicContact CB-CD1 3.82Å; D831-L852 HydrophobicContact CB-CG 4.39Å
832	I	93.7	Very high	90.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.162	C	C	.	.			trans	-76.4	115.1	171.8	-68.4	-69	0	0	0	108.7	L815 L819 H829 L847 Y971 D987 S990 I994	L815-I832 HydrophobicContact CD2-CG2 4.49Å; L819-I832 HydrophobicContact CD2-CD1 3.77Å; L819-I832 HydrophobicContact CD2-CG1 3.97Å; L819-I832 HydrophobicContact CG-CD1 4.46Å; H829-I832 HydrophobicContact CB-CD1 3.85Å; H829-I832 HydrophobicContact CB-CG1 3.82Å; H829-I832 VanDerWaalsContact CG-CD1 3.43Å; I832-L847 HydrophobicContact CD1-CD1 4.4Å; I832-L847 HydrophobicContact CD1-CD2 4.09Å; I832-Y971 VanDerWaalsContact O-CB 3.29Å; I832-Y971 WeakPolarHBondContact O-CB 3.33Å; I832-D987 HydrophobicContact CG1-CB 4.27Å; I832-S990 WeakPolarHBondContact O-CB 3.36Å; I832-I994 HydrophobicContact CG2-CD1 3.66Å
833	K	92	Very high	91	Very high	37 Å²	37	30.4 Å²	30.4	16%	0.161	16%	0.162	C	C	.	.			trans	-150	158.1	178.2	61	177.7	-173.5	-75.9	0	109.3	D831 D835 N836 Y971	D831-K833 VanDerWaalsContact CG-NZ 3.3Å; D831-K833 PolarHBondContact O-N 3.42Å; D831-K833 IonicContact OD1-NZ 2.66Å; D831-K833 PolarHBondContact OD1-NZ 3Å; D831-K833 IonicContact OD2-NZ 2.69Å; D831-K833 PolarHBondContact OD2-NZ 3.02Å; K833-D835 HydrophobicContact CD-CB 4.26Å; K833-D835 HydrophobicContact CG-CB 4.26Å; K833-D835 PolarHBondContact O-N 3.01Å; K833-N836 WeakPolarHBondContact CE-OD1 3.25Å; K833-N836 HydrophobicContact CG-CB 4.01Å; K833-N836 PolarHBondContact NZ-ND2 2.85Å; K833-N836 PolarHBondContact NZ-OD1 3.02Å; K833-N836 PolarHBondContact O-N 2.82Å; K833-Y971 HydrophobicContact CB-CD2 3.53Å; K833-Y971 HydrophobicContact CB-CE2 3.88Å; K833-Y971 HydrophobicContact CB-CG 3.92Å
834	P	92.3	Very high	91.3	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-58.7	-31.5	-177.4	-25	35.5	0	0	0	114	M793 M794 L797 N836 I837 Y971 I994	M793-P834 HydrophobicContact CB-CB 4.04Å; M793-P834 WeakPolarHBondContact CB-O 3.26Å; M793-P834 HydrophobicContact CG-CB 4.23Å; M793-P834 PolarHBondContact N-O 3.31Å; M794-P834 HydrophobicContact CB-CB 3.88Å; M794-P834 HydrophobicContact CG-CB 4.43Å; M794-P834 HydrophobicContact SD-CB 3.8Å; M794-P834 HydrophobicContact SD-CG 3.94Å; L797-P834 HydrophobicContact CD1-CB 3.7Å; L797-P834 HydrophobicContact CD1-CG 3.62Å; P834-N836 PolarHBondContact O-N 3.29Å; P834-I837 PolarHBondContact O-N 2.8Å; P834-Y971 VanDerWaalsContact CD-CZ 3.46Å; P834-Y971 HydrophobicContact CG-CE1 4.1Å; P834-I994 HydrophobicContact CG-CD1 4.43Å; P834-I994 HydrophobicContact CG-CG1 4.13Å
835	D	87.3	Confident	91.7	Very high	37 Å²	37	27.7 Å²	27.7	20%	0.198	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-63.9	-24.6	175.5	-43.6	-113.8	0	0	0	113.4	K833 I837 R959	K833-D835 HydrophobicContact CD-CB 4.26Å; K833-D835 HydrophobicContact CG-CB 4.26Å; K833-D835 PolarHBondContact O-N 3.01Å; D835-I837 VanDerWaalsContact C-N 3.35Å; D835-R959 IonicContact OD1-CZ 3.73Å; D835-R959 IonicContact OD1-NH1 3.39Å; D835-R959 PolarHBondContact OD1-NH1 2.83Å; D835-R959 IonicContact OD2-CZ 2.77Å; D835-R959 IonicContact OD2-NH1 3.72Å; D835-R959 PolarHBondContact OD2-NH1 2.95Å
836	N	92.5	Very high	92.2	Very high	7 Å²	7	25.6 Å²	25.6	4%	0.037	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-93.8	7.9	179.9	-74.7	6.5	0	0	0	112.6	H829 D831 K833 P834 T848	H829-N836 PolarHBondContact CE1-ND2 3.48Å; D831-N836 PolarHBondContact O-ND2 3.11Å; D831-N836 PolarHBondContact OD2-ND2 3.25Å; K833-N836 WeakPolarHBondContact CE-OD1 3.25Å; K833-N836 HydrophobicContact CG-CB 4.01Å; K833-N836 PolarHBondContact NZ-ND2 2.85Å; K833-N836 PolarHBondContact NZ-OD1 3.02Å; K833-N836 PolarHBondContact O-N 2.82Å; P834-N836 PolarHBondContact O-N 3.29Å; N836-T848 PolarHBondContact O-N 3.01Å
837	I	95.5	Very high	92.8	Very high	2 Å²	2	23.7 Å²	23.7	1%	0.01	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	103	178.3	-58.1	172.5	0	0	0	107.3	D792 M793 L815 P834 D835 I845 L847 I994	D792-I837 CarbonylContact C-O 3.58Å; D792-I837 WeakPolarHBondContact CA-O 3.45Å; M793-I837 HydrophobicContact CB-CB 3.91Å; M793-I837 HydrophobicContact CB-CG2 4.06Å; M793-I837 HydrophobicContact CE-CG2 4.12Å; M793-I837 PolarHBondContact N-O 3.43Å; L815-I837 HydrophobicContact CD1-CD1 4.01Å; L815-I837 HydrophobicContact CD1-CG1 4.5Å; L815-I837 HydrophobicContact CD2-CD1 3.96Å; P834-I837 PolarHBondContact O-N 2.8Å; D835-I837 VanDerWaalsContact C-N 3.35Å; I837-I845 HydrophobicContact CG2-CB 3.73Å; I837-I845 HydrophobicContact CG2-CD1 4.04Å; I837-I845 HydrophobicContact CG2-CG1 4.42Å; I837-I845 HydrophobicContact CG2-CG2 3.71Å; I837-L847 HydrophobicContact CG1-CD2 3.96Å; I837-I994 HydrophobicContact CD1-CD1 4.02Å
838	L	96.3	Very high	93	Very high	31 Å²	31	24.5 Å²	24.5	16%	0.162	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	157.7	177.5	-53.3	-174.8	0	0	0	111.2	V769 I788 G791 D792 I845 K846 T848	V769-L838 HydrophobicContact CG2-CD1 4.09Å; I788-L838 HydrophobicContact CB-CB 4.24Å; I788-L838 HydrophobicContact CB-CD1 4.04Å; I788-L838 HydrophobicContact CG1-CD1 4.19Å; I788-L838 HydrophobicContact CG2-CB 3.59Å; I788-L838 HydrophobicContact CG2-CD1 4.32Å; G791-L838 CarbonylContact O-C 3.54Å; G791-L838 VanDerWaalsContact O-CA 3.29Å; G791-L838 WeakPolarHBondContact O-CA 3.22Å; D792-L838 HydrophobicContact CB-CD2 3.83Å; L838-I845 CarbonylContact O-C 3.51Å; L838-I845 VanDerWaalsContact O-CA 3.23Å; L838-I845 WeakPolarHBondContact O-CA 3.38Å; L838-K846 PolarHBondContact N-O 2.84Å; L838-K846 PolarHBondContact O-N 2.83Å; L838-T848 HydrophobicContact CD1-CG2 3.96Å; L838-T848 HydrophobicContact CD2-CG2 4.02Å; L838-T848 HydrophobicContact CG-CG2 3.7Å
839	I	96.4	Very high	92.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	124.6	-178.7	-54.6	179.7	0	0	0	109.6	I788 G790 G791 M793 L796 H844 P1080	I788-I839 VanDerWaalsContact CG2-C 3.45Å; I788-I839 WeakPolarHBondContact CG2-O 3.26Å; G790-I839 WeakPolarHBondContact CA-O 3.5Å; G790-I839 PolarHBondContact N-O 3.17Å; G791-I839 PolarHBondContact O-N 3.28Å; M793-I839 HydrophobicContact CE-CD1 3.88Å; M793-I839 HydrophobicContact CE-CG1 4.17Å; M793-I839 HydrophobicContact SD-CD1 4.35Å; L796-I839 HydrophobicContact CB-CD1 4.27Å; L796-I839 HydrophobicContact CD2-CD1 3.63Å; I839-H844 WeakPolarHBondContact CA-O 3.38Å; I839-P1080 HydrophobicContact CG2-CG 4.29Å
840	N	95.1	Very high	92.2	Very high	26 Å²	26	26.6 Å²	26.6	14%	0.139	12%	0.123	C	C	.	.			trans	-74.4	179	178.7	77.5	-4.6	0	0	0	112.5	E842 G843 H844 P1080	N840-E842 PolarHBondContact ND2-OE2 2.97Å; N840-E842 VanDerWaalsContact ND2-OE2 3.1Å; N840-E842 PolarHBondContact O-N 3.19Å; N840-E842 PolarHBondContact OD1-N 3.37Å; N840-G843 PolarHBondContact O-N 2.92Å; N840-G843 PolarHBondContact OD1-N 2.93Å; N840-H844 PolarHBondContact N-O 3Å; N840-H844 PolarHBondContact OD1-N 3.13Å; N840-H844 PolarHBondContact OD1-O 2.92Å; N840-P1080 WeakPolarHBondContact O-CG 3.23Å
841	R	94.6	Very high	90.8	Very high	133 Å²	133	24.6 Å²	24.6	50%	0.502	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-29.5	-177.6	176.5	179	-158	173.3	8.2	112.2	P789 V1079 I1082	P789-R841 HydrophobicContact CG-CB 4.02Å; R841-V1079 WeakPolarHBondContact O-CG1 3.29Å; R841-I1082 HydrophobicContact CB-CD1 3.9Å; R841-I1082 HydrophobicContact CG-CD1 3.83Å
842	E	95	Very high	89.7	Confident	98 Å²	98	26.9 Å²	26.9	46%	0.458	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-17	-177.3	-60.9	63	-136.9	0	0	112.1	N840 P1076	N840-E842 PolarHBondContact ND2-OE2 2.97Å; N840-E842 VanDerWaalsContact ND2-OE2 3.1Å; N840-E842 PolarHBondContact O-N 3.19Å; N840-E842 PolarHBondContact OD1-N 3.37Å; E842-P1076 VanDerWaalsContact O-CD 3.3Å; E842-P1076 WeakPolarHBondContact O-CD 3.31Å; E842-P1076 WeakPolarHBondContact O-CG 3.46Å
843	G	95.6	Very high	88.4	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	104.7	-1.2	177.1	0	0	0	0	0	116.1	Y811 N840 P1076 Y1078	Y811-G843 WeakPolarHBondContact CE1-O 3.45Å; Y811-G843 PolarHBondContact OH-O 2.92Å; Y811-G843 VanDerWaalsContact OH-O 3.08Å; N840-G843 PolarHBondContact O-N 2.92Å; N840-G843 PolarHBondContact OD1-N 2.93Å; G843-P1076 VanDerWaalsContact C-CG 3.43Å; G843-Y1078 WeakPolarHBondContact CA-O 3.27Å
844	H	97.3	Very high	86.7	Confident	28 Å²	28	25.7 Å²	25.7	13%	0.13	13%	0.125	C	C	.	.			trans	-82.7	154.1	177.9	-62.7	-85.2	0	0	0	111.7	E814 I839 N840 V1072 Q1074	E814-H844 IonicContact OE1-CE1 3.23Å; E814-H844 IonicContact OE1-CG 2.76Å; E814-H844 IonicContact OE1-ND1 2.84Å; E814-H844 PolarHBondContact OE1-ND1 3.47Å; I839-H844 WeakPolarHBondContact CA-O 3.38Å; N840-H844 PolarHBondContact N-O 3Å; N840-H844 PolarHBondContact OD1-N 3.13Å; N840-H844 PolarHBondContact OD1-O 2.92Å; H844-V1072 PolarHBondContact CE1-O 2.9Å; H844-Q1074 PolarHBondContact CE1-O 3.16Å
845	I	97.5	Very high	84.9	Confident	4 Å²	4	26.5 Å²	26.5	2%	0.021	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	149.1	-178.2	71.5	178.2	0	0	0	115.2	M793 Y811 E814 L815 I837 L838	M793-I845 HydrophobicContact CE-CG2 3.68Å; Y811-I845 HydrophobicContact CD1-CG2 3.53Å; Y811-I845 HydrophobicContact CE1-CG2 3.75Å; Y811-I845 HydrophobicContact CG-CG2 4.47Å; E814-I845 HydrophobicContact CB-CD1 3.69Å; E814-I845 HydrophobicContact CB-CG1 3.78Å; E814-I845 PolarHBondContact OE2-N 2.92Å; L815-I845 HydrophobicContact CB-CD1 3.98Å; L815-I845 HydrophobicContact CD1-CD1 4.45Å; I837-I845 HydrophobicContact CG2-CB 3.73Å; I837-I845 HydrophobicContact CG2-CD1 4.04Å; I837-I845 HydrophobicContact CG2-CG1 4.42Å; I837-I845 HydrophobicContact CG2-CG2 3.71Å; L838-I845 CarbonylContact O-C 3.51Å; L838-I845 VanDerWaalsContact O-CA 3.23Å; L838-I845 WeakPolarHBondContact O-CA 3.38Å
846	K	96.3	Very high	83.4	Confident	12 Å²	12	31 Å²	31	5%	0.052	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	136.7	163.9	-66.9	-170.4	-178.4	-80.5	0	110.8	E766 V769 E786 I788 L838	E766-K846 WeakPolarHBondContact O-CG 3.44Å; E766-K846 PolarHBondContact O-NZ 3.02Å; E766-K846 IonicContact OE2-NZ 3.81Å; E766-K846 PolarHBondContact OE2-NZ 3.11Å; V769-K846 HydrophobicContact CG2-CB 3.99Å; E786-K846 WeakPolarHBondContact OE1-CD 3.35Å; E786-K846 IonicContact OE1-NZ 3.76Å; E786-K846 WeakPolarHBondContact OE2-CE 3.49Å; I788-K846 HydrophobicContact CD1-CD 3.87Å; L838-K846 PolarHBondContact N-O 2.84Å; L838-K846 PolarHBondContact O-N 2.83Å
847	L	95.2	Very high	81.7	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	143.8	176.8	-65.9	178.9	0	0	0	111.8	W767 V769 L815 A818 V822 I832 I837 F850	W767-L847 WeakPolarHBondContact O-CB 3.45Å; W767-L847 PolarHBondContact O-N 2.95Å; V769-L847 WeakPolarHBondContact CG2-O 3.12Å; V769-L847 PolarHBondContact N-O 2.86Å; L815-L847 HydrophobicContact CD1-CD2 3.89Å; A818-L847 HydrophobicContact CB-CD1 3.8Å; A818-L847 HydrophobicContact CB-CG 4.09Å; V822-L847 HydrophobicContact CG2-CD1 4.01Å; I832-L847 HydrophobicContact CD1-CD1 4.4Å; I832-L847 HydrophobicContact CD1-CD2 4.09Å; I837-L847 HydrophobicContact CG1-CD2 3.96Å; L847-F850 HydrophobicContact CB-CE2 4.26Å; L847-F850 HydrophobicContact CB-CZ 3.79Å; L847-F850 WeakPolarHBondContact O-CE2 3.22Å
848	T	90.9	Very high	79.6	Confident	20 Å²	20	39.3 Å²	39.3	12%	0.123	18%	0.182	C	C	.	.			trans	-138.4	-178.8	179.5	-162.2	0	0	0	0	113	H829 N836 L838	H829-T848 PolarHBondContact CE1-O 3.35Å; H829-T848 PolarHBondContact NE2-O 3.4Å; N836-T848 PolarHBondContact O-N 3.01Å; L838-T848 HydrophobicContact CD1-CG2 3.96Å; L838-T848 HydrophobicContact CD2-CG2 4.02Å; L838-T848 HydrophobicContact CG-CG2 3.7Å
849	D	80.8	Confident	77.8	Confident	46 Å²	46	39 Å²	39	25%	0.246	18%	0.181	C	C	.	.			trans	51.5	56.9	177.3	-158	33.4	0	0	0	115.1	K737 G851	K737-D849 IonicContact NZ-OD1 3.8Å; K737-D849 PolarHBondContact NZ-OD1 2.93Å; D849-G851 PolarHBondContact O-N 3.47Å
850	F	76.1	Confident	76.1	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-71.3	17.4	-179.5	-66.1	-104.2	0	0	0	114.3	E756 I759 L760 V768 V822 H829 L847 L852 C853	E756-F850 HydrophobicContact CG-CB 4.39Å; I759-F850 HydrophobicContact CB-CB 4.41Å; I759-F850 HydrophobicContact CB-CD1 4.3Å; I759-F850 HydrophobicContact CB-CG 4.47Å; I759-F850 HydrophobicContact CD1-CB 4.14Å; I759-F850 HydrophobicContact CD1-CD1 4.16Å; I759-F850 HydrophobicContact CG2-CB 4.43Å; I759-F850 HydrophobicContact CG2-CD1 3.47Å; I759-F850 VanDerWaalsContact CG2-CD1 3.47Å; I759-F850 HydrophobicContact CG2-CE1 3.85Å; I759-F850 HydrophobicContact CG2-CG 3.97Å; L760-F850 HydrophobicContact CD2-CD2 3.54Å; L760-F850 HydrophobicContact CD2-CE2 3.8Å; L760-F850 HydrophobicContact CD2-CG 4.43Å; L760-F850 HydrophobicContact CG-CD2 4.26Å; V768-F850 HydrophobicContact CB-CZ 4.3Å; V768-F850 HydrophobicContact CG1-CE1 4.5Å; V768-F850 HydrophobicContact CG1-CE2 3.73Å; V768-F850 HydrophobicContact CG1-CZ 3.64Å; V768-F850 HydrophobicContact CG2-CZ 3.92Å; V822-F850 HydrophobicContact CG1-CE1 4.44Å; V822-F850 HydrophobicContact CG2-CE1 4.08Å; H829-F850 AromaticContact CD2-CD1 3.9Å; H829-F850 AromaticContact CD2-CE1 3.67Å; H829-F850 AromaticContact NE2-CD1 3.93Å; H829-F850 AromaticContact NE2-CD2 3.88Å; H829-F850 AromaticContact NE2-CE1 3.82Å; H829-F850 AromaticContact NE2-CE2 3.79Å; H829-F850 AromaticContact NE2-CG 3.95Å; H829-F850 AromaticContact NE2-CZ 3.74Å; L847-F850 HydrophobicContact CB-CE2 4.26Å; L847-F850 HydrophobicContact CB-CZ 3.79Å; L847-F850 WeakPolarHBondContact O-CE2 3.22Å; F850-L852 VanDerWaalsContact C-N 3.31Å; F850-L852 PolarHBondContact O-N 3.09Å; F850-C853 WeakPolarHBondContact CA-SG 3.38Å; F850-C853 HydrophobicContact CB-CB 4.2Å; F850-C853 VanDerWaalsContact CB-SG 3.54Å; F850-C853 HydrophobicContact CD1-CB 4.37Å; F850-C853 WeakPolarHBondContact CD1-SG 2.86Å; F850-C853 VanDerWaalsContact O-CB 3.31Å; F850-C853 WeakPolarHBondContact O-CB 3.31Å; F850-C853 PolarHBondContact O-N 2.67Å; F850-C853 VanDerWaalsContact O-N 3.07Å; F850-C853 PolarHBondContact O-SG 3.38Å
851	G	60.1	Low	74.2	Confident	7 Å²	7	40.7 Å²	40.7	7%	0.072	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-60.5	-38.6	-179.5	0	0	0	0	0	112.6	H752 D849 C853	H752-G851 WeakPolarHBondContact CA-O 3.29Å; H752-G851 WeakPolarHBondContact CB-O 3.4Å; H752-G851 PolarHBondContact CD2-O 3.31Å; H752-G851 VanDerWaalsContact CG-O 3.3Å; D849-G851 PolarHBondContact O-N 3.47Å; G851-C853 VanDerWaalsContact C-N 3.34Å
852	L	62.4	Low	72.7	Confident	76 Å²	76	36.8 Å²	36.8	40%	0.398	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-88	9.4	175.5	-72.1	-179.7	0	0	0	114	H829 R830 D831 F850	H829-L852 CarbonylContact O-C 3.55Å; R830-L852 PolarHBondContact NE-O 2.97Å; R830-L852 PolarHBondContact NH2-O 2.78Å; D831-L852 HydrophobicContact CB-CB 3.8Å; D831-L852 HydrophobicContact CB-CD1 3.82Å; D831-L852 HydrophobicContact CB-CG 4.39Å; F850-L852 VanDerWaalsContact C-N 3.31Å; F850-L852 PolarHBondContact O-N 3.09Å
853	C	66.4	Low	71.1	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.014	20%	0.199	C	C	.	.			trans	-76.2	165.7	179.3	-60.2	0	0	0	0	113.2	I759 V828 H829 R830 F850 G851	I759-C853 HydrophobicContact CD1-CB 3.3Å; V828-C853 VanDerWaalsContact O-CA 3.3Å; V828-C853 WeakPolarHBondContact O-CA 3.38Å; V828-C853 WeakPolarHBondContact O-CB 3.3Å; H829-C853 VanDerWaalsContact CA-SG 3.54Å; H829-C853 WeakPolarHBondContact O-CA 3.33Å; H829-C853 PolarHBondContact O-SG 2.63Å; R830-C853 PolarHBondContact NH2-O 3.04Å; R830-C853 VanDerWaalsContact NH2-O 3.17Å; F850-C853 WeakPolarHBondContact CA-SG 3.38Å; F850-C853 HydrophobicContact CB-CB 4.2Å; F850-C853 VanDerWaalsContact CB-SG 3.54Å; F850-C853 HydrophobicContact CD1-CB 4.37Å; F850-C853 WeakPolarHBondContact CD1-SG 2.86Å; F850-C853 VanDerWaalsContact O-CB 3.31Å; F850-C853 WeakPolarHBondContact O-CB 3.31Å; F850-C853 PolarHBondContact O-N 2.67Å; F850-C853 VanDerWaalsContact O-N 3.07Å; F850-C853 PolarHBondContact O-SG 3.38Å; G851-C853 VanDerWaalsContact C-N 3.34Å
854	T	57.2	Low	69.4	Low	11 Å²	11	42 Å²	42	7%	0.067	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-147	136.1	166.6	-171.2	0	0	0	0	111.8	F827 V828 F856 Y982	F827-T854 WeakPolarHBondContact CA-O 3.4Å; V828-T854 PolarHBondContact N-O 2.91Å; V828-T854 PolarHBondContact O-N 3.03Å; T854-F856 HydrophobicContact CG2-CE1 4.33Å; T854-F856 HydrophobicContact CG2-CE2 4.46Å; T854-F856 HydrophobicContact CG2-CZ 4.28Å; T854-F856 PolarHBondContact OG1-N 3.3Å; T854-Y982 HydrophobicContact CG2-CE2 4.34Å
855	G	53.6	Low	67.9	Low	16 Å²	16	41.6 Å²	41.6	17%	0.165	21%	0.205	C	C	.	.			trans	-102.2	19.1	168.4	0	0	0	0	0	112.8	G826 R857	G826-G855 WeakPolarHBondContact O-CA 3.32Å; G855-R857 PolarHBondContact O-N 2.87Å
856	F	56.5	Low	66.2	Low	131 Å²	131	44.2 Å²	44.2	58%	0.575	22%	0.218	S	C	*	.	S	Bend	trans	53.7	4.1	-171.9	-58.4	-82.2	0	0	0	116.1	V828 T854 Y982	V828-F856 HydrophobicContact CG2-CE2 3.79Å; V828-F856 HydrophobicContact CG2-CZ 4.29Å; T854-F856 HydrophobicContact CG2-CE1 4.33Å; T854-F856 HydrophobicContact CG2-CE2 4.46Å; T854-F856 HydrophobicContact CG2-CZ 4.28Å; T854-F856 PolarHBondContact OG1-N 3.3Å; F856-Y982 HydrophobicContact CZ-CE2 4.46Å
857	R	56.1	Low	64.3	Low	73 Å²	73	49 Å²	49	28%	0.275	24%	0.244	S	C	.	.			trans	-61.8	141.8	170.3	-58.4	-173.7	-176	173.7	3.1	110	E762 G855 T859 H860	E762-R857 VanDerWaalsContact CD-NH2 3.3Å; E762-R857 IonicContact OE1-CZ 2.71Å; E762-R857 IonicContact OE1-NH1 2.7Å; E762-R857 PolarHBondContact OE1-NH1 2.83Å; E762-R857 IonicContact OE1-NH2 3.37Å; E762-R857 PolarHBondContact OE1-NH2 3.16Å; E762-R857 VanDerWaalsContact OE1-NH2 3.08Å; E762-R857 IonicContact OE2-CZ 3.83Å; E762-R857 IonicContact OE2-NH1 3.5Å; E762-R857 PolarHBondContact OE2-NH1 3.39Å; E762-R857 IonicContact OE2-NH2 2.62Å; E762-R857 PolarHBondContact OE2-NH2 2.89Å; G855-R857 PolarHBondContact O-N 2.87Å; R857-T859 PolarHBondContact O-N 3.49Å; R857-H860 WeakPolarHBondContact CD-CE1 3.24Å; R857-H860 PolarHBondContact O-N 2.78Å
858	W	52	Low	62.3	Low	111 Å²	111	49.8 Å²	49.8	42%	0.42	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-61.1	-28.3	-178.6	54.6	87.9	0	0	0	113.6	P389 P391 H860 S861 Y864	P389-W858 WeakPolarHBondContact O-CH2 3.24Å; P389-W858 VanDerWaalsContact O-CZ3 3.31Å; P389-W858 WeakPolarHBondContact O-CZ3 3.34Å; P391-W858 HydrophobicContact CB-CD2 4.35Å; P391-W858 HydrophobicContact CB-CE3 3.8Å; P391-W858 HydrophobicContact CB-CH2 4.15Å; P391-W858 HydrophobicContact CB-CZ3 3.71Å; P391-W858 HydrophobicContact CG-CE3 4.19Å; P391-W858 HydrophobicContact CG-CZ3 4.11Å; W858-H860 PolarHBondContact O-N 2.82Å; W858-S861 WeakPolarHBondContact O-CB 3.48Å; W858-S861 PolarHBondContact O-N 3.42Å; W858-Y864 AromaticContact CD1-CD2 3.93Å; W858-Y864 VanDerWaalsContact O-CB 3.28Å; W858-Y864 WeakPolarHBondContact O-CB 3.24Å
859	T	59.1	Low	60.5	Low	25 Å²	25	50.6 Å²	50.6	15%	0.153	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-60.8	-24.8	174.4	49.1	0	0	0	0	113.6	R857 S861 W865	R857-T859 PolarHBondContact O-N 3.49Å; T859-S861 VanDerWaalsContact C-N 3.35Å; T859-W865 PolarHBondContact O-NE1 3.3Å
860	H	60.1	Low	58.5	Low	12 Å²	12	55.9 Å²	55.9	6%	0.056	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-92.3	5.5	177.8	-48.7	148.7	0	0	0	112.4	A755 D758 F827 R857 W858	A755-H860 VanDerWaalsContact CA-CD2 3.49Å; A755-H860 WeakPolarHBondContact CA-CD2 3.29Å; A755-H860 HydrophobicContact CB-CB 4.2Å; D758-H860 WeakPolarHBondContact CB-NE2 3.09Å; D758-H860 IonicContact OD1-NE2 3.08Å; D758-H860 IonicContact OD2-CD2 2.74Å; D758-H860 IonicContact OD2-NE2 2.77Å; D758-H860 PolarHBondContact OD2-NE2 3.42Å; F827-H860 AromaticContact CE1-CE1 3.21Å; F827-H860 WeakPolarHBondContact CE1-CE1 3.48Å; F827-H860 AromaticContact CZ-CE1 3.92Å; R857-H860 WeakPolarHBondContact CD-CE1 3.24Å; R857-H860 PolarHBondContact O-N 2.78Å; W858-H860 PolarHBondContact O-N 2.82Å
861	S	55.7	Low	56.7	Low	49 Å²	49	59.3 Å²	59.3	34%	0.343	30%	0.296	S	S	.	.	S	Bend	trans	-98.1	133.4	173.1	-165.1	0	0	0	0	111	W858 T859 K863 Y864	W858-S861 WeakPolarHBondContact O-CB 3.48Å; W858-S861 PolarHBondContact O-N 3.42Å; T859-S861 VanDerWaalsContact C-N 3.35Å; S861-K863 PolarHBondContact O-N 3.02Å; S861-K863 VanDerWaalsContact O-N 3.16Å; S861-Y864 WeakPolarHBondContact O-CB 3.47Å; S861-Y864 PolarHBondContact O-N 3.48Å; S861-Y864 VanDerWaalsContact O-N 3.09Å
862	S	63.3	Low	55.2	Low	51 Å²	51	63.9 Å²	63.9	36%	0.357	33%	0.325	S	S	.	.	H	α-helix	trans	-50.2	-41.3	173.2	-168.6	0	0	0	0	111.7	Y864 W865 D866	S862-Y864 PolarHBondContact O-N 2.81Å; S862-W865 PolarHBondContact O-N 3.37Å; S862-D866 WeakPolarHBondContact CB-OD2 3.29Å; S862-D866 PolarHBondContact O-N 2.79Å; S862-D866 PolarHBondContact OG-OD2 3.35Å
863	K	61.4	Low	53.6	Low	164 Å²	164	64.3 Å²	64.3	71%	0.713	33%	0.333	S	S	*	.	H	α-helix	trans	-52.9	-27.6	-179.7	-65.4	-178.8	178.5	178.9	0	114.5	S861 D866 L867	S861-K863 PolarHBondContact O-N 3.02Å; S861-K863 VanDerWaalsContact O-N 3.16Å; K863-D866 PolarHBondContact N-OD2 2.92Å; K863-L867 WeakPolarHBondContact O-CD1 3.46Å; K863-L867 WeakPolarHBondContact O-CG 3.3Å
864	Y	59.9	Low	51.7	Low	45 Å²	45	70.3 Å²	70.3	18%	0.176	37%	0.369	C	S	.	.	H	α-helix	trans	-70	-41.1	176.3	175.2	-98.1	0	0	0	111.5	R644 W858 S861 S862	R644-Y864 PolarHBondContact NH1-O 2.72Å; W858-Y864 AromaticContact CD1-CD2 3.93Å; W858-Y864 VanDerWaalsContact O-CB 3.28Å; W858-Y864 WeakPolarHBondContact O-CB 3.24Å; S861-Y864 WeakPolarHBondContact O-CB 3.47Å; S861-Y864 PolarHBondContact O-N 3.48Å; S861-Y864 VanDerWaalsContact O-N 3.09Å; S862-Y864 PolarHBondContact O-N 2.81Å
865	W	64.6	Low	50.4	Low	19 Å²	19	73.8 Å²	73.8	7%	0.072	40%	0.395	C	S	.	.	H	α-helix	trans	-85.8	-35.8	-177.3	-60	103	0	0	0	113.1	L750 Q754 T859 S862 L867 D868 F869 P1122	L750-W865 HydrophobicContact CB-CD2 4.21Å; L750-W865 HydrophobicContact CB-CG 4.12Å; L750-W865 HydrophobicContact CD2-CE3 4.32Å; Q754-W865 HydrophobicContact CB-CZ2 4.25Å; Q754-W865 HydrophobicContact CG-CZ2 4.19Å; T859-W865 PolarHBondContact O-NE1 3.3Å; S862-W865 PolarHBondContact O-N 3.37Å; W865-L867 PolarHBondContact O-N 3.28Å; W865-D868 PolarHBondContact O-N 3.46Å; W865-F869 HydrophobicContact CE3-CE2 4.06Å; W865-F869 WeakPolarHBondContact O-CD2 3.06Å; W865-F869 PolarHBondContact O-N 2.7Å; W865-P1122 HydrophobicContact CH2-CG 4.33Å; W865-P1122 HydrophobicContact CZ3-CG 4.21Å
866	D	62.9	Low	49.1	Very low	58 Å²	58	79.1 Å²	79.1	31%	0.31	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-20.4	175.7	-71.1	-60.7	0	0	0	112.9	R748 S862 K863	R748-D866 IonicContact CZ-OD1 3.28Å; R748-D866 IonicContact NH1-OD1 2.74Å; R748-D866 PolarHBondContact NH1-OD1 3.21Å; S862-D866 WeakPolarHBondContact CB-OD2 3.29Å; S862-D866 PolarHBondContact O-N 2.79Å; S862-D866 PolarHBondContact OG-OD2 3.35Å; K863-D866 PolarHBondContact N-OD2 2.92Å
867	L	55.9	Low	48	Very low	113 Å²	113	77.8 Å²	77.8	59%	0.592	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-29.1	176.2	-71.2	170.4	0	0	0	114.7	K863 W865	K863-L867 WeakPolarHBondContact O-CD1 3.46Å; K863-L867 WeakPolarHBondContact O-CG 3.3Å; W865-L867 PolarHBondContact O-N 3.28Å
868	D	53.9	Low	46.9	Very low	17 Å²	17	84.9 Å²	84.9	9%	0.091	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-30.3	-179.1	-80.3	-26.8	0	0	0	111.7	V641 R644 W865	V641-D868 HydrophobicContact CG2-CB 3.85Å; R644-D868 WeakPolarHBondContact CD-OD1 3.49Å; R644-D868 VanDerWaalsContact CD-OD2 3.26Å; R644-D868 WeakPolarHBondContact CD-OD2 3.36Å; R644-D868 IonicContact CZ-OD1 3.76Å; R644-D868 IonicContact CZ-OD2 3.57Å; R644-D868 IonicContact NE-OD1 3.45Å; R644-D868 PolarHBondContact NE-OD1 2.87Å; R644-D868 IonicContact NE-OD2 3.68Å; R644-D868 IonicContact NH1-OD1 3.97Å; R644-D868 PolarHBondContact NH1-OD1 3.41Å; R644-D868 IonicContact NH1-OD2 2.71Å; R644-D868 PolarHBondContact NH1-OD2 2.84Å; W865-D868 PolarHBondContact O-N 3.46Å
869	F	51.9	Low	46.1	Very low	36 Å²	36	86.6 Å²	86.6	16%	0.158	48%	0.477	C	S	.	.			trans	-104.9	84.2	178.5	-60.3	-83.2	0	0	0	110.6	L750 W865 I871 L1119 P1120	L750-F869 HydrophobicContact CD2-CD2 4.14Å; L750-F869 HydrophobicContact CD2-CE2 3.41Å; L750-F869 VanDerWaalsContact CD2-CE2 3.41Å; L750-F869 HydrophobicContact CD2-CZ 3.81Å; W865-F869 HydrophobicContact CE3-CE2 4.06Å; W865-F869 WeakPolarHBondContact O-CD2 3.06Å; W865-F869 PolarHBondContact O-N 2.7Å; F869-I871 HydrophobicContact CB-CD1 4.14Å; F869-I871 HydrophobicContact CB-CG1 3.7Å; F869-I871 PolarHBondContact O-N 3.23Å; F869-L1119 HydrophobicContact CE1-CD2 4.29Å; F869-P1120 HydrophobicContact CE1-CG 4.2Å; F869-P1120 HydrophobicContact CZ-CG 4.17Å
870	N	39.4	Very low	44.9	Very low	157 Å²	157	96.2 Å²	96.2	84%	0.84	51%	0.511	S	S	*	.			trans	-70.6	66.6	162.4	-130.1	0.7	0	0	0	108.7	P872	N870-P872 VanDerWaalsContact O-CD 3.23Å; N870-P872 WeakPolarHBondContact O-CD 3.45Å
871	I	39	Very low	43.7	Very low	73 Å²	73	102.1 Å²	102.1	37%	0.374	54%	0.542	S	S	.	.			trans	-69.6	115	178.3	-49.9	-177.9	0	0	0	106.9	V745 F869 C873	V745-I871 HydrophobicContact CG1-CD1 3.69Å; F869-I871 HydrophobicContact CB-CD1 4.14Å; F869-I871 HydrophobicContact CB-CG1 3.7Å; F869-I871 PolarHBondContact O-N 3.23Å; I871-C873 PolarHBondContact O-N 2.96Å
872	P	28	Very low	42.8	Very low	103 Å²	103	106.9 Å²	106.9	67%	0.669	56%	0.563	S	S	*	*			trans	-67.1	112.4	167.1	-9	26.6	0	0	0	105.8	N870 T874	N870-P872 VanDerWaalsContact O-CD 3.23Å; N870-P872 WeakPolarHBondContact O-CD 3.45Å; P872-T874 HydrophobicContact CB-CG2 4.47Å; P872-T874 PolarHBondContact O-N 3.13Å
873	C	28.7	Very low	41.6	Very low	84 Å²	84	115.4 Å²	115.4	57%	0.568	59%	0.587	S	S	*	*			trans	-70.5	79.5	175.1	-68.8	0	0	0	0	109.4	I871 S875	I871-C873 PolarHBondContact O-N 2.96Å; C873-S875 PolarHBondContact O-N 3.23Å
874	T	26.8	Very low	40.3	Very low	128 Å²	128	111.6 Å²	111.6	79%	0.785	59%	0.586	S	S	*	*			trans	-72.7	57.9	168.6	53.9	0	0	0	0	110	P872 P876	P872-T874 HydrophobicContact CB-CG2 4.47Å; P872-T874 PolarHBondContact O-N 3.13Å; T874-P876 VanDerWaalsContact O-CD 3.29Å; T874-P876 WeakPolarHBondContact O-CD 3.41Å
875	S	29.8	Very low	39.1	Very low	85 Å²	85	118.9 Å²	118.9	59%	0.594	62%	0.619	S	S	*	*			trans	-92.7	99.7	164.5	-49.9	0	0	0	0	106.3	C873 S877	C873-S875 PolarHBondContact O-N 3.23Å; S875-S877 PolarHBondContact O-N 2.86Å
876	P	26.8	Very low	37.7	Very low	128 Å²	128	124.5 Å²	124.5	83%	0.831	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	52	-171.2	33	-37.6	0	0	0	112.8	T874	T874-P876 VanDerWaalsContact O-CD 3.29Å; T874-P876 WeakPolarHBondContact O-CD 3.41Å
877	S	32	Very low	36.3	Very low	103 Å²	103	126.3 Å²	126.3	72%	0.72	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.5	-0.3	-171.8	-47	0	0	0	0	115.7	S875	S875-S877 PolarHBondContact O-N 2.86Å
878	R	34	Very low	35.2	Very low	221 Å²	221	129.6 Å²	129.6	83%	0.834	69%	0.691	S	S	*	*	S	Bend	trans	-118.9	-22.3	178.6	-88.2	-174.9	171.4	168.9	-0.5	117.3
879	N	34	Very low	34.2	Very low	148 Å²	148	134 Å²	134	79%	0.791	72%	0.72	S	S	*	*	S	Bend	trans	-97.3	0.2	-176.8	-72.9	4.6	0	0	0	115.3
880	R	34.4	Very low	33.4	Very low	227 Å²	227	138.3 Å²	138.3	86%	0.857	75%	0.752	S	S	*	*	S	Bend	trans	-78	-24.2	178.9	-168.7	173.6	-80.5	-159.2	-2.1	113.4
881	I	35.9	Very low	33	Very low	136 Å²	136	139.7 Å²	139.7	70%	0.697	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-75.5	-32.9	-176.7	-63.6	175.5	0	0	0	112.2	R883	I881-R883 PolarHBondContact O-N 2.73Å
882	N	36.5	Very low	32.5	Very low	149 Å²	149	141.2 Å²	141.2	80%	0.797	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-92.1	11.9	-173.3	-68.1	7.6	0	0	0	114.6
883	R	37.5	Very low	32.7	Very low	229 Å²	229	141.6 Å²	141.6	86%	0.864	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-122.6	13.7	177.3	-150.6	178.6	-178.8	172.4	1	113.9	I881	I881-R883 PolarHBondContact O-N 2.73Å
884	A	34.5	Very low	32.7	Very low	84 Å²	84	146.1 Å²	146.1	69%	0.694	78%	0.784	S	S	*	*	S	Bend	trans	-120.7	30.2	-176.9	0	0	0	0	0	112.9
885	K	35.3	Very low	32.9	Very low	199 Å²	199	144.5 Å²	144.5	87%	0.865	78%	0.778	S	S	*	*	S	Bend	trans	-139.3	25	-176.7	-93.7	-163.8	171.2	-169.2	0	115.1
886	T	33.8	Very low	33.1	Very low	137 Å²	137	145.9 Å²	145.9	84%	0.84	78%	0.782	S	S	*	*	S	Bend	trans	-143.5	66.9	173.6	55.3	0	0	0	0	110
887	A	34.6	Very low	33.4	Very low	95 Å²	95	148.2 Å²	148.2	79%	0.785	78%	0.782	S	S	*	*			trans	-158.3	108.7	168.1	0	0	0	0	0	107.6
888	E	31.9	Very low	33.5	Very low	183 Å²	183	149.4 Å²	149.4	86%	0.855	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-72.4	141.5	170.9	-64.7	-66.4	131.1	0	0	109.5
889	P	33.8	Very low	33.5	Very low	109 Å²	109	146.1 Å²	146.1	71%	0.708	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-91.1	136.7	176.8	34.3	-31.7	0	0	0	112.4
890	P	35.3	Very low	33.6	Very low	126 Å²	126	147.2 Å²	147.2	82%	0.818	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-78	165.2	154.5	34.1	-32.3	0	0	0	110.9
891	E	29.5	Very low	33.3	Very low	187 Å²	187	142.3 Å²	142.3	87%	0.874	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-90	169.7	-162.8	-60.4	170.4	104.3	0	0	115.9
892	S	30.2	Very low	33.2	Very low	104 Å²	104	145 Å²	145	73%	0.727	78%	0.781	S	S	*	*			trans	87.3	144.3	148.3	76.4	0	0	0	0	121.1
893	T	31.2	Very low	33	Very low	111 Å²	111	143.5 Å²	143.5	68%	0.681	78%	0.782	S	S	*	*			trans	61.1	117	170.1	50.3	0	0	0	0	116.9
894	E	29.9	Very low	32.7	Very low	180 Å²	180	138.5 Å²	138.5	84%	0.841	78%	0.781	S	S	*	*				66.9	133.2	71.5	-68.5	-178.7	156.1	0	0	112.9
895	S	31	Very low	32.4	Very low	94 Å²	94	143.9 Å²	143.9	66%	0.657	79%	0.789	S	S	*	*			cis	-164.1	178.9	-3	54.8	0	0	0	0	110.3
896	T	33.8	Very low	32.2	Very low	113 Å²	113	142.2 Å²	142.2	69%	0.693	78%	0.784	S	S	*	*			trans	64.2	133.1	170.4	44.7	0	0	0	0	116.2
897	E	31.8	Very low	32	Very low	177 Å²	177	142.1 Å²	142.1	83%	0.827	79%	0.787	S	S	*	*				62.7	134.3	66.1	-58.7	178.6	153.4	0	0	111.7
898	D	33.9	Very low	31.9	Very low	129 Å²	129	143.8 Å²	143.8	69%	0.69	78%	0.783	S	S	*	*			cis	-156.8	178	21.6	-163.2	7.2	0	0	0	113
899	Q	35.5	Very low	31.8	Very low	152 Å²	152	143.8 Å²	143.8	71%	0.71	78%	0.783	S	S	*	*			trans	58.8	109.2	154.9	-76.9	163.1	70	0	0	120.8
900	I	35.1	Very low	31.7	Very low	171 Å²	171	145.9 Å²	145.9	88%	0.877	79%	0.788	S	S	*	*				-173.7	139.3	110.4	-93.3	156.7	0	0	0	108.8
901	T	29.4	Very low	31.5	Very low	123 Å²	123	146.5 Å²	146.5	76%	0.755	79%	0.785	S	S	*	*			trans	-140.7	169	-170.9	62.5	0	0	0	0	114.3
902	K	33.8	Very low	31.6	Very low	193 Å²	193	144.3 Å²	144.3	84%	0.839	78%	0.784	S	S	*	*			trans	74.1	95.4	163.5	-62.6	177.1	178.1	-179.7	0	119.5
903	S	32.3	Very low	31.4	Very low	118 Å²	118	144.6 Å²	144.6	83%	0.825	78%	0.781	S	S	*	*	S	Bend		168.5	129.9	123.6	41.3	0	0	0	0	110.2
904	C	30.2	Very low	31.2	Very low	124 Å²	124	145.1 Å²	145.1	84%	0.838	78%	0.784	S	S	*	*			cis	-127.4	150.2	-11.3	-65.2	0	0	0	0	110.5
905	K	28.4	Very low	31.3	Very low	196 Å²	196	144.6 Å²	144.6	85%	0.852	79%	0.786	S	S	*	*			trans	-126.2	-174.2	157.3	-83.1	-171.6	173.5	-174.8	0	107
906	E	31	Very low	31.2	Very low	164 Å²	164	148.8 Å²	148.8	77%	0.766	80%	0.795	S	S	*	*			trans	78.7	93	177.8	-62.4	157.2	-172.4	0	0	113.6
907	C	29.9	Very low	30.9	Very low	135 Å²	135	153.3 Å²	153.3	91%	0.912	81%	0.805	S	S	*	*			trans	-141.4	99.3	146.7	-73.6	0	0	0	0	102.8
908	D	31.3	Very low	30.9	Very low	131 Å²	131	154.2 Å²	154.2	70%	0.701	81%	0.809	S	S	*	*			trans	-83.9	157.6	-150.6	-51.8	-76.8	0	0	0	114.1
909	E	31.1	Very low	30.8	Very low	183 Å²	183	154.9 Å²	154.9	86%	0.855	81%	0.808	S	S	*	*	S	Bend	trans	-76.9	170.6	153	-60.8	-165.6	154.5	0	0	108.4
910	D	32	Very low	30.6	Very low	153 Å²	153	155.3 Å²	155.3	82%	0.818	82%	0.821	S	S	*	*			trans	75.4	68.4	-174.5	-55.4	-27.7	0	0	0	117.6
911	D	29.7	Very low	30.4	Very low	139 Å²	139	149.8 Å²	149.8	74%	0.743	81%	0.806	S	S	*	*			trans	-159	72.2	134.2	-150.6	-4.2	0	0	0	116
912	V	31.7	Very low	30.5	Very low	141 Å²	141	149 Å²	149	86%	0.855	80%	0.801	S	S	*	*			trans	-147.4	63.5	147.8	-166.1	0	0	0	0	110.2
913	T	27	Very low	30.4	Very low	110 Å²	110	147.3 Å²	147.3	68%	0.675	80%	0.8	S	S	*	*			trans	-117.6	46.1	178.5	51.8	0	0	0	0	113.5
914	T	27	Very low	30.4	Very low	121 Å²	121	150.1 Å²	150.1	74%	0.742	80%	0.8	S	S	*	*	S	Bend	trans	-135.7	26.3	-176.8	-33.2	0	0	0	0	115.1
915	I	31	Very low	30.5	Very low	170 Å²	170	152.2 Å²	152.2	87%	0.872	80%	0.798	S	S	*	*	S	Bend	trans	-133.5	41.5	157.5	-37.7	179.6	0	0	0	111.2
916	E	28.8	Very low	30.9	Very low	181 Å²	181	148.4 Å²	148.4	85%	0.846	79%	0.791	S	S	*	*			trans	-121.3	64.3	169.3	-69.1	-156.4	148.1	0	0	111
917	K	29.1	Very low	31.1	Very low	208 Å²	208	148.9 Å²	148.9	90%	0.904	79%	0.793	S	S	*	*	S	Bend	trans	-159.1	13.9	172	-111.8	144.7	-167.5	168.4	0	117
918	E	30.4	Very low	31.3	Very low	196 Å²	196	149.6 Å²	149.6	92%	0.916	79%	0.787	S	S	*	*	S	Bend	trans	-155.6	63.3	178.2	-129	170.1	-123.5	0	0	114.7
919	E	32.5	Very low	31.3	Very low	143 Å²	143	151.5 Å²	151.5	67%	0.668	79%	0.79	S	S	*	*	S	Bend	trans	-158.9	-9.7	154.9	-125.7	-174.3	-172	0	0	112.9	G921 V922 K947	E919-G921 PolarHBondContact O-N 3.06Å; E919-V922 PolarHBondContact O-N 3.43Å; E919-K947 IonicContact OE1-NZ 2.83Å
920	V	31	Very low	31.2	Very low	162 Å²	162	153.1 Å²	153.1	98%	0.982	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	76.1	168.5	-172.4	0	0	0	0	110.2
921	G	30.4	Very low	31.2	Very low	55 Å²	55	152.7 Å²	152.7	57%	0.567	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-178.3	-17.6	179.7	0	0	0	0	0	114.6	E919	E919-G921 PolarHBondContact O-N 3.06Å
922	V	32.7	Very low	31.4	Very low	105 Å²	105	150.9 Å²	150.9	64%	0.636	78%	0.775	S	S	*	*	S	Bend	trans	-92.2	-12.9	-174.3	-170.9	0	0	0	0	113.3	E919	E919-V922 PolarHBondContact O-N 3.43Å
923	L	32	Very low	31.5	Very low	159 Å²	159	152 Å²	152	83%	0.832	78%	0.776	S	S	*	*	S	Bend	trans	-92.1	-10.6	-172.9	-91.9	165.6	0	0	0	116.4
924	E	32.5	Very low	31.6	Very low	177 Å²	177	150.3 Å²	150.3	83%	0.827	78%	0.781	S	S	*	*	S	Bend	trans	-94.4	-18.6	179.9	-73	-169.2	121.2	0	0	114.7
925	Q	31	Very low	32.2	Very low	167 Å²	167	154.4 Å²	154.4	78%	0.78	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-80.8	-15.2	-178.2	-67.1	-168.3	-4	0	0	114.6	H927	Q925-H927 VanDerWaalsContact C-N 3.26Å; Q925-H927 PolarHBondContact O-N 2.86Å
926	V	37.3	Very low	32.4	Very low	116 Å²	116	154.6 Å²	154.6	70%	0.703	79%	0.786	S	S	*	*	G	3₁₀ helix	trans	-74.5	-15.9	-176.9	-172	0	0	0	0	112.5	N928	V926-N928 VanDerWaalsContact C-N 3.31Å; V926-N928 PolarHBondContact O-N 2.9Å
927	H	35.8	Very low	32.6	Very low	175 Å²	175	154 Å²	154	81%	0.81	78%	0.78	S	S	*	*	G	3₁₀ helix	trans	-80.5	-3.5	-173.5	-146	-67.5	0	0	0	115.1	Q925	Q925-H927 VanDerWaalsContact C-N 3.26Å; Q925-H927 PolarHBondContact O-N 2.86Å
928	N	32.7	Very low	32.9	Very low	150 Å²	150	149.7 Å²	149.7	80%	0.802	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-111.5	-11.7	-178.3	-84.2	-30.4	0	0	0	115.7	V926 R930	V926-N928 VanDerWaalsContact C-N 3.31Å; V926-N928 PolarHBondContact O-N 2.9Å; N928-R930 VanDerWaalsContact C-N 3.27Å; N928-R930 PolarHBondContact O-N 2.85Å
929	F	31.3	Very low	33.2	Very low	170 Å²	170	144 Å²	144	75%	0.746	76%	0.759	S	S	*	*			trans	-84.4	59.6	-172.9	-140.7	-98.9	0	0	0	113.8	T932	F929-T932 VanDerWaalsContact CE1-OG1 3.27Å; F929-T932 WeakPolarHBondContact CE1-OG1 3.34Å
930	R	28.7	Very low	33.4	Very low	218 Å²	218	144 Å²	144	82%	0.823	76%	0.763	S	S	*	*			trans	-108.8	40.8	-174.5	-156.8	-171.2	175.7	173.2	0.2	114.3	N928	N928-R930 VanDerWaalsContact C-N 3.27Å; N928-R930 PolarHBondContact O-N 2.85Å
931	Q	32.5	Very low	33.8	Very low	144 Å²	144	142.7 Å²	142.7	67%	0.673	74%	0.74	S	S	*	*			trans	-171.9	88.7	164.8	-106.7	141.2	104.3	0	0	111.9
932	T	35	Very low	34.1	Very low	100 Å²	100	142.2 Å²	142.2	61%	0.613	74%	0.735	S	S	*	*			trans	-164.9	123.4	148.3	46.2	0	0	0	0	111.7	F929	F929-T932 VanDerWaalsContact CE1-OG1 3.27Å; F929-T932 WeakPolarHBondContact CE1-OG1 3.34Å
933	N	32.4	Very low	34.3	Very low	164 Å²	164	141.7 Å²	141.7	88%	0.877	73%	0.732	S	S	*	*			trans	7.9	123.1	153.8	-56.5	-15.9	0	0	0	119.4
934	G	30.6	Very low	34.6	Very low	76 Å²	76	141 Å²	141	78%	0.784	72%	0.724	S	S	*	*	S	Bend	trans	-77.2	128.9	178.6	0	0	0	0	0	114.7
935	K	39.2	Very low	35.2	Very low	206 Å²	206	136 Å²	136	90%	0.896	70%	0.701	S	S	*	*	S	Bend	trans	-162.7	-10.3	152	-110	162.6	-172.9	178.8	0	115.1
936	Q	34.8	Very low	35.8	Very low	174 Å²	174	133.4 Å²	133.4	81%	0.813	69%	0.692	S	S	*	*			trans	-101.1	5.5	-177.5	-73.5	174.9	-30.7	0	0	115.7	T938	Q936-T938 PolarHBondContact O-N 3.26Å
937	F	32.2	Very low	36.2	Very low	168 Å²	168	133.7 Å²	133.7	74%	0.737	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	1.9	-169.3	-149.2	-97.2	0	0	0	115.7
938	T	36.7	Very low	36.7	Very low	118 Å²	118	126.6 Å²	126.6	72%	0.724	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-42.9	-178.9	45.4	0	0	0	0	113.2	Q936 L940 R941	Q936-T938 PolarHBondContact O-N 3.26Å; T938-L940 PolarHBondContact O-N 3.28Å; T938-R941 PolarHBondContact O-N 2.86Å
939	A	35.9	Very low	37.5	Very low	78 Å²	78	122.1 Å²	122.1	65%	0.645	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-44.5	-172.6	0	0	0	0	0	113.2	R941 G942	A939-R941 PolarHBondContact O-N 3.05Å; A939-R941 VanDerWaalsContact O-N 3.09Å; A939-G942 PolarHBondContact O-N 3.46Å
940	L	36.5	Very low	38.5	Very low	142 Å²	142	118.3 Å²	118.3	74%	0.743	61%	0.613	S	S	*	*	H	α-helix	trans	-63.9	-14.6	-179.4	-79.7	162.5	0	0	0	114.3	T938	T938-L940 PolarHBondContact O-N 3.28Å
941	R	39	Very low	39.7	Very low	134 Å²	134	116.2 Å²	116.2	51%	0.506	61%	0.606	S	S	.	*	H	α-helix	trans	-73.8	-28.3	176.4	-84.6	-173	174.4	-174	2.8	113.8	T938 A939 H945	T938-R941 PolarHBondContact O-N 2.86Å; A939-R941 PolarHBondContact O-N 3.05Å; A939-R941 VanDerWaalsContact O-N 3.09Å; R941-H945 PolarHBondContact O-N 3.18Å
942	G	36.3	Very low	40.7	Very low	46 Å²	46	110.8 Å²	110.8	47%	0.474	58%	0.579	S	S	.	*	H	α-helix	trans	-65	-55	-178.5	0	0	0	0	0	111.9	A939 H944 H945 D946	A939-G942 PolarHBondContact O-N 3.46Å; G942-H944 PolarHBondContact O-N 3.31Å; G942-H944 VanDerWaalsContact O-N 3.11Å; G942-H945 WeakPolarHBondContact O-CB 3.28Å; G942-H945 PolarHBondContact O-N 2.98Å; G942-D946 PolarHBondContact O-N 3.33Å
943	V	37	Very low	41.6	Very low	94 Å²	94	114.7 Å²	114.7	57%	0.57	58%	0.582	S	S	*	*	H	α-helix	trans	-53.5	-37.7	-175.7	-171.6	0	0	0	0	113	K947	V943-K947 PolarHBondContact O-N 2.83Å
944	H	39	Very low	42.4	Very low	143 Å²	143	110.8 Å²	110.8	66%	0.662	56%	0.562	S	S	*	*	H	α-helix	trans	-81.6	-22.2	-178.8	-150.4	-47.5	0	0	0	113.4	G942 T948	G942-H944 PolarHBondContact O-N 3.31Å; G942-H944 VanDerWaalsContact O-N 3.11Å; H944-T948 PolarHBondContact O-OG1 3.23Å
945	H	46.1	Very low	43.3	Very low	73 Å²	73	109.7 Å²	109.7	34%	0.338	54%	0.542	S	S	.	.	H	α-helix	trans	-74.4	-41.7	170.4	-168.5	67.9	0	0	0	110.4	R941 G942 T948 L949	R941-H945 PolarHBondContact O-N 3.18Å; G942-H945 WeakPolarHBondContact O-CB 3.28Å; G942-H945 PolarHBondContact O-N 2.98Å; H945-T948 CarbonylContact O-C 3.51Å; H945-T948 WeakPolarHBondContact O-CA 3.43Å; H945-T948 VanDerWaalsContact O-CB 3.23Å; H945-T948 WeakPolarHBondContact O-CB 3.47Å; H945-T948 PolarHBondContact O-N 2.78Å; H945-L949 PolarHBondContact O-N 3.24Å
946	D	43.1	Very low	43.9	Very low	113 Å²	113	101.3 Å²	101.3	60%	0.604	51%	0.506	S	S	*	.	H	α-helix	trans	-61.9	-51.1	-179.7	-136	11	0	0	0	111.8	G942 T948 L949 E950	G942-D946 PolarHBondContact O-N 3.33Å; D946-T948 PolarHBondContact O-N 3.06Å; D946-L949 PolarHBondContact O-N 2.87Å; D946-E950 PolarHBondContact O-N 2.77Å
947	K	45.2	Very low	44.1	Very low	121 Å²	121	95.3 Å²	95.3	53%	0.526	49%	0.486	S	S	.	.	H	α-helix	trans	-58.6	-14.9	171	-72.4	-166.6	176.9	-170.1	0	113.4	E919 V943 R951	E919-K947 IonicContact OE1-NZ 2.83Å; V943-K947 PolarHBondContact O-N 2.83Å; K947-R951 WeakPolarHBondContact O-CB 3.5Å; K947-R951 WeakPolarHBondContact O-CD 3.26Å; K947-R951 WeakPolarHBondContact O-CG 3.27Å; K947-R951 PolarHBondContact O-N 2.83Å
948	T	47.5	Very low	44.5	Very low	26 Å²	26	92.5 Å²	92.5	16%	0.16	48%	0.478	C	S	.	.	H	α-helix	trans	-90.1	-39.6	174.2	-53.6	0	0	0	0	112.1	H944 H945 D946 R951 R952	H944-T948 PolarHBondContact O-OG1 3.23Å; H945-T948 CarbonylContact O-C 3.51Å; H945-T948 WeakPolarHBondContact O-CA 3.43Å; H945-T948 VanDerWaalsContact O-CB 3.23Å; H945-T948 WeakPolarHBondContact O-CB 3.47Å; H945-T948 PolarHBondContact O-N 2.78Å; D946-T948 PolarHBondContact O-N 3.06Å; T948-R951 PolarHBondContact O-N 3.38Å; T948-R952 WeakPolarHBondContact O-CG 3.45Å; T948-R952 PolarHBondContact O-N 3.46Å
949	L	48.8	Very low	45	Very low	56 Å²	56	90.8 Å²	90.8	29%	0.293	46%	0.459	S	S	.	.	H	α-helix	trans	-65.9	-41.9	173.3	-67.2	174.7	0	0	0	111.2	H945 D946 R951 R952 R953	H945-L949 PolarHBondContact O-N 3.24Å; D946-L949 PolarHBondContact O-N 2.87Å; L949-R951 VanDerWaalsContact C-N 3.32Å; L949-R951 PolarHBondContact O-N 3.08Å; L949-R952 WeakPolarHBondContact O-CA 3.03Å; L949-R952 WeakPolarHBondContact O-CB 3.09Å; L949-R952 PolarHBondContact O-N 3.18Å; L949-R953 PolarHBondContact O-N 2.75Å
950	E	52.3	Low	45.4	Very low	90 Å²	90	91.1 Å²	91.1	42%	0.421	44%	0.443	S	S	.	.	H	α-helix	trans	-65.8	-36.2	176	-166.8	51.7	-143.6	0	0	111.6	D946 R953 N954	D946-E950 PolarHBondContact O-N 2.77Å; E950-R953 PolarHBondContact O-N 2.8Å; E950-N954 WeakPolarHBondContact O-CB 3.46Å; E950-N954 PolarHBondContact O-N 3.16Å; E950-N954 PolarHBondContact O-ND2 2.91Å; E950-N954 PolarHBondContact OE1-ND2 3.46Å
951	R	54.7	Low	45.4	Very low	175 Å²	175	88 Å²	88	66%	0.66	43%	0.433	S	S	*	.	H	α-helix	trans	-65.8	-33	168.6	-81.1	177.1	177.5	-179.1	0.8	113.3	K947 T948 L949 S955	K947-R951 WeakPolarHBondContact O-CB 3.5Å; K947-R951 WeakPolarHBondContact O-CD 3.26Å; K947-R951 WeakPolarHBondContact O-CG 3.27Å; K947-R951 PolarHBondContact O-N 2.83Å; T948-R951 PolarHBondContact O-N 3.38Å; L949-R951 VanDerWaalsContact C-N 3.32Å; L949-R951 PolarHBondContact O-N 3.08Å; R951-S955 WeakPolarHBondContact O-CB 3.48Å; R951-S955 PolarHBondContact O-N 2.86Å
952	R	53.2	Low	45.1	Very low	30 Å²	30	84.2 Å²	84.2	11%	0.113	43%	0.43	C	S	.	.	H	α-helix	trans	-65.8	-46.3	170.8	-71	-178.3	-134.4	169.7	5.6	110.7	G801 T948 L949 N954 S955 F956 G1001	G801-R952 PolarHBondContact O-NH1 2.67Å; G801-R952 PolarHBondContact O-NH2 3.17Å; T948-R952 WeakPolarHBondContact O-CG 3.45Å; T948-R952 PolarHBondContact O-N 3.46Å; L949-R952 WeakPolarHBondContact O-CA 3.03Å; L949-R952 WeakPolarHBondContact O-CB 3.09Å; L949-R952 PolarHBondContact O-N 3.18Å; R952-N954 PolarHBondContact O-N 3.38Å; R952-S955 CarbonylContact O-C 3.58Å; R952-S955 PolarHBondContact O-N 3.44Å; R952-F956 WeakPolarHBondContact O-CB 2.92Å; R952-F956 PolarHBondContact O-N 2.73Å; R952-G1001 PolarHBondContact NE-O 3.09Å; R952-G1001 PolarHBondContact NH1-O 2.83Å; R952-G1001 PolarHBondContact NH2-O 2.89Å
953	R	53.7	Low	45.4	Very low	182 Å²	182	87.2 Å²	87.2	69%	0.687	43%	0.431	S	S	*	.	H	α-helix	trans	-57.5	-47.8	177.7	-167	178.2	-165.1	145.9	5.5	112	L949 E950 F956 A957	L949-R953 PolarHBondContact O-N 2.75Å; E950-R953 PolarHBondContact O-N 2.8Å; R953-F956 CarbonylContact O-C 3.53Å; R953-F956 WeakPolarHBondContact O-CA 3.27Å; R953-F956 VanDerWaalsContact O-CB 3.27Å; R953-F956 WeakPolarHBondContact O-CB 3.16Å; R953-F956 PolarHBondContact O-N 2.92Å; R953-F956 VanDerWaalsContact O-N 3.11Å; R953-A957 PolarHBondContact O-N 3.3Å
954	N	49.6	Very low	45.2	Very low	82 Å²	82	87.4 Å²	87.4	44%	0.439	44%	0.437	S	S	.	.	H	α-helix	trans	-76.7	-29.4	179.7	-64.9	-40.6	0	0	0	112.8	E950 R952 F956 A957 N958	E950-N954 WeakPolarHBondContact O-CB 3.46Å; E950-N954 PolarHBondContact O-N 3.16Å; E950-N954 PolarHBondContact O-ND2 2.91Å; E950-N954 PolarHBondContact OE1-ND2 3.46Å; R952-N954 PolarHBondContact O-N 3.38Å; N954-F956 VanDerWaalsContact C-N 3.25Å; N954-F956 PolarHBondContact O-N 3.3Å; N954-A957 PolarHBondContact O-N 3.05Å; N954-N958 PolarHBondContact O-N 3.25Å
955	S	49.5	Very low	44.9	Very low	53 Å²	53	88.4 Å²	88.4	37%	0.371	45%	0.447	S	S	.	.	H	α-helix	trans	-65.8	-28.5	165	-174	0	0	0	0	112.2	R951 R952 N958 R959	R951-S955 WeakPolarHBondContact O-CB 3.48Å; R951-S955 PolarHBondContact O-N 2.86Å; R952-S955 CarbonylContact O-C 3.58Å; R952-S955 PolarHBondContact O-N 3.44Å; S955-N958 CarbonylContact O-C 3.53Å; S955-N958 PolarHBondContact O-N 3.37Å; S955-R959 WeakPolarHBondContact O-CG 3.36Å; S955-R959 PolarHBondContact O-N 2.85Å
956	F	50.4	Low	44.7	Very low	30 Å²	30	89.3 Å²	89.3	13%	0.132	46%	0.457	C	S	.	.	H	α-helix	trans	-74.9	-40	173.6	-113.5	-106.8	0	0	0	112.4	M794 I798 R952 R953 N954 N958 R959 R960	M794-F956 HydrophobicContact CB-CZ 4.22Å; M794-F956 HydrophobicContact CE-CE2 4.13Å; M794-F956 HydrophobicContact CG-CE2 3.62Å; M794-F956 HydrophobicContact CG-CZ 3.46Å; M794-F956 VanDerWaalsContact CG-CZ 3.46Å; I798-F956 HydrophobicContact CD1-CD1 4.12Å; I798-F956 HydrophobicContact CD1-CD2 3.83Å; I798-F956 HydrophobicContact CD1-CE1 3.91Å; I798-F956 HydrophobicContact CD1-CE2 3.6Å; I798-F956 HydrophobicContact CD1-CG 4.1Å; I798-F956 HydrophobicContact CD1-CZ 3.66Å; R952-F956 WeakPolarHBondContact O-CB 2.92Å; R952-F956 PolarHBondContact O-N 2.73Å; R953-F956 CarbonylContact O-C 3.53Å; R953-F956 WeakPolarHBondContact O-CA 3.27Å; R953-F956 VanDerWaalsContact O-CB 3.27Å; R953-F956 WeakPolarHBondContact O-CB 3.16Å; R953-F956 PolarHBondContact O-N 2.92Å; R953-F956 VanDerWaalsContact O-N 3.11Å; N954-F956 VanDerWaalsContact C-N 3.25Å; N954-F956 PolarHBondContact O-N 3.3Å; F956-N958 PolarHBondContact O-N 2.83Å; F956-R959 HydrophobicContact CD2-CG 4.48Å; F956-R959 WeakPolarHBondContact O-CA 3.3Å; F956-R959 WeakPolarHBondContact O-CB 3.45Å; F956-R959 PolarHBondContact O-N 2.91Å; F956-R960 PolarHBondContact O-N 3.43Å
957	A	40.3	Very low	45.2	Very low	48 Å²	48	86.2 Å²	86.2	40%	0.397	45%	0.451	S	S	.	.	H	α-helix	trans	-55.6	-41	165.4	0	0	0	0	0	110.8	R953 N954 R959 R960	R953-A957 PolarHBondContact O-N 3.3Å; N954-A957 PolarHBondContact O-N 3.05Å; A957-R959 PolarHBondContact O-N 3Å; A957-R960 VanDerWaalsContact O-CB 3.31Å; A957-R960 WeakPolarHBondContact O-CB 3.19Å; A957-R960 PolarHBondContact O-N 3.41Å
958	N	38.9	Very low	46.1	Very low	109 Å²	109	83.4 Å²	83.4	58%	0.583	45%	0.445	S	S	*	.	H	α-helix	trans	-69.1	-26	170.8	-89.7	-7.5	0	0	0	114.4	N954 S955 F956 R960 C961 A962	N954-N958 PolarHBondContact O-N 3.25Å; S955-N958 CarbonylContact O-C 3.53Å; S955-N958 PolarHBondContact O-N 3.37Å; F956-N958 PolarHBondContact O-N 2.83Å; N958-R960 VanDerWaalsContact C-N 3.27Å; N958-R960 PolarHBondContact O-N 2.87Å; N958-C961 CarbonylContact O-C 3.53Å; N958-C961 WeakPolarHBondContact O-CA 3.1Å; N958-C961 PolarHBondContact O-N 3.05Å; N958-A962 VanDerWaalsContact O-CB 3.29Å; N958-A962 WeakPolarHBondContact O-CB 3.45Å; N958-A962 PolarHBondContact O-N 3.29Å
959	R	47.7	Very low	47.7	Very low	82 Å²	82	82.4 Å²	82.4	31%	0.309	44%	0.438	S	S	.	.	H	α-helix	trans	-62.7	-34.4	168.8	-68.4	-171.1	-169.9	-140.7	8.1	111.4	D835 S955 F956 A957 C961 A962	D835-R959 IonicContact OD1-CZ 3.73Å; D835-R959 IonicContact OD1-NH1 3.39Å; D835-R959 PolarHBondContact OD1-NH1 2.83Å; D835-R959 IonicContact OD2-CZ 2.77Å; D835-R959 IonicContact OD2-NH1 3.72Å; D835-R959 PolarHBondContact OD2-NH1 2.95Å; S955-R959 WeakPolarHBondContact O-CG 3.36Å; S955-R959 PolarHBondContact O-N 2.85Å; F956-R959 HydrophobicContact CD2-CG 4.48Å; F956-R959 WeakPolarHBondContact O-CA 3.3Å; F956-R959 WeakPolarHBondContact O-CB 3.45Å; F956-R959 PolarHBondContact O-N 2.91Å; A957-R959 PolarHBondContact O-N 3Å; R959-C961 PolarHBondContact O-N 2.62Å; R959-A962 PolarHBondContact O-N 3.5Å
960	R	43.9	Very low	49.5	Very low	84 Å²	84	80.2 Å²	80.2	32%	0.317	43%	0.427	S	S	.	.	H	α-helix	trans	-61.1	-28.6	171.6	-55.4	-178	179.3	-152.9	-9	112.1	F956 A957 N958 Q963 D1092 P1093 D1095	F956-R960 PolarHBondContact O-N 3.43Å; A957-R960 VanDerWaalsContact O-CB 3.31Å; A957-R960 WeakPolarHBondContact O-CB 3.19Å; A957-R960 PolarHBondContact O-N 3.41Å; N958-R960 VanDerWaalsContact C-N 3.27Å; N958-R960 PolarHBondContact O-N 2.87Å; R960-Q963 PolarHBondContact O-NE2 3.1Å; R960-D1092 IonicContact CZ-OD2 3.44Å; R960-D1092 IonicContact NE-OD2 3.4Å; R960-D1092 IonicContact NH2-OD2 3.16Å; R960-D1092 PolarHBondContact NH2-OD2 3.15Å; R960-P1093 PolarHBondContact NH1-O 3.47Å; R960-P1093 PolarHBondContact NH2-O 3.14Å; R960-D1095 IonicContact CZ-OD2 3.93Å; R960-D1095 IonicContact NH1-OD1 3.75Å; R960-D1095 PolarHBondContact NH1-OD1 3.41Å; R960-D1095 IonicContact NH1-OD2 2.74Å; R960-D1095 PolarHBondContact NH1-OD2 3.04Å
961	C	37.1	Very low	51.5	Low	78 Å²	78	76.6 Å²	76.6	53%	0.527	41%	0.409	S	S	.	.	H	α-helix	trans	-97.5	-19.9	178.7	-65.7	0	0	0	0	114.9	N958 R959 Q963	N958-C961 CarbonylContact O-C 3.53Å; N958-C961 WeakPolarHBondContact O-CA 3.1Å; N958-C961 PolarHBondContact O-N 3.05Å; R959-C961 PolarHBondContact O-N 2.62Å; C961-Q963 PolarHBondContact O-N 3.07Å
962	A	32.3	Very low	53.2	Low	54 Å²	54	70.3 Å²	70.3	45%	0.446	39%	0.389	S	S	.	.			trans	-74.2	28.8	-174.3	0	0	0	0	0	114.5	N958 R959 S964	N958-A962 VanDerWaalsContact O-CB 3.29Å; N958-A962 WeakPolarHBondContact O-CB 3.45Å; N958-A962 PolarHBondContact O-N 3.29Å; R959-A962 PolarHBondContact O-N 3.5Å; A962-S964 PolarHBondContact O-N 2.9Å
963	Q	42.9	Very low	55.1	Low	108 Å²	108	68.9 Å²	68.9	51%	0.505	38%	0.384	S	S	.	.			trans	-73.9	15.6	-176.3	-53.7	-176.6	11.9	0	0	113.4	R960 C961	R960-Q963 PolarHBondContact O-NE2 3.1Å; C961-Q963 PolarHBondContact O-N 3.07Å
964	S	32.2	Very low	57	Low	99 Å²	99	60.2 Å²	60.2	69%	0.692	35%	0.351	S	S	*	.	S	Bend	trans	-124.7	98.1	-173	-168.1	0	0	0	0	111.8	A962 V966	A962-S964 PolarHBondContact O-N 2.9Å; S964-V966 VanDerWaalsContact C-N 3.31Å; S964-V966 PolarHBondContact O-N 2.98Å
965	L	33.4	Very low	59.1	Low	164 Å²	164	56.4 Å²	56.4	86%	0.859	33%	0.33	S	S	*	.	S	Bend	trans	64.9	-39.1	160.5	-132	70.4	0	0	0	120.2
966	V	41.1	Very low	61	Low	92 Å²	92	56.1 Å²	56.1	56%	0.558	32%	0.324	S	S	*	.			trans	-148.9	119	176.1	-143.4	0	0	0	0	112.4	S964	S964-V966 VanDerWaalsContact C-N 3.31Å; S964-V966 PolarHBondContact O-N 2.98Å
967	G	55.6	Low	62.7	Low	47 Å²	47	56.8 Å²	56.8	49%	0.485	33%	0.329	S	S	.	.			trans	-77.4	167.7	165.2	0	0	0	0	0	112.1	P969	G967-P969 WeakPolarHBondContact O-CD 3.48Å
968	T	62.7	Low	65	Low	63 Å²	63	58.2 Å²	58.2	39%	0.387	32%	0.324	S	S	.	.			trans	-59.4	117.6	178.2	-50.1	0	0	0	0	110.4	N970 L1006 T1013	T968-N970 PolarHBondContact O-N 2.78Å; T968-L1006 HydrophobicContact CG2-CD1 4.42Å; T968-T1013 HydrophobicContact CG2-CG2 4.14Å
969	P	82.1	Confident	67.2	Low	4 Å²	4	62 Å²	62	3%	0.026	33%	0.33	C	S	.	.			trans	-83.6	42.9	-163.1	31.8	-34.1	0	0	0	113.7	G967 Y971 I972 T1013 Q1014	G967-P969 WeakPolarHBondContact O-CD 3.48Å; P969-Y971 VanDerWaalsContact C-N 3.28Å; P969-Y971 PolarHBondContact O-N 3.23Å; P969-I972 HydrophobicContact CB-CB 4.3Å; P969-I972 HydrophobicContact CB-CD1 3.57Å; P969-I972 HydrophobicContact CB-CG1 3.92Å; P969-I972 PolarHBondContact O-N 3.45Å; P969-T1013 HydrophobicContact CG-CG2 4.31Å; P969-Q1014 HydrophobicContact CB-CG 4.43Å; P969-Q1014 HydrophobicContact CG-CG 3.45Å; P969-Q1014 VanDerWaalsContact CG-CG 3.45Å
970	N	86.4	Confident	69	Low	10 Å²	10	62.9 Å²	62.9	5%	0.053	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-38.5	-173.3	-68.8	-42.9	0	0	0	113.6	T968 V993 P1003 T1013	T968-N970 PolarHBondContact O-N 2.78Å; N970-V993 WeakPolarHBondContact O-CG1 3.49Å; N970-P1003 HydrophobicContact CB-CB 3.89Å; N970-P1003 HydrophobicContact CB-CG 3.95Å; N970-T1013 WeakPolarHBondContact OD1-CG2 3.22Å
971	Y	93.2	Very high	70.7	Confident	14 Å²	14	66.9 Å²	66.9	6%	0.055	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-5.4	-172.6	-45.3	-81.1	0	0	0	113.8	I832 K833 P834 P969 S990 V993 I994 E997	I832-Y971 VanDerWaalsContact O-CB 3.29Å; I832-Y971 WeakPolarHBondContact O-CB 3.33Å; K833-Y971 HydrophobicContact CB-CD2 3.53Å; K833-Y971 HydrophobicContact CB-CE2 3.88Å; K833-Y971 HydrophobicContact CB-CG 3.92Å; P834-Y971 VanDerWaalsContact CD-CZ 3.46Å; P834-Y971 HydrophobicContact CG-CE1 4.1Å; P969-Y971 VanDerWaalsContact C-N 3.28Å; P969-Y971 PolarHBondContact O-N 3.23Å; Y971-S990 WeakPolarHBondContact O-CB 3.38Å; Y971-S990 PolarHBondContact O-OG 3.17Å; Y971-V993 HydrophobicContact CD1-CB 4.1Å; Y971-V993 HydrophobicContact CD1-CG1 3.38Å; Y971-V993 HydrophobicContact CE1-CG1 3.8Å; Y971-V993 HydrophobicContact CG-CG1 4.26Å; Y971-I994 HydrophobicContact CD1-CG1 3.9Å; Y971-I994 HydrophobicContact CE1-CG1 4.09Å; Y971-E997 WeakPolarHBondContact CE1-OE2 3.45Å; Y971-E997 VanDerWaalsContact CZ-OE2 3.3Å; Y971-E997 PolarHBondContact OH-OE2 3.04Å
972	I	91.2	Very high	73	Confident	43 Å²	43	66.7 Å²	66.7	22%	0.221	35%	0.354	C	S	.	.			trans	-76.1	137.4	-174.2	-55.1	-171	0	0	0	109.8	P969 I976 L977 W989 V1017	P969-I972 HydrophobicContact CB-CB 4.3Å; P969-I972 HydrophobicContact CB-CD1 3.57Å; P969-I972 HydrophobicContact CB-CG1 3.92Å; P969-I972 PolarHBondContact O-N 3.45Å; I972-I976 HydrophobicContact CG2-CB 3.82Å; I972-I976 HydrophobicContact CG2-CD1 4.32Å; I972-I976 HydrophobicContact CG2-CG2 3.84Å; I972-L977 HydrophobicContact CB-CD2 4.4Å; I972-L977 HydrophobicContact CG2-CD2 3.88Å; I972-L977 HydrophobicContact CG2-CG 3.97Å; I972-W989 PolarHBondContact O-NE1 3.38Å; I972-V1017 VanDerWaalsContact O-CG1 3.31Å; I972-V1017 WeakPolarHBondContact O-CG1 3.49Å
973	A	93.8	Very high	75.6	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.008	35%	0.346	C	S	.	.			trans	-74.4	145.7	178.5	0	0	0	0	0	112.6	E975 I976 L977 C986 W989	A973-E975 VanDerWaalsContact C-N 3.29Å; A973-E975 VanDerWaalsContact CB-CD 3.47Å; A973-E975 HydrophobicContact CB-CG 4.49Å; A973-E975 VanDerWaalsContact CB-OE1 3.27Å; A973-E975 WeakPolarHBondContact CB-OE1 3.21Å; A973-E975 WeakPolarHBondContact CB-OE2 3.41Å; A973-E975 PolarHBondContact O-N 3.25Å; A973-I976 HydrophobicContact CB-CD1 4.3Å; A973-I976 HydrophobicContact CB-CG1 4.43Å; A973-I976 WeakPolarHBondContact O-CB 3.31Å; A973-I976 PolarHBondContact O-N 3.42Å; A973-L977 PolarHBondContact O-N 2.88Å; A973-C986 HydrophobicContact CB-CB 3.8Å; A973-W989 VanDerWaalsContact CA-CD1 3.44Å; A973-W989 HydrophobicContact CB-CB 3.84Å; A973-W989 HydrophobicContact CB-CD2 4.48Å; A973-W989 HydrophobicContact CB-CG 3.8Å
974	P	93.7	Very high	78	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-61.9	-33.4	-173.5	23.5	-33.9	0	0	0	113.3	I976 L977 R978 W989 V1017	P974-I976 VanDerWaalsContact C-N 3.3Å; P974-I976 PolarHBondContact O-N 3.12Å; P974-L977 PolarHBondContact O-N 2.74Å; P974-R978 WeakPolarHBondContact O-CB 3.43Å; P974-R978 WeakPolarHBondContact O-CD 3.42Å; P974-R978 WeakPolarHBondContact O-CG 3.12Å; P974-R978 PolarHBondContact O-N 3.18Å; P974-W989 HydrophobicContact CG-CE3 4.27Å; P974-W989 HydrophobicContact CG-CH2 4.07Å; P974-W989 HydrophobicContact CG-CZ2 4.38Å; P974-W989 HydrophobicContact CG-CZ3 4Å; P974-V1017 HydrophobicContact CB-CG1 4.24Å
975	E	92.9	Very high	80.9	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.009	32%	0.315	C	S	.	.	H	α-helix	trans	-62.3	-34.2	175.6	64.3	-83.1	-164.9	0	0	113	A973 R978 R979 Q980 C986 P1047 R1050	A973-E975 VanDerWaalsContact C-N 3.29Å; A973-E975 VanDerWaalsContact CB-CD 3.47Å; A973-E975 HydrophobicContact CB-CG 4.49Å; A973-E975 VanDerWaalsContact CB-OE1 3.27Å; A973-E975 WeakPolarHBondContact CB-OE1 3.21Å; A973-E975 WeakPolarHBondContact CB-OE2 3.41Å; A973-E975 PolarHBondContact O-N 3.25Å; E975-R978 PolarHBondContact O-N 2.88Å; E975-R979 PolarHBondContact O-N 3.41Å; E975-R979 VanDerWaalsContact O-N 3.12Å; E975-Q980 HydrophobicContact CB-CB 4.29Å; E975-Q980 PolarHBondContact O-N 3.05Å; E975-C986 WeakPolarHBondContact OE1-CA 3.36Å; E975-C986 WeakPolarHBondContact OE1-CB 3.43Å; E975-P1047 HydrophobicContact CB-CG 3.98Å; E975-P1047 HydrophobicContact CG-CG 3.92Å; E975-R1050 IonicContact OE1-CZ 3.55Å; E975-R1050 IonicContact OE1-NH1 3.54Å; E975-R1050 PolarHBondContact OE1-NH1 2.89Å; E975-R1050 IonicContact OE1-NH2 3.63Å; E975-R1050 PolarHBondContact OE1-NH2 2.99Å; E975-R1050 IonicContact OE2-CZ 3.89Å; E975-R1050 IonicContact OE2-NH1 2.98Å; E975-R1050 IonicContact OE2-NH2 3.06Å; E975-R1050 PolarHBondContact OE2-NH2 2.94Å
976	I	88.7	Confident	83.8	Confident	47 Å²	47	52.7 Å²	52.7	24%	0.241	27%	0.274	C	S	.	.	H	α-helix	trans	-68.6	-45.7	176.1	-60.5	176.2	0	0	0	109.7	I972 A973 P974 R978 R979 Y982 C986	I972-I976 HydrophobicContact CG2-CB 3.82Å; I972-I976 HydrophobicContact CG2-CD1 4.32Å; I972-I976 HydrophobicContact CG2-CG2 3.84Å; A973-I976 HydrophobicContact CB-CD1 4.3Å; A973-I976 HydrophobicContact CB-CG1 4.43Å; A973-I976 WeakPolarHBondContact O-CB 3.31Å; A973-I976 PolarHBondContact O-N 3.42Å; P974-I976 VanDerWaalsContact C-N 3.3Å; P974-I976 PolarHBondContact O-N 3.12Å; I976-R978 VanDerWaalsContact C-N 3.32Å; I976-R978 PolarHBondContact O-N 3.27Å; I976-R979 PolarHBondContact O-N 2.98Å; I976-Y982 HydrophobicContact CG1-CD1 4.33Å; I976-Y982 HydrophobicContact CG1-CG 4.32Å; I976-C986 HydrophobicContact CD1-CB 3.8Å; I976-C986 HydrophobicContact CG1-CB 4.33Å
977	L	86.9	Confident	86.4	Confident	43 Å²	43	48.3 Å²	48.3	23%	0.225	25%	0.248	C	C	.	.	H	α-helix	trans	-63.8	-37	176.9	-63.8	-177.8	0	0	0	112.2	I972 A973 P974 R979 Q1014 V1017 V1018	I972-L977 HydrophobicContact CB-CD2 4.4Å; I972-L977 HydrophobicContact CG2-CD2 3.88Å; I972-L977 HydrophobicContact CG2-CG 3.97Å; A973-L977 PolarHBondContact O-N 2.88Å; P974-L977 PolarHBondContact O-N 2.74Å; L977-R979 PolarHBondContact O-N 2.79Å; L977-Q1014 HydrophobicContact CD1-CB 4.16Å; L977-Q1014 HydrophobicContact CD1-CG 4.16Å; L977-Q1014 HydrophobicContact CD2-CG 4.19Å; L977-V1017 HydrophobicContact CD1-CB 3.81Å; L977-V1017 HydrophobicContact CD1-CG1 3.57Å; L977-V1018 HydrophobicContact CB-CG2 3.88Å; L977-V1018 HydrophobicContact CD1-CG2 4.1Å
978	R	89	Confident	88.4	Confident	79 Å²	79	46.1 Å²	46.1	30%	0.298	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-5.9	174.5	-66	165.4	-171.1	163.9	2.3	113.6	P974 E975 I976 Q980 V1018 D1046	P974-R978 WeakPolarHBondContact O-CB 3.43Å; P974-R978 WeakPolarHBondContact O-CD 3.42Å; P974-R978 WeakPolarHBondContact O-CG 3.12Å; P974-R978 PolarHBondContact O-N 3.18Å; E975-R978 PolarHBondContact O-N 2.88Å; I976-R978 VanDerWaalsContact C-N 3.32Å; I976-R978 PolarHBondContact O-N 3.27Å; R978-Q980 HydrophobicContact CB-CG 3.86Å; R978-Q980 PolarHBondContact O-N 3.22Å; R978-V1018 HydrophobicContact CG-CG1 4.37Å; R978-V1018 HydrophobicContact CG-CG2 4.43Å; R978-V1018 PolarHBondContact NH2-O 2.87Å; R978-D1046 IonicContact CZ-OD1 3.24Å; R978-D1046 VanDerWaalsContact CZ-OD1 3.24Å; R978-D1046 IonicContact NH1-OD1 2.68Å; R978-D1046 PolarHBondContact NH1-OD1 3.34Å; R978-D1046 IonicContact NH2-OD1 2.88Å; R978-D1046 PolarHBondContact NH2-OD1 3.23Å
979	R	84.9	Confident	90.1	Very high	189 Å²	189	43.1 Å²	43.1	71%	0.713	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	34.4	-175.2	-51.7	-179.6	-175.9	169.3	3.1	113.5	E975 I976 L977	E975-R979 PolarHBondContact O-N 3.41Å; E975-R979 VanDerWaalsContact O-N 3.12Å; I976-R979 PolarHBondContact O-N 2.98Å; L977-R979 PolarHBondContact O-N 2.79Å
980	Q	84	Confident	90.8	Very high	99 Å²	99	43 Å²	43	46%	0.463	21%	0.206	S	C	.	.			trans	-82.9	165.6	174.6	-68.2	171.9	-40.6	0	0	110.2	E975 R978 Y982	E975-Q980 HydrophobicContact CB-CB 4.29Å; E975-Q980 PolarHBondContact O-N 3.05Å; R978-Q980 HydrophobicContact CB-CG 3.86Å; R978-Q980 PolarHBondContact O-N 3.22Å; Q980-Y982 WeakPolarHBondContact O-CD1 3.19Å; Q980-Y982 PolarHBondContact O-N 3Å
981	D	80.1	Confident	91.3	Very high	169 Å²	169	42.6 Å²	42.6	90%	0.904	20%	0.204	S	C	*	.			trans	-61.4	134.2	167.3	-69.8	-50.6	0	0	0	109.7
982	Y	84.8	Confident	91.6	Very high	74 Å²	74	42 Å²	42	29%	0.29	20%	0.201	S	C	.	.			trans	-131.3	161.5	-177.2	59.2	-97.5	0	0	0	110.3	R830 T854 F856 I976 Q980	R830-Y982 VanDerWaalsContact CD-CE2 3.43Å; R830-Y982 HydrophobicContact CG-CE2 4.33Å; R830-Y982 PolarHBondContact NH1-OH 2.98Å; T854-Y982 HydrophobicContact CG2-CE2 4.34Å; F856-Y982 HydrophobicContact CZ-CE2 4.46Å; I976-Y982 HydrophobicContact CG1-CD1 4.33Å; I976-Y982 HydrophobicContact CG1-CG 4.32Å; Q980-Y982 WeakPolarHBondContact O-CD1 3.19Å; Q980-Y982 PolarHBondContact O-N 3Å
983	G	87.9	Confident	91.8	Very high	26 Å²	26	39.9 Å²	39.9	27%	0.268	19%	0.191	S	C	.	.			trans	-147	-159.6	173.8	0	0	0	0	0	110.8	A985 C986	G983-A985 PolarHBondContact O-N 3.25Å; G983-C986 PolarHBondContact O-N 2.69Å; G983-C986 PolarHBondContact O-SG 3.15Å
984	Q	92.7	Very high	92	Very high	85 Å²	85	39.9 Å²	39.9	40%	0.397	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-24.8	-178.9	-70	172.9	-9.7	0	0	114.4	H823 V828 C986 D987 W988	H823-Q984 HydrophobicContact CB-CG 4.19Å; H823-Q984 PolarHBondContact CE1-O 2.66Å; H823-Q984 PolarHBondContact O-NE2 3.47Å; H823-Q984 VanDerWaalsContact O-NE2 3.16Å; V828-Q984 HydrophobicContact CG2-CG 3.84Å; Q984-C986 PolarHBondContact O-N 2.82Å; Q984-D987 PolarHBondContact O-N 3.1Å; Q984-W988 VanDerWaalsContact O-CD1 3.29Å
985	A	93.7	Very high	92.2	Very high	19 Å²	19	39.9 Å²	39.9	16%	0.157	19%	0.19	C	C	.	.	H	α-helix	trans	-52.2	-31.1	172.4	0	0	0	0	0	114.7	G983 D987 W988 W989 R1050	G983-A985 PolarHBondContact O-N 3.25Å; A985-D987 VanDerWaalsContact C-N 3.33Å; A985-D987 PolarHBondContact O-N 3.49Å; A985-W988 PolarHBondContact O-N 3.42Å; A985-W989 PolarHBondContact O-N 3.44Å; A985-R1050 VanDerWaalsContact C-NH1 3.27Å; A985-R1050 WeakPolarHBondContact O-CD 3.17Å; A985-R1050 PolarHBondContact O-NH1 3.28Å
986	C	94.1	Very high	92.3	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.007	19%	0.193	C	C	.	.	H	α-helix	trans	-67.3	-32.4	-177.3	66.7	0	0	0	0	113	V828 A973 E975 I976 G983 Q984 W988 W989 S990	V828-C986 WeakPolarHBondContact CG1-SG 3.44Å; A973-C986 HydrophobicContact CB-CB 3.8Å; E975-C986 WeakPolarHBondContact OE1-CA 3.36Å; E975-C986 WeakPolarHBondContact OE1-CB 3.43Å; I976-C986 HydrophobicContact CD1-CB 3.8Å; I976-C986 HydrophobicContact CG1-CB 4.33Å; G983-C986 PolarHBondContact O-N 2.69Å; G983-C986 PolarHBondContact O-SG 3.15Å; Q984-C986 PolarHBondContact O-N 2.82Å; C986-W988 VanDerWaalsContact C-N 3.33Å; C986-W988 PolarHBondContact O-N 3.07Å; C986-W989 WeakPolarHBondContact O-CB 3.25Å; C986-W989 PolarHBondContact O-N 3.25Å; C986-S990 PolarHBondContact O-N 3.18Å; C986-S990 PolarHBondContact O-OG 2.94Å
987	D	96	Very high	92.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-70.6	-34.6	-179.2	-59.8	-18.4	0	0	0	110.5	L819 H823 H829 R830 I832 Q984 A985 W989 S990 V991	L819-D987 HydrophobicContact CD1-CB 4.02Å; L819-D987 HydrophobicContact CD2-CB 3.79Å; H823-D987 IonicContact CD2-OD2 2.92Å; H823-D987 IonicContact CE1-OD2 3.81Å; H823-D987 IonicContact NE2-OD2 2.73Å; H823-D987 PolarHBondContact NE2-OD2 3.31Å; H829-D987 PolarHBondContact N-OD1 2.93Å; H829-D987 PolarHBondContact N-OD2 3.2Å; R830-D987 WeakPolarHBondContact CA-OD1 3.47Å; R830-D987 PolarHBondContact N-OD1 2.93Å; I832-D987 HydrophobicContact CG1-CB 4.27Å; Q984-D987 PolarHBondContact O-N 3.1Å; A985-D987 VanDerWaalsContact C-N 3.33Å; A985-D987 PolarHBondContact O-N 3.49Å; D987-W989 VanDerWaalsContact C-N 3.32Å; D987-W989 PolarHBondContact O-N 3.43Å; D987-S990 WeakPolarHBondContact O-CB 3.49Å; D987-S990 PolarHBondContact O-N 3.19Å; D987-S990 VanDerWaalsContact O-N 3.13Å; D987-V991 WeakPolarHBondContact O-CG2 3.43Å; D987-V991 PolarHBondContact O-N 3.22Å
988	W	97.6	Very high	93	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-68.1	-27.6	176.4	-59.8	115	0	0	0	113.6	T816 L819 H823 Q984 A985 C986 V991 G992 L1043 S1052 P1054 I1057	T816-W988 HydrophobicContact CG2-CH2 3.98Å; T816-W988 HydrophobicContact CG2-CZ3 4.06Å; L819-W988 HydrophobicContact CB-CH2 3.71Å; L819-W988 HydrophobicContact CB-CZ2 3.96Å; L819-W988 HydrophobicContact CB-CZ3 4.3Å; L819-W988 HydrophobicContact CD1-CE3 4.22Å; L819-W988 HydrophobicContact CD1-CH2 4.27Å; L819-W988 HydrophobicContact CD1-CZ3 4.05Å; H823-W988 AromaticContact CE1-CE2 3.87Å; H823-W988 AromaticContact CE1-NE1 3.53Å; H823-W988 AromaticContact ND1-CZ2 3.93Å; H823-W988 AromaticContact ND1-NE1 3.74Å; Q984-W988 VanDerWaalsContact O-CD1 3.29Å; A985-W988 PolarHBondContact O-N 3.42Å; C986-W988 VanDerWaalsContact C-N 3.33Å; C986-W988 PolarHBondContact O-N 3.07Å; W988-V991 HydrophobicContact CE3-CB 4.42Å; W988-V991 HydrophobicContact CE3-CG2 3.95Å; W988-V991 HydrophobicContact CZ3-CG2 4.29Å; W988-V991 PolarHBondContact O-N 3.26Å; W988-G992 PolarHBondContact O-N 2.94Å; W988-G992 VanDerWaalsContact O-N 3.13Å; W988-L1043 HydrophobicContact CB-CD2 4.21Å; W988-S1052 PolarHBondContact NE1-O 3.32Å; W988-P1054 HydrophobicContact CZ2-CG 3.9Å; W988-I1057 HydrophobicContact CD2-CD1 3.5Å; W988-I1057 VanDerWaalsContact CD2-CD1 3.5Å; W988-I1057 HydrophobicContact CE3-CD1 3.35Å; W988-I1057 HydrophobicContact CG-CD1 4.11Å; W988-I1057 HydrophobicContact CH2-CD1 4.14Å; W988-I1057 HydrophobicContact CZ2-CD1 4.28Å; W988-I1057 HydrophobicContact CZ3-CD1 3.68Å
989	W	97.5	Very high	93.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.3	-47.8	167.8	171.8	-85.7	0	0	0	111	I972 A973 P974 A985 C986 D987 V991 G992 V993 F1005 V1017 W1020 L1044	I972-W989 PolarHBondContact O-NE1 3.38Å; A973-W989 VanDerWaalsContact CA-CD1 3.44Å; A973-W989 HydrophobicContact CB-CB 3.84Å; A973-W989 HydrophobicContact CB-CD2 4.48Å; A973-W989 HydrophobicContact CB-CG 3.8Å; P974-W989 HydrophobicContact CG-CE3 4.27Å; P974-W989 HydrophobicContact CG-CH2 4.07Å; P974-W989 HydrophobicContact CG-CZ2 4.38Å; P974-W989 HydrophobicContact CG-CZ3 4Å; A985-W989 PolarHBondContact O-N 3.44Å; C986-W989 WeakPolarHBondContact O-CB 3.25Å; C986-W989 PolarHBondContact O-N 3.25Å; D987-W989 VanDerWaalsContact C-N 3.32Å; D987-W989 PolarHBondContact O-N 3.43Å; W989-V991 VanDerWaalsContact C-N 3.31Å; W989-V991 PolarHBondContact O-N 3.3Å; W989-G992 WeakPolarHBondContact O-CA 3.47Å; W989-G992 PolarHBondContact O-N 3.01Å; W989-V993 PolarHBondContact O-N 3.42Å; W989-F1005 AromaticContact CH2-CE2 3.96Å; W989-F1005 HydrophobicContact CH2-CE2 3.96Å; W989-F1005 HydrophobicContact CH2-CZ 4Å; W989-F1005 HydrophobicContact CZ2-CD2 4.22Å; W989-F1005 AromaticContact CZ2-CE2 3.41Å; W989-F1005 HydrophobicContact CZ2-CE2 3.41Å; W989-F1005 VanDerWaalsContact CZ2-CE2 3.41Å; W989-F1005 AromaticContact CZ2-CZ 3.93Å; W989-F1005 HydrophobicContact CZ2-CZ 3.93Å; W989-V1017 HydrophobicContact CZ2-CG1 4.05Å; W989-W1020 HydrophobicContact CH2-CB 3.59Å; W989-W1020 HydrophobicContact CH2-CD2 4.3Å; W989-W1020 AromaticContact CH2-CG 3.67Å; W989-W1020 HydrophobicContact CH2-CG 3.67Å; W989-W1020 HydrophobicContact CZ2-CB 4.38Å; W989-W1020 HydrophobicContact CZ3-CD2 4.41Å; W989-W1020 HydrophobicContact CZ3-CG 4.16Å; W989-L1044 HydrophobicContact CD2-CD2 3.7Å; W989-L1044 HydrophobicContact CE3-CB 4.41Å; W989-L1044 HydrophobicContact CE3-CD2 3.85Å; W989-L1044 HydrophobicContact CG-CD2 4.19Å; W989-L1044 HydrophobicContact CH2-CB 4.43Å; W989-L1044 HydrophobicContact CH2-CD2 4.29Å; W989-L1044 HydrophobicContact CZ2-CD2 4.17Å; W989-L1044 HydrophobicContact CZ3-CB 4.1Å; W989-L1044 HydrophobicContact CZ3-CD2 4.16Å; W989-L1044 WeakPolarHBondContact O-CD2 3.36Å
990	S	97.1	Very high	93.7	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-61.5	-38.1	178.5	-50.5	0	0	0	0	111.9	I832 Y971 C986 D987 G992 V993 I994	I832-S990 WeakPolarHBondContact O-CB 3.36Å; Y971-S990 WeakPolarHBondContact O-CB 3.38Å; Y971-S990 PolarHBondContact O-OG 3.17Å; C986-S990 PolarHBondContact O-N 3.18Å; C986-S990 PolarHBondContact O-OG 2.94Å; D987-S990 WeakPolarHBondContact O-CB 3.49Å; D987-S990 PolarHBondContact O-N 3.19Å; D987-S990 VanDerWaalsContact O-N 3.13Å; S990-G992 VanDerWaalsContact C-N 3.31Å; S990-G992 PolarHBondContact O-N 2.88Å; S990-V993 PolarHBondContact O-N 3.46Å; S990-I994 VanDerWaalsContact O-CG1 3.31Å; S990-I994 WeakPolarHBondContact O-CG1 3.5Å; S990-I994 PolarHBondContact O-N 3Å
991	V	98.1	Very high	93.9	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.006	12%	0.116	C	C	.	.	H	α-helix	trans	-57.2	-43.7	170	178.7	0	0	0	0	111.4	I812 L815 L819 D987 W988 W989 V993 I994 L995 L1043	I812-V991 HydrophobicContact CD1-CG1 4.19Å; I812-V991 HydrophobicContact CG2-CG1 3.85Å; L815-V991 HydrophobicContact CD2-CG1 4.45Å; L815-V991 HydrophobicContact CD2-CG2 3.89Å; L815-V991 HydrophobicContact CG-CG2 4.1Å; L819-V991 HydrophobicContact CD1-CG2 3.4Å; L819-V991 VanDerWaalsContact CD1-CG2 3.4Å; D987-V991 WeakPolarHBondContact O-CG2 3.43Å; D987-V991 PolarHBondContact O-N 3.22Å; W988-V991 HydrophobicContact CE3-CB 4.42Å; W988-V991 HydrophobicContact CE3-CG2 3.95Å; W988-V991 HydrophobicContact CZ3-CG2 4.29Å; W988-V991 PolarHBondContact O-N 3.26Å; W989-V991 VanDerWaalsContact C-N 3.31Å; W989-V991 PolarHBondContact O-N 3.3Å; V991-V993 VanDerWaalsContact C-N 3.35Å; V991-V993 PolarHBondContact O-N 3.37Å; V991-I994 PolarHBondContact O-N 3.49Å; V991-L995 WeakPolarHBondContact O-CB 3.22Å; V991-L995 PolarHBondContact O-N 3.05Å; V991-L1043 HydrophobicContact CG1-CD1 4.13Å
992	G	97.9	Very high	94.3	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-62.6	-37.3	175.7	0	0	0	0	0	113.7	W988 W989 S990 Y996	W988-G992 PolarHBondContact O-N 2.94Å; W988-G992 VanDerWaalsContact O-N 3.13Å; W989-G992 WeakPolarHBondContact O-CA 3.47Å; W989-G992 PolarHBondContact O-N 3.01Å; S990-G992 VanDerWaalsContact C-N 3.31Å; S990-G992 PolarHBondContact O-N 2.88Å; G992-Y996 PolarHBondContact O-N 3.24Å
993	V	97.2	Very high	94.7	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.6	-45.9	173.6	174.5	0	0	0	0	111	N970 Y971 W989 S990 V991 Y996 E997 P1003 L1044	N970-V993 WeakPolarHBondContact O-CG1 3.49Å; Y971-V993 HydrophobicContact CD1-CB 4.1Å; Y971-V993 HydrophobicContact CD1-CG1 3.38Å; Y971-V993 HydrophobicContact CE1-CG1 3.8Å; Y971-V993 HydrophobicContact CG-CG1 4.26Å; W989-V993 PolarHBondContact O-N 3.42Å; S990-V993 PolarHBondContact O-N 3.46Å; V991-V993 VanDerWaalsContact C-N 3.35Å; V991-V993 PolarHBondContact O-N 3.37Å; V993-Y996 PolarHBondContact O-N 3.42Å; V993-E997 PolarHBondContact O-N 2.8Å; V993-P1003 HydrophobicContact CG1-CB 4.21Å; V993-L1044 HydrophobicContact CG2-CD2 3.82Å
994	I	96.7	Very high	95	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-65.8	-42.8	-178.9	-67.2	171.8	0	0	0	111	I812 L815 I832 P834 I837 Y971 S990 V991 Y996 E997 M998	I812-I994 HydrophobicContact CD1-CB 4.5Å; I812-I994 HydrophobicContact CD1-CG2 4.05Å; L815-I994 HydrophobicContact CD2-CD1 4.34Å; I832-I994 HydrophobicContact CG2-CD1 3.66Å; P834-I994 HydrophobicContact CG-CD1 4.43Å; P834-I994 HydrophobicContact CG-CG1 4.13Å; I837-I994 HydrophobicContact CD1-CD1 4.02Å; Y971-I994 HydrophobicContact CD1-CG1 3.9Å; Y971-I994 HydrophobicContact CE1-CG1 4.09Å; S990-I994 VanDerWaalsContact O-CG1 3.31Å; S990-I994 WeakPolarHBondContact O-CG1 3.5Å; S990-I994 PolarHBondContact O-N 3Å; V991-I994 PolarHBondContact O-N 3.49Å; I994-Y996 VanDerWaalsContact C-N 3.32Å; I994-Y996 PolarHBondContact O-N 3.27Å; I994-E997 PolarHBondContact O-N 3.17Å; I994-M998 HydrophobicContact CG2-CE 3.68Å; I994-M998 HydrophobicContact CG2-CG 4.4Å; I994-M998 HydrophobicContact CG2-SD 4.21Å; I994-M998 WeakPolarHBondContact O-CB 3.44Å; I994-M998 WeakPolarHBondContact O-CG 3.46Å; I994-M998 PolarHBondContact O-N 2.9Å
995	L	97.9	Very high	95.1	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-61.5	-39	175	174.1	60.3	0	0	0	111.9	I812 V991 L999 L1039 I1040 F1062	I812-L995 HydrophobicContact CD1-CB 4.07Å; I812-L995 HydrophobicContact CG1-CB 4.14Å; I812-L995 HydrophobicContact CG1-CD1 4.09Å; V991-L995 WeakPolarHBondContact O-CB 3.22Å; V991-L995 PolarHBondContact O-N 3.05Å; L995-L999 HydrophobicContact CD1-CD1 3.66Å; L995-L999 HydrophobicContact CD1-CG 4.17Å; L995-L999 HydrophobicContact CG-CD1 4.4Å; L995-L999 PolarHBondContact O-N 3.22Å; L995-L1039 HydrophobicContact CD2-CB 4.25Å; L995-L1039 HydrophobicContact CD2-CD2 3.61Å; L995-L1039 HydrophobicContact CD2-CG 3.86Å; L995-I1040 HydrophobicContact CB-CG1 4.42Å; L995-I1040 HydrophobicContact CD2-CD1 4.43Å; L995-I1040 HydrophobicContact CD2-CG1 3.75Å; L995-I1040 HydrophobicContact CG-CD1 4.1Å; L995-I1040 HydrophobicContact CG-CG1 3.85Å; L995-F1062 HydrophobicContact CD1-CE1 4.19Å; L995-F1062 HydrophobicContact CD1-CE2 4.36Å; L995-F1062 HydrophobicContact CD1-CZ 3.71Å
996	Y	96.4	Very high	94.8	Very high	17 Å²	17	11.4 Å²	11.4	7%	0.067	6%	0.059	C	C	.	.	H	α-helix	trans	-65.3	-44.4	172.6	-177.7	-80.5	0	0	0	111.6	G992 V993 I994 M998 L999 V1000 Q1002 P1004 K1025 L1026 I1040	G992-Y996 PolarHBondContact O-N 3.24Å; V993-Y996 PolarHBondContact O-N 3.42Å; I994-Y996 VanDerWaalsContact C-N 3.32Å; I994-Y996 PolarHBondContact O-N 3.27Å; Y996-M998 PolarHBondContact O-N 3.33Å; Y996-L999 PolarHBondContact O-N 3.48Å; Y996-V1000 HydrophobicContact CD1-CB 4.11Å; Y996-V1000 HydrophobicContact CD1-CG2 4.21Å; Y996-V1000 HydrophobicContact CD2-CG2 3.96Å; Y996-V1000 HydrophobicContact CE1-CB 3.78Å; Y996-V1000 HydrophobicContact CE1-CG1 3.94Å; Y996-V1000 HydrophobicContact CE1-CG2 4.05Å; Y996-V1000 HydrophobicContact CE2-CB 4.42Å; Y996-V1000 HydrophobicContact CE2-CG2 3.79Å; Y996-V1000 HydrophobicContact CG-CG2 4.18Å; Y996-V1000 VanDerWaalsContact O-CB 3.28Å; Y996-V1000 WeakPolarHBondContact O-CB 3.45Å; Y996-V1000 WeakPolarHBondContact O-CG2 3.17Å; Y996-V1000 PolarHBondContact O-N 3.21Å; Y996-Q1002 WeakPolarHBondContact CD1-O 3.48Å; Y996-Q1002 WeakPolarHBondContact CE1-O 3.49Å; Y996-P1004 HydrophobicContact CD1-CB 3.65Å; Y996-P1004 VanDerWaalsContact CD1-CD 3.44Å; Y996-P1004 HydrophobicContact CD1-CG 3.86Å; Y996-P1004 HydrophobicContact CD2-CB 4.11Å; Y996-P1004 HydrophobicContact CE1-CB 3.6Å; Y996-P1004 HydrophobicContact CE1-CG 4.3Å; Y996-P1004 HydrophobicContact CE2-CB 4.05Å; Y996-P1004 HydrophobicContact CG-CB 3.92Å; Y996-P1004 HydrophobicContact CG-CG 3.99Å; Y996-K1025 PolarHBondContact OH-O 2.78Å; Y996-L1026 HydrophobicContact CD2-CD2 3.57Å; Y996-L1026 HydrophobicContact CE2-CD2 3.52Å; Y996-I1040 HydrophobicContact CD2-CD1 4.31Å; Y996-I1040 HydrophobicContact CD2-CG2 4.28Å
997	E	94.5	Very high	94.5	Very high	8 Å²	8	12.1 Å²	12.1	4%	0.037	7%	0.066	C	C	.	.	H	α-helix	trans	-64.5	-38.9	177.7	-177.8	166.2	-144.4	0	0	112.3	L797 Y971 V993 I994 L999 G1001 P1003	L797-E997 HydrophobicContact CD1-CG 4.39Å; Y971-E997 WeakPolarHBondContact CE1-OE2 3.45Å; Y971-E997 VanDerWaalsContact CZ-OE2 3.3Å; Y971-E997 PolarHBondContact OH-OE2 3.04Å; V993-E997 PolarHBondContact O-N 2.8Å; I994-E997 PolarHBondContact O-N 3.17Å; E997-L999 PolarHBondContact O-N 3.14Å; E997-G1001 CarbonylContact O-C 3.56Å; E997-G1001 WeakPolarHBondContact O-CA 3.45Å; E997-G1001 PolarHBondContact O-N 2.78Å; E997-P1003 HydrophobicContact CG-CG 4.46Å; E997-P1003 VanDerWaalsContact OE1-CD 3.3Å; E997-P1003 WeakPolarHBondContact OE1-CD 3.49Å
998	M	95.4	Very high	93.7	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-58	-47.8	173.3	-76.5	175.5	176.2	0	0	112	M793 L797 F803 A808 I812 I994 Y996	M793-M998 HydrophobicContact CG-CE 4.14Å; M793-M998 HydrophobicContact SD-CE 4.05Å; L797-M998 HydrophobicContact CD2-CB 4.42Å; L797-M998 HydrophobicContact CD2-CG 3.88Å; F803-M998 HydrophobicContact CB-CB 4.21Å; F803-M998 HydrophobicContact CD2-CB 4.12Å; F803-M998 HydrophobicContact CD2-CE 4.27Å; F803-M998 HydrophobicContact CD2-CG 3.67Å; F803-M998 HydrophobicContact CD2-SD 3.99Å; F803-M998 HydrophobicContact CE2-CE 3.92Å; F803-M998 HydrophobicContact CE2-CG 4.03Å; F803-M998 HydrophobicContact CE2-SD 4.26Å; F803-M998 HydrophobicContact CG-CB 4.35Å; F803-M998 HydrophobicContact CG-CG 4.29Å; F803-M998 PolarHBondContact N-O 3.26Å; A808-M998 HydrophobicContact CB-CB 3.99Å; A808-M998 HydrophobicContact CB-SD 4Å; I812-M998 HydrophobicContact CD1-CE 4.27Å; I812-M998 HydrophobicContact CD1-SD 3.94Å; I812-M998 HydrophobicContact CG1-SD 3.84Å; I994-M998 HydrophobicContact CG2-CE 3.68Å; I994-M998 HydrophobicContact CG2-CG 4.4Å; I994-M998 HydrophobicContact CG2-SD 4.21Å; I994-M998 WeakPolarHBondContact O-CB 3.44Å; I994-M998 WeakPolarHBondContact O-CG 3.46Å; I994-M998 PolarHBondContact O-N 2.9Å; Y996-M998 PolarHBondContact O-N 3.33Å
999	L	95.4	Very high	93	Very high	14 Å²	14	23.9 Å²	23.9	7%	0.073	13%	0.125	C	C	.	.	H	α-helix	trans	-90.6	-22.6	-171.3	-65.3	179.4	0	0	0	114.7	E805 A808 L995 Y996 E997 L1032 A1036	E805-L999 HydrophobicContact CB-CD2 4.32Å; E805-L999 HydrophobicContact CG-CD2 4.5Å; A808-L999 HydrophobicContact CB-CD2 3.76Å; A808-L999 HydrophobicContact CB-CG 4.22Å; L995-L999 HydrophobicContact CD1-CD1 3.66Å; L995-L999 HydrophobicContact CD1-CG 4.17Å; L995-L999 HydrophobicContact CG-CD1 4.4Å; L995-L999 PolarHBondContact O-N 3.22Å; Y996-L999 PolarHBondContact O-N 3.48Å; E997-L999 PolarHBondContact O-N 3.14Å; L999-L1032 HydrophobicContact CB-CD1 3.99Å; L999-L1032 HydrophobicContact CD1-CD1 3.58Å; L999-L1032 HydrophobicContact CG-CD1 4.45Å; L999-A1036 HydrophobicContact CD1-CB 3.73Å
1000	V	92.5	Very high	92.2	Very high	33 Å²	33	25.6 Å²	25.6	20%	0.2	14%	0.139	C	C	.	.	H	α-helix	trans	-110.3	-13.7	-179.5	-169.9	0	0	0	0	112	Y996 P1027	Y996-V1000 HydrophobicContact CD1-CB 4.11Å; Y996-V1000 HydrophobicContact CD1-CG2 4.21Å; Y996-V1000 HydrophobicContact CD2-CG2 3.96Å; Y996-V1000 HydrophobicContact CE1-CB 3.78Å; Y996-V1000 HydrophobicContact CE1-CG1 3.94Å; Y996-V1000 HydrophobicContact CE1-CG2 4.05Å; Y996-V1000 HydrophobicContact CE2-CB 4.42Å; Y996-V1000 HydrophobicContact CE2-CG2 3.79Å; Y996-V1000 HydrophobicContact CG-CG2 4.18Å; Y996-V1000 VanDerWaalsContact O-CB 3.28Å; Y996-V1000 WeakPolarHBondContact O-CB 3.45Å; Y996-V1000 WeakPolarHBondContact O-CG2 3.17Å; Y996-V1000 PolarHBondContact O-N 3.21Å; V1000-P1027 HydrophobicContact CG1-CG 4.27Å; V1000-P1027 HydrophobicContact CG2-CG 3.79Å
1001	G	88.9	Confident	91.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.16	C	C	.	.	S	Bend	trans	89.5	-16.3	178	0	0	0	0	0	115.1	R952 E997	R952-G1001 PolarHBondContact NE-O 3.09Å; R952-G1001 PolarHBondContact NH1-O 2.83Å; R952-G1001 PolarHBondContact NH2-O 2.89Å; E997-G1001 CarbonylContact O-C 3.56Å; E997-G1001 WeakPolarHBondContact O-CA 3.45Å; E997-G1001 PolarHBondContact O-N 2.78Å
1002	Q	89	Confident	91.1	Very high	73 Å²	73	31.3 Å²	31.3	34%	0.341	18%	0.177	S	C	.	.	S	Bend	trans	-141.9	156.9	-178.8	67.9	179.4	13.9	0	0	110.8	Y996 L1006	Y996-Q1002 WeakPolarHBondContact CD1-O 3.48Å; Y996-Q1002 WeakPolarHBondContact CE1-O 3.49Å; Q1002-L1006 HydrophobicContact CB-CD2 4.45Å
1003	P	92.7	Very high	90.7	Very high	5 Å²	5	31.3 Å²	31.3	3%	0.032	18%	0.177	C	C	.	.			trans	-63.2	148.4	175.9	-21	34.3	0	0	0	112.1	N970 V993 E997 F1005 L1006	N970-P1003 HydrophobicContact CB-CB 3.89Å; N970-P1003 HydrophobicContact CB-CG 3.95Å; V993-P1003 HydrophobicContact CG1-CB 4.21Å; E997-P1003 HydrophobicContact CG-CG 4.46Å; E997-P1003 VanDerWaalsContact OE1-CD 3.3Å; E997-P1003 WeakPolarHBondContact OE1-CD 3.49Å; P1003-F1005 VanDerWaalsContact C-N 3.29Å; P1003-F1005 PolarHBondContact O-N 2.82Å; P1003-L1006 HydrophobicContact CB-CB 4.38Å
1004	P	93.7	Very high	90.3	Very high	17 Å²	17	34.8 Å²	34.8	11%	0.11	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-24.3	-173.5	23.6	-26.4	0	0	0	113.7	Y996 L1024 L1044	Y996-P1004 HydrophobicContact CD1-CB 3.65Å; Y996-P1004 VanDerWaalsContact CD1-CD 3.44Å; Y996-P1004 HydrophobicContact CD1-CG 3.86Å; Y996-P1004 HydrophobicContact CD2-CB 4.11Å; Y996-P1004 HydrophobicContact CE1-CB 3.6Å; Y996-P1004 HydrophobicContact CE1-CG 4.3Å; Y996-P1004 HydrophobicContact CE2-CB 4.05Å; Y996-P1004 HydrophobicContact CG-CB 3.92Å; Y996-P1004 HydrophobicContact CG-CG 3.99Å; P1004-L1024 HydrophobicContact CB-CD1 3.87Å; P1004-L1024 HydrophobicContact CG-CD1 4.43Å; P1004-L1044 HydrophobicContact CG-CD1 4Å
1005	F	93.8	Very high	90	Very high	1 Å²	1	38.7 Å²	38.7	0%	0.004	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	1.7	-175	-52	-61.8	0	0	0	114	W989 P1003 A1007 R1016 V1017 W1020 L1024 L1044	W989-F1005 AromaticContact CH2-CE2 3.96Å; W989-F1005 HydrophobicContact CH2-CE2 3.96Å; W989-F1005 HydrophobicContact CH2-CZ 4Å; W989-F1005 HydrophobicContact CZ2-CD2 4.22Å; W989-F1005 AromaticContact CZ2-CE2 3.41Å; W989-F1005 HydrophobicContact CZ2-CE2 3.41Å; W989-F1005 VanDerWaalsContact CZ2-CE2 3.41Å; W989-F1005 AromaticContact CZ2-CZ 3.93Å; W989-F1005 HydrophobicContact CZ2-CZ 3.93Å; P1003-F1005 VanDerWaalsContact C-N 3.29Å; P1003-F1005 PolarHBondContact O-N 2.82Å; F1005-A1007 PolarHBondContact O-N 3.19Å; F1005-R1016 HydrophobicContact CB-CB 3.98Å; F1005-R1016 HydrophobicContact CD1-CB 4.34Å; F1005-R1016 WeakPolarHBondContact O-CD 3.33Å; F1005-V1017 HydrophobicContact CB-CG2 3.74Å; F1005-V1017 HydrophobicContact CD2-CG2 3.74Å; F1005-V1017 HydrophobicContact CG-CG2 3.86Å; F1005-W1020 HydrophobicContact CE1-CB 3.75Å; F1005-W1020 HydrophobicContact CZ-CB 3.7Å; F1005-L1024 HydrophobicContact CE1-CB 4.07Å; F1005-L1024 HydrophobicContact CE1-CD1 4.48Å; F1005-L1024 HydrophobicContact CZ-CB 4.3Å; F1005-L1024 HydrophobicContact CZ-CD1 4.19Å; F1005-L1044 HydrophobicContact CE2-CD1 4.35Å; F1005-L1044 HydrophobicContact CZ-CD1 4.39Å
1006	L	88.8	Confident	89.9	Confident	64 Å²	64	42.9 Å²	42.9	34%	0.335	23%	0.229	S	C	.	.			trans	-53.1	128	-175.6	-179.4	66.3	0	0	0	112	T968 Q1002 P1003 R1016	T968-L1006 HydrophobicContact CG2-CD1 4.42Å; Q1002-L1006 HydrophobicContact CB-CD2 4.45Å; P1003-L1006 HydrophobicContact CB-CB 4.38Å; L1006-R1016 PolarHBondContact O-NH1 2.85Å
1007	A	86.8	Confident	89.7	Confident	17 Å²	17	42.1 Å²	42.1	14%	0.14	23%	0.226	C	C	.	.			trans	-128.9	-178.2	176.3	0	0	0	0	0	111.7	F1005 D1012 T1013	F1005-A1007 PolarHBondContact O-N 3.19Å; A1007-D1012 HydrophobicContact CB-CB 3.39Å; A1007-T1013 PolarHBondContact N-OG1 2.99Å
1008	Q	80.5	Confident	89.6	Confident	181 Å²	181	44 Å²	44	85%	0.846	24%	0.238	S	C	*	.	S	Bend	trans	-71.1	-42.8	177.6	-67.2	-178.6	-1.5	0	0	111.6
1009	T	83	Confident	89.5	Confident	65 Å²	65	47.3 Å²	47.3	40%	0.399	25%	0.254	S	S	.	.	S	Bend	trans	-105.3	158.6	176.1	79.3	0	0	0	0	112.3	A1011 D1012 T1013	T1009-A1011 VanDerWaalsContact C-N 3.28Å; T1009-A1011 PolarHBondContact O-N 3.36Å; T1009-A1011 PolarHBondContact OG1-N 3.11Å; T1009-D1012 WeakPolarHBondContact CB-OD2 3.43Å; T1009-D1012 WeakPolarHBondContact CG2-OD2 3.29Å; T1009-D1012 PolarHBondContact N-OD2 2.88Å; T1009-D1012 PolarHBondContact OG1-N 2.75Å; T1009-D1012 PolarHBondContact OG1-OD2 2.71Å; T1009-T1013 PolarHBondContact O-N 2.83Å; T1009-T1013 VanDerWaalsContact O-N 3.16Å; T1009-T1013 PolarHBondContact O-OG1 2.78Å
1010	A	79.5	Confident	89.5	Confident	36 Å²	36	48.3 Å²	48.3	30%	0.298	26%	0.257	S	S	.	.	H	α-helix	trans	-63.4	-34.2	170.6	0	0	0	0	0	112	T1013 Q1014	A1010-T1013 WeakPolarHBondContact O-CB 3.33Å; A1010-T1013 PolarHBondContact O-N 2.83Å; A1010-Q1014 WeakPolarHBondContact O-CG 3.45Å; A1010-Q1014 PolarHBondContact O-N 3.43Å
1011	A	84.4	Confident	89.6	Confident	56 Å²	56	53.7 Å²	53.7	46%	0.463	27%	0.274	S	S	.	.	H	α-helix	trans	-67.2	-46	178.5	0	0	0	0	0	112.1	T1009 T1013 Q1014 I1015	T1009-A1011 VanDerWaalsContact C-N 3.28Å; T1009-A1011 PolarHBondContact O-N 3.36Å; T1009-A1011 PolarHBondContact OG1-N 3.11Å; A1011-T1013 PolarHBondContact O-N 2.83Å; A1011-Q1014 WeakPolarHBondContact O-CB 3.38Å; A1011-Q1014 PolarHBondContact O-N 3.01Å; A1011-Q1014 VanDerWaalsContact O-N 3.12Å; A1011-I1015 WeakPolarHBondContact O-CG1 3.3Å; A1011-I1015 PolarHBondContact O-N 2.83Å
1012	D	88.7	Confident	89.8	Confident	68 Å²	68	57.8 Å²	57.8	36%	0.364	30%	0.296	S	S	.	.	H	α-helix	trans	-59.2	-39	173.5	-62.7	-52	0	0	0	111.5	A1007 T1009 I1015 R1016	A1007-D1012 HydrophobicContact CB-CB 3.39Å; T1009-D1012 WeakPolarHBondContact CB-OD2 3.43Å; T1009-D1012 WeakPolarHBondContact CG2-OD2 3.29Å; T1009-D1012 PolarHBondContact N-OD2 2.88Å; T1009-D1012 PolarHBondContact OG1-N 2.75Å; T1009-D1012 PolarHBondContact OG1-OD2 2.71Å; D1012-I1015 PolarHBondContact O-N 2.84Å; D1012-R1016 VanDerWaalsContact O-CG 3.28Å; D1012-R1016 WeakPolarHBondContact O-CG 3.48Å; D1012-R1016 PolarHBondContact O-N 2.85Å
1013	T	88.7	Confident	90	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63	-42.8	176.3	-54.4	0	0	0	0	110.7	T968 P969 N970 A1007 T1009 A1010 A1011 R1016 V1017	T968-T1013 HydrophobicContact CG2-CG2 4.14Å; P969-T1013 HydrophobicContact CG-CG2 4.31Å; N970-T1013 WeakPolarHBondContact OD1-CG2 3.22Å; A1007-T1013 PolarHBondContact N-OG1 2.99Å; T1009-T1013 PolarHBondContact O-N 2.83Å; T1009-T1013 VanDerWaalsContact O-N 3.16Å; T1009-T1013 PolarHBondContact O-OG1 2.78Å; A1010-T1013 WeakPolarHBondContact O-CB 3.33Å; A1010-T1013 PolarHBondContact O-N 2.83Å; A1011-T1013 PolarHBondContact O-N 2.83Å; T1013-R1016 PolarHBondContact O-N 2.78Å; T1013-V1017 WeakPolarHBondContact O-CG2 3.2Å; T1013-V1017 PolarHBondContact O-N 2.82Å
1014	Q	89	Confident	90.1	Very high	74 Å²	74	59.5 Å²	59.5	35%	0.346	30%	0.301	S	S	.	.	H	α-helix	trans	-61	-44.9	173.9	-68.5	174.1	4.9	0	0	112	P969 L977 A1010 A1011 R1016 V1017 V1018	P969-Q1014 HydrophobicContact CB-CG 4.43Å; P969-Q1014 HydrophobicContact CG-CG 3.45Å; P969-Q1014 VanDerWaalsContact CG-CG 3.45Å; L977-Q1014 HydrophobicContact CD1-CB 4.16Å; L977-Q1014 HydrophobicContact CD1-CG 4.16Å; L977-Q1014 HydrophobicContact CD2-CG 4.19Å; A1010-Q1014 WeakPolarHBondContact O-CG 3.45Å; A1010-Q1014 PolarHBondContact O-N 3.43Å; A1011-Q1014 WeakPolarHBondContact O-CB 3.38Å; A1011-Q1014 PolarHBondContact O-N 3.01Å; A1011-Q1014 VanDerWaalsContact O-N 3.12Å; Q1014-R1016 VanDerWaalsContact C-N 3.32Å; Q1014-R1016 PolarHBondContact O-N 3.01Å; Q1014-V1017 PolarHBondContact O-N 2.86Å; Q1014-V1018 WeakPolarHBondContact O-CB 3.22Å; Q1014-V1018 VanDerWaalsContact O-CG2 3.32Å; Q1014-V1018 WeakPolarHBondContact O-CG2 3.43Å; Q1014-V1018 PolarHBondContact O-N 2.94Å
1015	I	91.4	Very high	90	Very high	82 Å²	82	66.3 Å²	66.3	42%	0.421	33%	0.329	S	S	.	.	H	α-helix	trans	-60	-44.4	177.8	-66.3	166.1	0	0	0	110.3	A1011 D1012 V1018 Q1019	A1011-I1015 WeakPolarHBondContact O-CG1 3.3Å; A1011-I1015 PolarHBondContact O-N 2.83Å; D1012-I1015 PolarHBondContact O-N 2.84Å; I1015-V1018 PolarHBondContact O-N 2.74Å; I1015-Q1019 WeakPolarHBondContact O-CB 3.48Å; I1015-Q1019 PolarHBondContact O-N 3.23Å
1016	R	94.1	Very high	89.9	Confident	88 Å²	88	67.5 Å²	67.5	33%	0.332	34%	0.335	S	S	.	.	H	α-helix	trans	-64.7	-37.4	178	-71.1	176.7	-176.3	-166.1	1.1	113.5	F1005 L1006 D1012 T1013 Q1014 Q1019 W1020 Y1023	F1005-R1016 HydrophobicContact CB-CB 3.98Å; F1005-R1016 HydrophobicContact CD1-CB 4.34Å; F1005-R1016 WeakPolarHBondContact O-CD 3.33Å; L1006-R1016 PolarHBondContact O-NH1 2.85Å; D1012-R1016 VanDerWaalsContact O-CG 3.28Å; D1012-R1016 WeakPolarHBondContact O-CG 3.48Å; D1012-R1016 PolarHBondContact O-N 2.85Å; T1013-R1016 PolarHBondContact O-N 2.78Å; Q1014-R1016 VanDerWaalsContact C-N 3.32Å; Q1014-R1016 PolarHBondContact O-N 3.01Å; R1016-Q1019 CarbonylContact O-C 3.57Å; R1016-W1020 VanDerWaalsContact O-CA 3.22Å; R1016-W1020 WeakPolarHBondContact O-CA 3.19Å; R1016-W1020 PolarHBondContact O-N 3.42Å; R1016-W1020 VanDerWaalsContact O-N 3.13Å; R1016-Y1023 HydrophobicContact CB-CD2 4.08Å; R1016-Y1023 HydrophobicContact CB-CG 4.05Å; R1016-Y1023 HydrophobicContact CG-CD1 3.78Å; R1016-Y1023 HydrophobicContact CG-CD2 3.94Å; R1016-Y1023 HydrophobicContact CG-CE1 3.98Å; R1016-Y1023 HydrophobicContact CG-CE2 4.12Å; R1016-Y1023 HydrophobicContact CG-CG 3.76Å
1017	V	92.9	Very high	89.8	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-69.4	-46.3	173.9	170.5	0	0	0	0	111.1	I972 P974 L977 W989 F1005 T1013 Q1014 Q1019 W1020	I972-V1017 VanDerWaalsContact O-CG1 3.31Å; I972-V1017 WeakPolarHBondContact O-CG1 3.49Å; P974-V1017 HydrophobicContact CB-CG1 4.24Å; L977-V1017 HydrophobicContact CD1-CB 3.81Å; L977-V1017 HydrophobicContact CD1-CG1 3.57Å; W989-V1017 HydrophobicContact CZ2-CG1 4.05Å; F1005-V1017 HydrophobicContact CB-CG2 3.74Å; F1005-V1017 HydrophobicContact CD2-CG2 3.74Å; F1005-V1017 HydrophobicContact CG-CG2 3.86Å; T1013-V1017 WeakPolarHBondContact O-CG2 3.2Å; T1013-V1017 PolarHBondContact O-N 2.82Å; Q1014-V1017 PolarHBondContact O-N 2.86Å; V1017-Q1019 VanDerWaalsContact C-N 3.27Å; V1017-Q1019 PolarHBondContact O-N 2.64Å; V1017-W1020 WeakPolarHBondContact O-CB 3.42Å; V1017-W1020 PolarHBondContact O-N 2.93Å
1018	V	92.3	Very high	89.6	Confident	48 Å²	48	67.4 Å²	67.4	29%	0.291	35%	0.347	S	S	.	.	H	α-helix	trans	-63.4	-35.1	-179.8	168.9	0	0	0	0	111.7	L977 R978 Q1014 I1015	L977-V1018 HydrophobicContact CB-CG2 3.88Å; L977-V1018 HydrophobicContact CD1-CG2 4.1Å; R978-V1018 HydrophobicContact CG-CG1 4.37Å; R978-V1018 HydrophobicContact CG-CG2 4.43Å; R978-V1018 PolarHBondContact NH2-O 2.87Å; Q1014-V1018 WeakPolarHBondContact O-CB 3.22Å; Q1014-V1018 VanDerWaalsContact O-CG2 3.32Å; Q1014-V1018 WeakPolarHBondContact O-CG2 3.43Å; Q1014-V1018 PolarHBondContact O-N 2.94Å; I1015-V1018 PolarHBondContact O-N 2.74Å
1019	Q	93.6	Very high	89.3	Confident	72 Å²	72	64.9 Å²	64.9	34%	0.336	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	33.8	176.1	-57.2	-173.7	3.6	0	0	113	I1015 R1016 V1017 Y1021 N1022 Y1023	I1015-Q1019 WeakPolarHBondContact O-CB 3.48Å; I1015-Q1019 PolarHBondContact O-N 3.23Å; R1016-Q1019 CarbonylContact O-C 3.57Å; V1017-Q1019 VanDerWaalsContact C-N 3.27Å; V1017-Q1019 PolarHBondContact O-N 2.64Å; Q1019-Y1021 PolarHBondContact O-N 3.17Å; Q1019-N1022 WeakPolarHBondContact O-CB 3.37Å; Q1019-N1022 PolarHBondContact O-N 2.86Å; Q1019-Y1023 HydrophobicContact CB-CD2 4.11Å; Q1019-Y1023 HydrophobicContact CB-CE2 4Å; Q1019-Y1023 WeakPolarHBondContact O-CD2 3.23Å
1020	W	95.1	Very high	88.9	Confident	35 Å²	35	67.9 Å²	67.9	13%	0.133	36%	0.356	C	S	.	.	H	α-helix	trans	-46.2	-37.1	-170.5	65.4	-88.8	0	0	0	115.4	W989 F1005 R1016 V1017 N1022 Y1023 L1024 L1044 R1045 D1046	W989-W1020 HydrophobicContact CH2-CB 3.59Å; W989-W1020 HydrophobicContact CH2-CD2 4.3Å; W989-W1020 AromaticContact CH2-CG 3.67Å; W989-W1020 HydrophobicContact CH2-CG 3.67Å; W989-W1020 HydrophobicContact CZ2-CB 4.38Å; W989-W1020 HydrophobicContact CZ3-CD2 4.41Å; W989-W1020 HydrophobicContact CZ3-CG 4.16Å; F1005-W1020 HydrophobicContact CE1-CB 3.75Å; F1005-W1020 HydrophobicContact CZ-CB 3.7Å; R1016-W1020 VanDerWaalsContact O-CA 3.22Å; R1016-W1020 WeakPolarHBondContact O-CA 3.19Å; R1016-W1020 PolarHBondContact O-N 3.42Å; R1016-W1020 VanDerWaalsContact O-N 3.13Å; V1017-W1020 WeakPolarHBondContact O-CB 3.42Å; V1017-W1020 PolarHBondContact O-N 2.93Å; W1020-N1022 PolarHBondContact O-N 2.82Å; W1020-Y1023 PolarHBondContact O-N 2.91Å; W1020-L1024 HydrophobicContact CE3-CD2 4.11Å; W1020-L1024 HydrophobicContact CZ3-CD2 4.36Å; W1020-L1024 VanDerWaalsContact O-CB 3.31Å; W1020-L1024 WeakPolarHBondContact O-CB 3.09Å; W1020-L1024 PolarHBondContact O-N 2.8Å; W1020-L1044 WeakPolarHBondContact CZ3-O 3.27Å; W1020-R1045 HydrophobicContact CH2-CB 4.38Å; W1020-R1045 HydrophobicContact CH2-CG 4.09Å; W1020-R1045 HydrophobicContact CZ2-CB 4.45Å; W1020-D1046 VanDerWaalsContact CE2-OD2 3.32Å; W1020-D1046 WeakPolarHBondContact CZ2-OD2 3.49Å; W1020-D1046 PolarHBondContact NE1-OD2 2.87Å
1021	Y	93.8	Very high	88.7	Confident	146 Å²	146	73.1 Å²	73.1	57%	0.573	37%	0.368	S	S	*	.	H	α-helix	trans	-61.4	-26.5	-179.3	61.2	-90.9	0	0	0	113.5	Q1019	Q1019-Y1021 PolarHBondContact O-N 3.17Å
1022	N	93.9	Very high	88.8	Confident	86 Å²	86	70.7 Å²	70.7	46%	0.46	35%	0.347	S	S	.	.	H	α-helix	trans	-82.7	-24.3	174.4	-69.4	-31.6	0	0	0	113.2	Q1019 W1020	Q1019-N1022 WeakPolarHBondContact O-CB 3.37Å; Q1019-N1022 PolarHBondContact O-N 2.86Å; W1020-N1022 PolarHBondContact O-N 2.82Å
1023	Y	94.1	Very high	89	Confident	89 Å²	89	72.4 Å²	72.4	35%	0.349	35%	0.352	S	S	.	.	H	α-helix	trans	-113.4	-19.2	-167.1	-68.1	-76	0	0	0	114.6	R1016 Q1019 W1020 K1025	R1016-Y1023 HydrophobicContact CB-CD2 4.08Å; R1016-Y1023 HydrophobicContact CB-CG 4.05Å; R1016-Y1023 HydrophobicContact CG-CD1 3.78Å; R1016-Y1023 HydrophobicContact CG-CD2 3.94Å; R1016-Y1023 HydrophobicContact CG-CE1 3.98Å; R1016-Y1023 HydrophobicContact CG-CE2 4.12Å; R1016-Y1023 HydrophobicContact CG-CG 3.76Å; Q1019-Y1023 HydrophobicContact CB-CD2 4.11Å; Q1019-Y1023 HydrophobicContact CB-CE2 4Å; Q1019-Y1023 WeakPolarHBondContact O-CD2 3.23Å; W1020-Y1023 PolarHBondContact O-N 2.91Å; Y1023-K1025 PolarHBondContact O-N 3.43Å
1024	L	94.8	Very high	89.2	Confident	25 Å²	25	79.4 Å²	79.4	13%	0.131	38%	0.382	C	S	.	.			trans	-71.2	88.2	-179.6	-177.3	59.1	0	0	0	112	P1004 F1005 W1020 L1026 L1044	P1004-L1024 HydrophobicContact CB-CD1 3.87Å; P1004-L1024 HydrophobicContact CG-CD1 4.43Å; F1005-L1024 HydrophobicContact CE1-CB 4.07Å; F1005-L1024 HydrophobicContact CE1-CD1 4.48Å; F1005-L1024 HydrophobicContact CZ-CB 4.3Å; F1005-L1024 HydrophobicContact CZ-CD1 4.19Å; W1020-L1024 HydrophobicContact CE3-CD2 4.11Å; W1020-L1024 HydrophobicContact CZ3-CD2 4.36Å; W1020-L1024 VanDerWaalsContact O-CB 3.31Å; W1020-L1024 WeakPolarHBondContact O-CB 3.09Å; W1020-L1024 PolarHBondContact O-N 2.8Å; L1024-L1026 HydrophobicContact CD1-CD2 3.74Å; L1024-L1026 HydrophobicContact CG-CD2 4.21Å; L1024-L1044 HydrophobicContact CD1-CD1 3.66Å; L1024-L1044 HydrophobicContact CD2-CB 3.73Å; L1024-L1044 HydrophobicContact CD2-CD1 4.16Å
1025	K	91.4	Very high	89.6	Confident	160 Å²	160	79 Å²	79	70%	0.696	38%	0.382	S	S	*	.			trans	-103.2	90.4	-179.7	-67	178.6	-176.8	-179.6	0	110.8	Y996 Y1023	Y996-K1025 PolarHBondContact OH-O 2.78Å; Y1023-K1025 PolarHBondContact O-N 3.43Å
1026	L	90.7	Very high	89.8	Confident	25 Å²	25	75 Å²	75	13%	0.131	36%	0.362	C	S	.	.			trans	-68.6	132.4	174.1	-58.8	-161.1	0	0	0	111	Y996 L1024 L1032 S1037 I1040 R1041	Y996-L1026 HydrophobicContact CD2-CD2 3.57Å; Y996-L1026 HydrophobicContact CE2-CD2 3.52Å; L1024-L1026 HydrophobicContact CD1-CD2 3.74Å; L1024-L1026 HydrophobicContact CG-CD2 4.21Å; L1026-L1032 HydrophobicContact CB-CD2 4.11Å; L1026-L1032 HydrophobicContact CD1-CD2 4.12Å; L1026-L1032 HydrophobicContact CD2-CD2 4.49Å; L1026-L1032 HydrophobicContact CG-CD2 4.49Å; L1026-S1037 VanDerWaalsContact CD1-O 3.28Å; L1026-S1037 WeakPolarHBondContact CD1-O 3.42Å; L1026-I1040 HydrophobicContact CD1-CB 4.32Å; L1026-I1040 HydrophobicContact CD1-CG2 4.32Å; L1026-I1040 HydrophobicContact CD2-CG2 3.78Å; L1026-R1041 HydrophobicContact CD1-CG 3.69Å
1027	P	87.4	Confident	89.9	Confident	24 Å²	24	71.9 Å²	71.9	16%	0.156	35%	0.353	C	S	.	.			trans	-66.9	148.6	169	29.9	-34	0	0	0	110.3	V1000 R1031 L1032	V1000-P1027 HydrophobicContact CG1-CG 4.27Å; V1000-P1027 HydrophobicContact CG2-CG 3.79Å; P1027-R1031 HydrophobicContact CB-CB 4.2Å; P1027-R1031 HydrophobicContact CG-CB 4.33Å; P1027-L1032 HydrophobicContact CG-CB 4.09Å; P1027-L1032 HydrophobicContact CG-CD2 4.29Å
1028	G	82.2	Confident	90	Very high	55 Å²	55	75.2 Å²	75.2	57%	0.567	37%	0.371	S	S	*	.			trans	-77.4	177.2	170.5	0	0	0	0	0	113.1	R1031	G1028-R1031 PolarHBondContact O-N 3.45Å
1029	E	74.9	Confident	90.3	Very high	129 Å²	129	72.9 Å²	72.9	60%	0.603	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	150.4	172.7	-69.4	-177.4	171.6	0	0	111.6	L1032 K1033 K1034	E1029-L1032 WeakPolarHBondContact CG-O 3.35Å; E1029-K1033 WeakPolarHBondContact OE1-CA 3.48Å; E1029-K1034 PolarHBondContact OE1-N 3.36Å
1030	P	73.9	Confident	90.5	Very high	128 Å²	128	69.5 Å²	69.5	83%	0.831	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	cis	-84.7	2.3	3.8	35.3	-37.5	0	0	0	114.7	L1032	P1030-L1032 PolarHBondContact O-N 2.84Å
1031	R	74.8	Confident	90.6	Very high	145 Å²	145	73.6 Å²	73.6	55%	0.547	36%	0.356	S	S	.	.	S	Bend	trans	-66.4	-35.1	-175	-75.1	-178.9	172.4	167.7	-5.6	113.7	P1027 G1028	P1027-R1031 HydrophobicContact CB-CB 4.2Å; P1027-R1031 HydrophobicContact CG-CB 4.33Å; G1028-R1031 PolarHBondContact O-N 3.45Å
1032	L	87.1	Confident	90.7	Very high	5 Å²	5	69.7 Å²	69.7	3%	0.026	34%	0.343	C	S	.	.	S	Bend	trans	-143	108.7	-175.4	-177.4	68.4	0	0	0	107.4	L999 L1026 P1027 E1029 P1030 A1036 I1040	L999-L1032 HydrophobicContact CB-CD1 3.99Å; L999-L1032 HydrophobicContact CD1-CD1 3.58Å; L999-L1032 HydrophobicContact CG-CD1 4.45Å; L1026-L1032 HydrophobicContact CB-CD2 4.11Å; L1026-L1032 HydrophobicContact CD1-CD2 4.12Å; L1026-L1032 HydrophobicContact CD2-CD2 4.49Å; L1026-L1032 HydrophobicContact CG-CD2 4.49Å; P1027-L1032 HydrophobicContact CG-CB 4.09Å; P1027-L1032 HydrophobicContact CG-CD2 4.29Å; E1029-L1032 WeakPolarHBondContact CG-O 3.35Å; P1030-L1032 PolarHBondContact O-N 2.84Å; L1032-A1036 HydrophobicContact CD1-CB 3.61Å; L1032-A1036 HydrophobicContact CG-CB 4.38Å; L1032-I1040 HydrophobicContact CD1-CD1 3.94Å; L1032-I1040 HydrophobicContact CD2-CD1 4.13Å
1033	K	92.4	Very high	90.9	Very high	105 Å²	105	65.6 Å²	65.6	46%	0.457	32%	0.322	S	S	.	.			trans	-62.2	154.1	179.8	-61.1	-170.9	-153.7	156.2	0	111.2	E805 E1029 D1035 A1036 S1037	E805-K1033 VanDerWaalsContact CD-NZ 3.29Å; E805-K1033 IonicContact OE1-NZ 3.9Å; E805-K1033 PolarHBondContact OE1-NZ 3.11Å; E805-K1033 WeakPolarHBondContact OE2-CD 3.33Å; E805-K1033 WeakPolarHBondContact OE2-CE 3.42Å; E805-K1033 VanDerWaalsContact OE2-CG 3.26Å; E805-K1033 WeakPolarHBondContact OE2-CG 3.49Å; E805-K1033 IonicContact OE2-NZ 2.67Å; E805-K1033 PolarHBondContact OE2-NZ 2.81Å; E1029-K1033 WeakPolarHBondContact OE1-CA 3.48Å; K1033-D1035 VanDerWaalsContact C-N 3.28Å; K1033-D1035 PolarHBondContact O-N 2.76Å; K1033-D1035 VanDerWaalsContact O-N 3.13Å; K1033-A1036 PolarHBondContact O-N 3.16Å; K1033-A1036 VanDerWaalsContact O-N 3.17Å; K1033-S1037 PolarHBondContact O-N 3.4Å
1034	K	94	Very high	91.1	Very high	147 Å²	147	61.4 Å²	61.4	64%	0.639	31%	0.305	S	S	*	.	H	α-helix	trans	-36.3	-55	175.3	-170.7	-174.6	-179.2	-170.6	0	113.3	E1029 S1037 N1038	E1029-K1034 PolarHBondContact OE1-N 3.36Å; K1034-S1037 WeakPolarHBondContact O-CB 3.23Å; K1034-S1037 PolarHBondContact O-N 3.29Å; K1034-S1037 PolarHBondContact O-OG 2.74Å; K1034-N1038 WeakPolarHBondContact O-CB 3.28Å; K1034-N1038 PolarHBondContact O-N 2.74Å
1035	D	95.7	Very high	91.1	Very high	64 Å²	64	64.8 Å²	64.8	34%	0.342	32%	0.316	S	S	.	.	H	α-helix	trans	-76	-36.8	-172	-48	-64.6	0	0	0	113.1	K1033 S1037 N1038 L1039 H1060 P1061 F1062	K1033-D1035 VanDerWaalsContact C-N 3.28Å; K1033-D1035 PolarHBondContact O-N 2.76Å; K1033-D1035 VanDerWaalsContact O-N 3.13Å; D1035-S1037 VanDerWaalsContact C-N 3.31Å; D1035-S1037 PolarHBondContact O-N 3.43Å; D1035-N1038 PolarHBondContact O-N 3.13Å; D1035-L1039 PolarHBondContact O-N 3.47Å; D1035-H1060 PolarHBondContact O-CE1 3.3Å; D1035-H1060 VanDerWaalsContact O-CE1 3.28Å; D1035-P1061 HydrophobicContact CB-CB 4.48Å; D1035-F1062 HydrophobicContact CB-CB 4.42Å
1036	A	96.8	Very high	91.2	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.1	-41.6	170.1	0	0	0	0	0	110.9	L999 L1032 K1033 N1038 I1040 F1062	L999-A1036 HydrophobicContact CD1-CB 3.73Å; L1032-A1036 HydrophobicContact CD1-CB 3.61Å; L1032-A1036 HydrophobicContact CG-CB 4.38Å; K1033-A1036 PolarHBondContact O-N 3.16Å; K1033-A1036 VanDerWaalsContact O-N 3.17Å; A1036-N1038 VanDerWaalsContact C-N 3.31Å; A1036-N1038 PolarHBondContact O-N 2.81Å; A1036-I1040 WeakPolarHBondContact O-CD1 3.35Å; A1036-I1040 VanDerWaalsContact O-CG1 3.29Å; A1036-I1040 WeakPolarHBondContact O-CG1 3.45Å; A1036-I1040 PolarHBondContact O-N 2.75Å; A1036-I1040 VanDerWaalsContact O-N 3.16Å; A1036-F1062 HydrophobicContact CB-CD2 3.79Å; A1036-F1062 HydrophobicContact CB-CE2 3.77Å
1037	S	95.9	Very high	91.2	Very high	22 Å²	22	60.3 Å²	60.3	15%	0.154	30%	0.303	C	S	.	.	H	α-helix	trans	-64.8	-35.2	174.3	92.1	0	0	0	0	112.4	L1026 K1033 K1034 D1035 R1041	L1026-S1037 VanDerWaalsContact CD1-O 3.28Å; L1026-S1037 WeakPolarHBondContact CD1-O 3.42Å; K1033-S1037 PolarHBondContact O-N 3.4Å; K1034-S1037 WeakPolarHBondContact O-CB 3.23Å; K1034-S1037 PolarHBondContact O-N 3.29Å; K1034-S1037 PolarHBondContact O-OG 2.74Å; D1035-S1037 VanDerWaalsContact C-N 3.31Å; D1035-S1037 PolarHBondContact O-N 3.43Å; S1037-R1041 VanDerWaalsContact O-CG 3.29Å; S1037-R1041 WeakPolarHBondContact O-CG 3.45Å; S1037-R1041 PolarHBondContact O-N 3.35Å
1038	N	96.2	Very high	91.3	Very high	69 Å²	69	64.2 Å²	64.2	37%	0.369	33%	0.331	S	S	.	.	H	α-helix	trans	-69	-48	179	-164.7	-61.7	0	0	0	110.8	K1034 D1035 A1036 I1040 R1041 Q1042 H1060	K1034-N1038 WeakPolarHBondContact O-CB 3.28Å; K1034-N1038 PolarHBondContact O-N 2.74Å; D1035-N1038 PolarHBondContact O-N 3.13Å; A1036-N1038 VanDerWaalsContact C-N 3.31Å; A1036-N1038 PolarHBondContact O-N 2.81Å; N1038-I1040 VanDerWaalsContact C-N 3.33Å; N1038-I1040 PolarHBondContact O-N 2.76Å; N1038-R1041 CarbonylContact O-C 3.6Å; N1038-R1041 WeakPolarHBondContact O-CA 3.34Å; N1038-R1041 WeakPolarHBondContact O-CB 3.37Å; N1038-R1041 PolarHBondContact O-N 2.64Å; N1038-Q1042 WeakPolarHBondContact O-CG 3.43Å; N1038-Q1042 PolarHBondContact O-N 3.07Å; N1038-Q1042 PolarHBondContact OD1-NE2 3.19Å; N1038-H1060 PolarHBondContact OD1-NE2 3.18Å
1039	L	97.9	Very high	91.9	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-57.5	-45.6	177.2	-176.5	54.6	0	0	0	111.4	L995 D1035 R1041 Q1042 L1043 L1051 H1060 F1062 F1063	L995-L1039 HydrophobicContact CD2-CB 4.25Å; L995-L1039 HydrophobicContact CD2-CD2 3.61Å; L995-L1039 HydrophobicContact CD2-CG 3.86Å; D1035-L1039 PolarHBondContact O-N 3.47Å; L1039-R1041 VanDerWaalsContact C-N 3.33Å; L1039-R1041 PolarHBondContact O-N 3.18Å; L1039-Q1042 PolarHBondContact O-N 3.29Å; L1039-L1043 HydrophobicContact CD1-CD1 3.87Å; L1039-L1043 HydrophobicContact CD1-CG 4Å; L1039-L1043 HydrophobicContact CG-CD1 3.83Å; L1039-L1043 HydrophobicContact CG-CG 4.37Å; L1039-L1043 WeakPolarHBondContact O-CG 3.19Å; L1039-L1043 PolarHBondContact O-N 2.92Å; L1039-L1051 HydrophobicContact CD1-CD2 3.95Å; L1039-H1060 HydrophobicContact CD1-CB 4.36Å; L1039-F1062 HydrophobicContact CB-CB 4.44Å; L1039-F1062 HydrophobicContact CD2-CB 3.98Å; L1039-F1062 HydrophobicContact CD2-CD1 3.39Å; L1039-F1062 HydrophobicContact CD2-CE1 4.05Å; L1039-F1062 HydrophobicContact CD2-CG 3.83Å; L1039-F1063 HydrophobicContact CD1-CE2 4.46Å; L1039-F1063 HydrophobicContact CD2-CE2 3.61Å; L1039-F1063 HydrophobicContact CD2-CZ 3.67Å
1040	I	97.7	Very high	92.9	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-61.7	-40.3	176	-63.1	164.5	0	0	0	111.1	L995 Y996 L1026 L1032 A1036 N1038 Q1042 L1043 L1044	L995-I1040 HydrophobicContact CB-CG1 4.42Å; L995-I1040 HydrophobicContact CD2-CD1 4.43Å; L995-I1040 HydrophobicContact CD2-CG1 3.75Å; L995-I1040 HydrophobicContact CG-CD1 4.1Å; L995-I1040 HydrophobicContact CG-CG1 3.85Å; Y996-I1040 HydrophobicContact CD2-CD1 4.31Å; Y996-I1040 HydrophobicContact CD2-CG2 4.28Å; L1026-I1040 HydrophobicContact CD1-CB 4.32Å; L1026-I1040 HydrophobicContact CD1-CG2 4.32Å; L1026-I1040 HydrophobicContact CD2-CG2 3.78Å; L1032-I1040 HydrophobicContact CD1-CD1 3.94Å; L1032-I1040 HydrophobicContact CD2-CD1 4.13Å; A1036-I1040 WeakPolarHBondContact O-CD1 3.35Å; A1036-I1040 VanDerWaalsContact O-CG1 3.29Å; A1036-I1040 WeakPolarHBondContact O-CG1 3.45Å; A1036-I1040 PolarHBondContact O-N 2.75Å; A1036-I1040 VanDerWaalsContact O-N 3.16Å; N1038-I1040 VanDerWaalsContact C-N 3.33Å; N1038-I1040 PolarHBondContact O-N 2.76Å; I1040-Q1042 PolarHBondContact O-N 2.8Å; I1040-L1043 PolarHBondContact O-N 3.19Å; I1040-L1044 HydrophobicContact CG2-CD1 3.64Å; I1040-L1044 HydrophobicContact CG2-CG 4.15Å; I1040-L1044 WeakPolarHBondContact O-CB 3.48Å; I1040-L1044 PolarHBondContact O-N 2.95Å
1041	R	96.4	Very high	94	Very high	121 Å²	121	55.8 Å²	55.8	46%	0.457	27%	0.269	S	S	.	.	H	α-helix	trans	-68.4	-14.9	173.9	-72.4	177.3	-165.8	-77.2	2.1	114.4	L1026 S1037 N1038 L1039 R1045	L1026-R1041 HydrophobicContact CD1-CG 3.69Å; S1037-R1041 VanDerWaalsContact O-CG 3.29Å; S1037-R1041 WeakPolarHBondContact O-CG 3.45Å; S1037-R1041 PolarHBondContact O-N 3.35Å; N1038-R1041 CarbonylContact O-C 3.6Å; N1038-R1041 WeakPolarHBondContact O-CA 3.34Å; N1038-R1041 WeakPolarHBondContact O-CB 3.37Å; N1038-R1041 PolarHBondContact O-N 2.64Å; L1039-R1041 VanDerWaalsContact C-N 3.33Å; L1039-R1041 PolarHBondContact O-N 3.18Å; R1041-R1045 WeakPolarHBondContact O-CG 3.32Å; R1041-R1045 PolarHBondContact O-NE 2.83Å
1042	Q	97.1	Very high	95	Very high	64 Å²	64	50.3 Å²	50.3	30%	0.299	25%	0.253	S	S	.	.	H	α-helix	trans	-95.7	-33.3	175.9	-72.5	-161.2	63.7	0	0	112.2	N1038 L1039 I1040 L1051 H1060	N1038-Q1042 WeakPolarHBondContact O-CG 3.43Å; N1038-Q1042 PolarHBondContact O-N 3.07Å; N1038-Q1042 PolarHBondContact OD1-NE2 3.19Å; L1039-Q1042 PolarHBondContact O-N 3.29Å; I1040-Q1042 PolarHBondContact O-N 2.8Å; Q1042-L1051 HydrophobicContact CB-CB 3.78Å; Q1042-L1051 HydrophobicContact CB-CD2 3.91Å; Q1042-L1051 HydrophobicContact CB-CG 4.47Å; Q1042-L1051 PolarHBondContact O-N 3.23Å; Q1042-H1060 PolarHBondContact NE2-CD2 3.45Å; Q1042-H1060 VanDerWaalsContact NE2-CD2 3.35Å; Q1042-H1060 PolarHBondContact NE2-NE2 3.09Å
1043	L	97.9	Very high	95.3	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-80.1	-35	176	-65.1	172.9	0	0	0	113.1	W988 V991 L1039 I1040 R1045 R1050 L1051 I1057	W988-L1043 HydrophobicContact CB-CD2 4.21Å; V991-L1043 HydrophobicContact CG1-CD1 4.13Å; L1039-L1043 HydrophobicContact CD1-CD1 3.87Å; L1039-L1043 HydrophobicContact CD1-CG 4Å; L1039-L1043 HydrophobicContact CG-CD1 3.83Å; L1039-L1043 HydrophobicContact CG-CG 4.37Å; L1039-L1043 WeakPolarHBondContact O-CG 3.19Å; L1039-L1043 PolarHBondContact O-N 2.92Å; I1040-L1043 PolarHBondContact O-N 3.19Å; L1043-R1045 PolarHBondContact O-N 3.38Å; L1043-R1050 WeakPolarHBondContact O-CD 3.33Å; L1043-R1050 VanDerWaalsContact O-CG 3.29Å; L1043-R1050 WeakPolarHBondContact O-CG 3.36Å; L1043-L1051 WeakPolarHBondContact CD2-O 3.3Å; L1043-I1057 HydrophobicContact CD2-CD1 4.36Å
1044	L	97.5	Very high	95.4	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.	S	Bend	trans	-93.7	75.5	178.7	-59.8	-176.1	0	0	0	111	W989 V993 P1004 F1005 W1020 L1024 I1040	W989-L1044 HydrophobicContact CD2-CD2 3.7Å; W989-L1044 HydrophobicContact CE3-CB 4.41Å; W989-L1044 HydrophobicContact CE3-CD2 3.85Å; W989-L1044 HydrophobicContact CG-CD2 4.19Å; W989-L1044 HydrophobicContact CH2-CB 4.43Å; W989-L1044 HydrophobicContact CH2-CD2 4.29Å; W989-L1044 HydrophobicContact CZ2-CD2 4.17Å; W989-L1044 HydrophobicContact CZ3-CB 4.1Å; W989-L1044 HydrophobicContact CZ3-CD2 4.16Å; W989-L1044 WeakPolarHBondContact O-CD2 3.36Å; V993-L1044 HydrophobicContact CG2-CD2 3.82Å; P1004-L1044 HydrophobicContact CG-CD1 4Å; F1005-L1044 HydrophobicContact CE2-CD1 4.35Å; F1005-L1044 HydrophobicContact CZ-CD1 4.39Å; W1020-L1044 WeakPolarHBondContact CZ3-O 3.27Å; L1024-L1044 HydrophobicContact CD1-CD1 3.66Å; L1024-L1044 HydrophobicContact CD2-CB 3.73Å; L1024-L1044 HydrophobicContact CD2-CD1 4.16Å; I1040-L1044 HydrophobicContact CG2-CD1 3.64Å; I1040-L1044 HydrophobicContact CG2-CG 4.15Å; I1040-L1044 WeakPolarHBondContact O-CB 3.48Å; I1040-L1044 PolarHBondContact O-N 2.95Å
1045	R	95.4	Very high	95.4	Very high	96 Å²	96	46.7 Å²	46.7	36%	0.362	25%	0.251	S	S	.	.	S	Bend	trans	-139.8	168.8	175.2	-69.6	-175.6	171.7	-107	-3.1	112	W1020 R1041 L1043 D1049 R1050	W1020-R1045 HydrophobicContact CH2-CB 4.38Å; W1020-R1045 HydrophobicContact CH2-CG 4.09Å; W1020-R1045 HydrophobicContact CZ2-CB 4.45Å; R1041-R1045 WeakPolarHBondContact O-CG 3.32Å; R1041-R1045 PolarHBondContact O-NE 2.83Å; L1043-R1045 PolarHBondContact O-N 3.38Å; R1045-D1049 HydrophobicContact CB-CB 4.34Å; R1045-D1049 VanDerWaalsContact CD-O 3.24Å; R1045-D1049 WeakPolarHBondContact CD-O 3.34Å; R1045-R1050 HydrophobicContact CB-CB 4.24Å; R1045-R1050 VanDerWaalsContact O-CZ 3.23Å; R1045-R1050 PolarHBondContact O-NE 3.43Å; R1045-R1050 PolarHBondContact O-NH2 3.14Å
1046	D	92.8	Very high	95.5	Very high	40 Å²	40	49.5 Å²	49.5	21%	0.214	26%	0.26	C	S	.	.			trans	-64	153.6	165.4	-70.4	-76.4	0	0	0	111.6	R978 W1020 S1048 D1049 R1050	R978-D1046 IonicContact CZ-OD1 3.24Å; R978-D1046 VanDerWaalsContact CZ-OD1 3.24Å; R978-D1046 IonicContact NH1-OD1 2.68Å; R978-D1046 PolarHBondContact NH1-OD1 3.34Å; R978-D1046 IonicContact NH2-OD1 2.88Å; R978-D1046 PolarHBondContact NH2-OD1 3.23Å; W1020-D1046 VanDerWaalsContact CE2-OD2 3.32Å; W1020-D1046 WeakPolarHBondContact CZ2-OD2 3.49Å; W1020-D1046 PolarHBondContact NE1-OD2 2.87Å; D1046-S1048 VanDerWaalsContact C-N 3.31Å; D1046-S1048 PolarHBondContact O-N 3.32Å; D1046-S1048 VanDerWaalsContact O-N 3.09Å; D1046-D1049 PolarHBondContact O-N 2.67Å; D1046-D1049 VanDerWaalsContact O-N 3.11Å; D1046-R1050 PolarHBondContact O-N 3.47Å
1047	P	90.8	Very high	95.5	Very high	51 Å²	51	49.6 Å²	49.6	33%	0.331	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.3	-162.1	-28.8	36.9	0	0	0	117.5	E975	E975-P1047 HydrophobicContact CB-CG 3.98Å; E975-P1047 HydrophobicContact CG-CG 3.92Å
1048	S	90.9	Very high	95.6	Very high	107 Å²	107	51 Å²	51	75%	0.748	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-35.2	177.6	52.3	0	0	0	0	113	D1046	D1046-S1048 VanDerWaalsContact C-N 3.31Å; D1046-S1048 PolarHBondContact O-N 3.32Å; D1046-S1048 VanDerWaalsContact O-N 3.09Å
1049	D	94	Very high	95.6	Very high	103 Å²	103	52 Å²	52	55%	0.551	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	-4.6	-169.6	-56.6	8.3	0	0	0	111.3	R1045 D1046	R1045-D1049 HydrophobicContact CB-CB 4.34Å; R1045-D1049 VanDerWaalsContact CD-O 3.24Å; R1045-D1049 WeakPolarHBondContact CD-O 3.34Å; D1046-D1049 PolarHBondContact O-N 2.67Å; D1046-D1049 VanDerWaalsContact O-N 3.11Å
1050	R	96.8	Very high	95.6	Very high	12 Å²	12	52.5 Å²	52.5	5%	0.045	28%	0.278	C	S	.	.	S	Bend	trans	-76.8	128.8	-176.8	-171.6	-178	-54.9	153.2	4.4	110.7	E975 A985 L1043 R1045 D1046 S1052	E975-R1050 IonicContact OE1-CZ 3.55Å; E975-R1050 IonicContact OE1-NH1 3.54Å; E975-R1050 PolarHBondContact OE1-NH1 2.89Å; E975-R1050 IonicContact OE1-NH2 3.63Å; E975-R1050 PolarHBondContact OE1-NH2 2.99Å; E975-R1050 IonicContact OE2-CZ 3.89Å; E975-R1050 IonicContact OE2-NH1 2.98Å; E975-R1050 IonicContact OE2-NH2 3.06Å; E975-R1050 PolarHBondContact OE2-NH2 2.94Å; A985-R1050 VanDerWaalsContact C-NH1 3.27Å; A985-R1050 WeakPolarHBondContact O-CD 3.17Å; A985-R1050 PolarHBondContact O-NH1 3.28Å; L1043-R1050 WeakPolarHBondContact O-CD 3.33Å; L1043-R1050 VanDerWaalsContact O-CG 3.29Å; L1043-R1050 WeakPolarHBondContact O-CG 3.36Å; R1045-R1050 HydrophobicContact CB-CB 4.24Å; R1045-R1050 VanDerWaalsContact O-CZ 3.23Å; R1045-R1050 PolarHBondContact O-NE 3.43Å; R1045-R1050 PolarHBondContact O-NH2 3.14Å; D1046-R1050 PolarHBondContact O-N 3.47Å; R1050-S1052 VanDerWaalsContact C-N 3.3Å; R1050-S1052 PolarHBondContact O-N 3.24Å; R1050-S1052 PolarHBondContact O-OG 2.89Å
1051	L	96.5	Very high	95.6	Very high	19 Å²	19	55.8 Å²	55.8	10%	0.099	30%	0.299	C	S	.	.			trans	-64.1	89.5	171.7	-178.2	70.7	0	0	0	110	L1039 Q1042 L1043 K1056 I1057	L1039-L1051 HydrophobicContact CD1-CD2 3.95Å; Q1042-L1051 HydrophobicContact CB-CB 3.78Å; Q1042-L1051 HydrophobicContact CB-CD2 3.91Å; Q1042-L1051 HydrophobicContact CB-CG 4.47Å; Q1042-L1051 PolarHBondContact O-N 3.23Å; L1043-L1051 WeakPolarHBondContact CD2-O 3.3Å; L1051-K1056 HydrophobicContact CD1-CB 3.57Å; L1051-I1057 HydrophobicContact CD2-CG1 3.99Å; L1051-I1057 HydrophobicContact CG-CG1 3.74Å
1052	S	94.3	Very high	95.6	Very high	31 Å²	31	50 Å²	50	22%	0.217	28%	0.278	C	S	.	.			trans	-117	5.8	-170.3	-50.8	0	0	0	0	113.3	W988 R1050	W988-S1052 PolarHBondContact NE1-O 3.32Å; R1050-S1052 VanDerWaalsContact C-N 3.3Å; R1050-S1052 PolarHBondContact O-N 3.24Å; R1050-S1052 PolarHBondContact O-OG 2.89Å
1053	D	94.5	Very high	95.6	Very high	55 Å²	55	47.1 Å²	47.1	29%	0.294	26%	0.264	S	S	.	.			trans	-98	114.2	-179.2	174.3	-11.3	0	0	0	108.8	V1055 K1056 I1057	D1053-V1055 PolarHBondContact O-N 2.73Å; D1053-V1055 VanDerWaalsContact O-N 3.1Å; D1053-V1055 WeakPolarHBondContact OD1-CB 3.35Å; D1053-V1055 PolarHBondContact OD1-N 2.97Å; D1053-K1056 HydrophobicContact CB-CB 4.2Å; D1053-K1056 HydrophobicContact CB-CD 3.98Å; D1053-K1056 HydrophobicContact CB-CG 4.17Å; D1053-K1056 PolarHBondContact O-N 2.8Å; D1053-K1056 VanDerWaalsContact O-N 3.07Å; D1053-K1056 VanDerWaalsContact OD2-CD 3.3Å; D1053-K1056 WeakPolarHBondContact OD2-CD 3.31Å; D1053-K1056 WeakPolarHBondContact OD2-CE 3.35Å; D1053-K1056 WeakPolarHBondContact OD2-CG 3.42Å; D1053-K1056 IonicContact OD2-NZ 2.79Å; D1053-K1056 PolarHBondContact OD2-NZ 3.24Å; D1053-I1057 WeakPolarHBondContact O-CG1 3.31Å; D1053-I1057 PolarHBondContact O-N 3.03Å
1054	P	93.9	Very high	95.5	Very high	26 Å²	26	55.6 Å²	55.6	17%	0.169	30%	0.304	C	S	.	.	H	α-helix	trans	-55.3	-30.7	-177.9	-25.9	33.7	0	0	0	113.8	Q820 W988 K1058	Q820-P1054 HydrophobicContact CB-CB 4.39Å; Q820-P1054 HydrophobicContact CG-CB 4.16Å; Q820-P1054 HydrophobicContact CG-CG 4.3Å; W988-P1054 HydrophobicContact CZ2-CG 3.9Å; P1054-K1058 VanDerWaalsContact O-CG 3.25Å; P1054-K1058 WeakPolarHBondContact O-CG 3.42Å; P1054-K1058 PolarHBondContact O-N 3.2Å; P1054-K1058 VanDerWaalsContact O-N 3.1Å
1055	V	95.2	Very high	95.3	Very high	100 Å²	100	60 Å²	60	61%	0.606	34%	0.335	S	S	*	.	H	α-helix	trans	-68.7	-45.7	179.5	-175.9	0	0	0	0	110.1	D1053 K1058 S1059	D1053-V1055 PolarHBondContact O-N 2.73Å; D1053-V1055 VanDerWaalsContact O-N 3.1Å; D1053-V1055 WeakPolarHBondContact OD1-CB 3.35Å; D1053-V1055 PolarHBondContact OD1-N 2.97Å; V1055-K1058 PolarHBondContact O-N 3.22Å; V1055-S1059 PolarHBondContact O-N 3.38Å; V1055-S1059 VanDerWaalsContact O-N 3.17Å; V1055-S1059 PolarHBondContact O-OG 2.94Å
1056	K	96.2	Very high	95.2	Very high	122 Å²	122	56.3 Å²	56.3	53%	0.53	32%	0.323	S	S	.	.	H	α-helix	trans	-71.6	-31.5	179.9	-62.9	174.2	-171.1	153.8	0	112.7	L1051 D1053 S1059 H1060	L1051-K1056 HydrophobicContact CD1-CB 3.57Å; D1053-K1056 HydrophobicContact CB-CB 4.2Å; D1053-K1056 HydrophobicContact CB-CD 3.98Å; D1053-K1056 HydrophobicContact CB-CG 4.17Å; D1053-K1056 PolarHBondContact O-N 2.8Å; D1053-K1056 VanDerWaalsContact O-N 3.07Å; D1053-K1056 VanDerWaalsContact OD2-CD 3.3Å; D1053-K1056 WeakPolarHBondContact OD2-CD 3.31Å; D1053-K1056 WeakPolarHBondContact OD2-CE 3.35Å; D1053-K1056 WeakPolarHBondContact OD2-CG 3.42Å; D1053-K1056 IonicContact OD2-NZ 2.79Å; D1053-K1056 PolarHBondContact OD2-NZ 3.24Å; K1056-S1059 WeakPolarHBondContact CA-OG 3.4Å; K1056-S1059 PolarHBondContact O-OG 2.79Å; K1056-H1060 PolarHBondContact O-N 3.26Å
1057	I	97.5	Very high	95.3	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.01	33%	0.333	C	S	.	.	H	α-helix	trans	-62.2	-49	171.2	-65.6	169.7	0	0	0	109.6	T816 W988 L1043 L1051 D1053 S1059 H1060 F1063	T816-I1057 HydrophobicContact CG2-CG2 3.86Å; W988-I1057 HydrophobicContact CD2-CD1 3.5Å; W988-I1057 VanDerWaalsContact CD2-CD1 3.5Å; W988-I1057 HydrophobicContact CE3-CD1 3.35Å; W988-I1057 HydrophobicContact CG-CD1 4.11Å; W988-I1057 HydrophobicContact CH2-CD1 4.14Å; W988-I1057 HydrophobicContact CZ2-CD1 4.28Å; W988-I1057 HydrophobicContact CZ3-CD1 3.68Å; L1043-I1057 HydrophobicContact CD2-CD1 4.36Å; L1051-I1057 HydrophobicContact CD2-CG1 3.99Å; L1051-I1057 HydrophobicContact CG-CG1 3.74Å; D1053-I1057 WeakPolarHBondContact O-CG1 3.31Å; D1053-I1057 PolarHBondContact O-N 3.03Å; I1057-S1059 VanDerWaalsContact C-N 3.3Å; I1057-S1059 PolarHBondContact O-N 3.17Å; I1057-H1060 WeakPolarHBondContact O-CB 3.39Å; I1057-H1060 PolarHBondContact O-N 2.98Å; I1057-H1060 VanDerWaalsContact O-N 3.09Å; I1057-F1063 HydrophobicContact CG2-CE2 3.86Å; I1057-F1063 HydrophobicContact CG2-CZ 4.27Å; I1057-F1063 WeakPolarHBondContact O-CD2 3.4Å; I1057-F1063 VanDerWaalsContact O-CE2 3.25Å; I1057-F1063 WeakPolarHBondContact O-CE2 3.34Å
1058	K	97.2	Very high	95.5	Very high	51 Å²	51	56.6 Å²	56.6	22%	0.222	33%	0.325	C	S	.	.	H	α-helix	trans	-62.5	-32.5	179.9	-71.1	-178	-171.5	-172.8	0	114.1	T816 Q820 P1054 V1055 H1060 W1068	T816-K1058 HydrophobicContact CG2-CG 4.17Å; Q820-K1058 VanDerWaalsContact OE1-CE 3.29Å; P1054-K1058 VanDerWaalsContact O-CG 3.25Å; P1054-K1058 WeakPolarHBondContact O-CG 3.42Å; P1054-K1058 PolarHBondContact O-N 3.2Å; P1054-K1058 VanDerWaalsContact O-N 3.1Å; V1055-K1058 PolarHBondContact O-N 3.22Å; K1058-H1060 VanDerWaalsContact C-N 3.28Å; K1058-H1060 PolarHBondContact O-N 3.24Å; K1058-W1068 HydrophobicContact CB-CD2 4.33Å; K1058-W1068 HydrophobicContact CB-CH2 4.36Å; K1058-W1068 HydrophobicContact CB-CZ2 3.77Å; K1058-W1068 HydrophobicContact CD-CD2 3.94Å; K1058-W1068 HydrophobicContact CD-CE3 4Å; K1058-W1068 HydrophobicContact CD-CG 4.41Å; K1058-W1068 HydrophobicContact CD-CZ3 4.3Å; K1058-W1068 HydrophobicContact CG-CD2 3.91Å; K1058-W1068 HydrophobicContact CG-CE3 4Å; K1058-W1068 HydrophobicContact CG-CH2 3.7Å; K1058-W1068 HydrophobicContact CG-CZ2 3.61Å; K1058-W1068 HydrophobicContact CG-CZ3 3.88Å; K1058-W1068 PolarHBondContact O-NE1 2.82Å
1059	S	96.7	Very high	95.5	Very high	90 Å²	90	59 Å²	59	63%	0.629	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	2.2	176.2	61.3	0	0	0	0	114.5	V1055 K1056 I1057	V1055-S1059 PolarHBondContact O-N 3.38Å; V1055-S1059 VanDerWaalsContact O-N 3.17Å; V1055-S1059 PolarHBondContact O-OG 2.94Å; K1056-S1059 WeakPolarHBondContact CA-OG 3.4Å; K1056-S1059 PolarHBondContact O-OG 2.79Å; I1057-S1059 VanDerWaalsContact C-N 3.3Å; I1057-S1059 PolarHBondContact O-N 3.17Å
1060	H	98.1	Very high	95.4	Very high	11 Å²	11	61.2 Å²	61.2	5%	0.051	34%	0.335	C	S	.	.	S	Bend	trans	-72.5	133.9	-179.6	-173.3	-81.6	0	0	0	111	D1035 N1038 L1039 Q1042 K1056 I1057 K1058 F1062 F1063	D1035-H1060 PolarHBondContact O-CE1 3.3Å; D1035-H1060 VanDerWaalsContact O-CE1 3.28Å; N1038-H1060 PolarHBondContact OD1-NE2 3.18Å; L1039-H1060 HydrophobicContact CD1-CB 4.36Å; Q1042-H1060 PolarHBondContact NE2-CD2 3.45Å; Q1042-H1060 VanDerWaalsContact NE2-CD2 3.35Å; Q1042-H1060 PolarHBondContact NE2-NE2 3.09Å; K1056-H1060 PolarHBondContact O-N 3.26Å; I1057-H1060 WeakPolarHBondContact O-CB 3.39Å; I1057-H1060 PolarHBondContact O-N 2.98Å; I1057-H1060 VanDerWaalsContact O-N 3.09Å; K1058-H1060 VanDerWaalsContact C-N 3.28Å; K1058-H1060 PolarHBondContact O-N 3.24Å; H1060-F1062 WeakPolarHBondContact ND1-CB 3.36Å; H1060-F1062 PolarHBondContact ND1-N 3.35Å; H1060-F1062 PolarHBondContact O-N 2.93Å; H1060-F1063 HydrophobicContact CB-CD2 4.13Å; H1060-F1063 HydrophobicContact CB-CE2 4.4Å; H1060-F1063 PolarHBondContact O-N 3.15Å
1061	P	97.3	Very high	95.3	Very high	69 Å²	69	60.8 Å²	60.8	45%	0.448	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-52.2	-29.2	-174.1	-31.2	36	0	0	0	115.9	D1035 F1063 E1064	D1035-P1061 HydrophobicContact CB-CB 4.48Å; P1061-F1063 PolarHBondContact O-N 2.97Å; P1061-E1064 VanDerWaalsContact O-CB 3.25Å; P1061-E1064 WeakPolarHBondContact O-CB 3.36Å; P1061-E1064 PolarHBondContact O-N 2.85Å
1062	F	97.3	Very high	95	Very high	1 Å²	1	62.6 Å²	62.6	0%	0.004	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-49.1	-31.9	170.5	178.6	-102.9	0	0	0	113.7	E805 R809 L995 D1035 A1036 L1039 H1060	E805-F1062 HydrophobicContact CG-CE2 3.88Å; R809-F1062 HydrophobicContact CB-CE1 4.08Å; R809-F1062 HydrophobicContact CB-CZ 3.91Å; R809-F1062 HydrophobicContact CG-CE1 4.36Å; R809-F1062 PolarHBondContact NE-O 2.89Å; R809-F1062 PolarHBondContact NH2-O 3.46Å; R809-F1062 VanDerWaalsContact NH2-O 3.17Å; L995-F1062 HydrophobicContact CD1-CE1 4.19Å; L995-F1062 HydrophobicContact CD1-CE2 4.36Å; L995-F1062 HydrophobicContact CD1-CZ 3.71Å; D1035-F1062 HydrophobicContact CB-CB 4.42Å; A1036-F1062 HydrophobicContact CB-CD2 3.79Å; A1036-F1062 HydrophobicContact CB-CE2 3.77Å; L1039-F1062 HydrophobicContact CB-CB 4.44Å; L1039-F1062 HydrophobicContact CD2-CB 3.98Å; L1039-F1062 HydrophobicContact CD2-CD1 3.39Å; L1039-F1062 HydrophobicContact CD2-CE1 4.05Å; L1039-F1062 HydrophobicContact CD2-CG 3.83Å; H1060-F1062 WeakPolarHBondContact ND1-CB 3.36Å; H1060-F1062 PolarHBondContact ND1-N 3.35Å; H1060-F1062 PolarHBondContact O-N 2.93Å
1063	F	97.7	Very high	94.8	Very high	3 Å²	3	67.8 Å²	67.8	1%	0.013	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-101	13.6	179.3	-52.6	-77.2	0	0	0	114.5	R809 I812 A813 L1039 I1057 H1060 P1061 S1065 V1066 W1068	R809-F1063 HydrophobicContact CG-CD1 4.46Å; I812-F1063 HydrophobicContact CB-CE1 4.44Å; I812-F1063 HydrophobicContact CG2-CE1 4Å; I812-F1063 HydrophobicContact CG2-CZ 3.87Å; A813-F1063 HydrophobicContact CB-CD1 4.13Å; A813-F1063 HydrophobicContact CB-CE1 4.18Å; L1039-F1063 HydrophobicContact CD1-CE2 4.46Å; L1039-F1063 HydrophobicContact CD2-CE2 3.61Å; L1039-F1063 HydrophobicContact CD2-CZ 3.67Å; I1057-F1063 HydrophobicContact CG2-CE2 3.86Å; I1057-F1063 HydrophobicContact CG2-CZ 4.27Å; I1057-F1063 WeakPolarHBondContact O-CD2 3.4Å; I1057-F1063 VanDerWaalsContact O-CE2 3.25Å; I1057-F1063 WeakPolarHBondContact O-CE2 3.34Å; H1060-F1063 HydrophobicContact CB-CD2 4.13Å; H1060-F1063 HydrophobicContact CB-CE2 4.4Å; H1060-F1063 PolarHBondContact O-N 3.15Å; P1061-F1063 PolarHBondContact O-N 2.97Å; F1063-S1065 PolarHBondContact O-N 3.39Å; F1063-V1066 HydrophobicContact CB-CB 4.25Å; F1063-V1066 HydrophobicContact CB-CG2 3.96Å; F1063-V1066 HydrophobicContact CD1-CG2 4.22Å; F1063-V1066 VanDerWaalsContact O-CB 3.29Å; F1063-V1066 WeakPolarHBondContact O-CB 3.5Å; F1063-V1066 WeakPolarHBondContact O-CG2 3.46Å; F1063-V1066 PolarHBondContact O-N 3.12Å; F1063-W1068 HydrophobicContact CB-CZ2 3.66Å; F1063-W1068 HydrophobicContact CD1-CH2 4.02Å; F1063-W1068 AromaticContact CD1-CZ2 3.95Å; F1063-W1068 HydrophobicContact CD1-CZ2 3.95Å; F1063-W1068 HydrophobicContact CD2-CZ2 4.14Å; F1063-W1068 HydrophobicContact CE1-CH2 4.27Å; F1063-W1068 HydrophobicContact CG-CH2 4.16Å; F1063-W1068 AromaticContact CG-CZ2 3.68Å; F1063-W1068 HydrophobicContact CG-CZ2 3.68Å
1064	E	94.5	Very high	94.6	Very high	179 Å²	179	69.3 Å²	69.3	84%	0.836	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-34.3	-178.5	-179.6	174.6	-151.3	0	0	113.4	P1061 V1066	P1061-E1064 VanDerWaalsContact O-CB 3.25Å; P1061-E1064 WeakPolarHBondContact O-CB 3.36Å; P1061-E1064 PolarHBondContact O-N 2.85Å; E1064-V1066 VanDerWaalsContact C-N 3.33Å; E1064-V1066 PolarHBondContact O-N 2.9Å
1065	S	93.5	Very high	94.6	Very high	93 Å²	93	73.3 Å²	73.3	65%	0.65	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	15.4	177.9	81.3	0	0	0	0	115.1	R809 F1063	R809-S1065 VanDerWaalsContact CD-OG 3.27Å; R809-S1065 WeakPolarHBondContact CD-OG 3.32Å; F1063-S1065 PolarHBondContact O-N 3.39Å
1066	V	94.3	Very high	94.5	Very high	18 Å²	18	69 Å²	69	11%	0.109	37%	0.369	C	S	.	.			trans	-106.2	111.5	-173.4	-179.6	0	0	0	0	111.6	R809 A813 F1063 E1064 W1068 L1071	R809-V1066 HydrophobicContact CG-CG2 3.78Å; A813-V1066 HydrophobicContact CB-CG1 3.91Å; A813-V1066 HydrophobicContact CB-CG2 4.35Å; F1063-V1066 HydrophobicContact CB-CB 4.25Å; F1063-V1066 HydrophobicContact CB-CG2 3.96Å; F1063-V1066 HydrophobicContact CD1-CG2 4.22Å; F1063-V1066 VanDerWaalsContact O-CB 3.29Å; F1063-V1066 WeakPolarHBondContact O-CB 3.5Å; F1063-V1066 WeakPolarHBondContact O-CG2 3.46Å; F1063-V1066 PolarHBondContact O-N 3.12Å; E1064-V1066 VanDerWaalsContact C-N 3.33Å; E1064-V1066 PolarHBondContact O-N 2.9Å; V1066-W1068 VanDerWaalsContact C-N 3.35Å; V1066-W1068 HydrophobicContact CB-CZ2 4.44Å; V1066-W1068 HydrophobicContact CG1-CD2 3.85Å; V1066-W1068 HydrophobicContact CG1-CE3 4.17Å; V1066-W1068 HydrophobicContact CG1-CG 4.23Å; V1066-W1068 HydrophobicContact CG1-CH2 4.48Å; V1066-W1068 HydrophobicContact CG1-CZ2 4.16Å; V1066-W1068 HydrophobicContact CG1-CZ3 4.49Å; V1066-W1068 VanDerWaalsContact O-CD1 3.3Å; V1066-W1068 PolarHBondContact O-N 3.21Å; V1066-L1071 HydrophobicContact CG1-CD1 4.38Å; V1066-L1071 HydrophobicContact CG1-CD2 4.34Å
1067	A	94.2	Very high	94.4	Very high	52 Å²	52	66.6 Å²	66.6	43%	0.43	37%	0.366	S	S	.	.			trans	-79.5	78.9	172.2	0	0	0	0	0	110.9	D1069 K1070 L1071	A1067-D1069 VanDerWaalsContact C-N 3.29Å; A1067-D1069 PolarHBondContact O-N 3.42Å; A1067-D1069 VanDerWaalsContact O-N 3.12Å; A1067-K1070 HydrophobicContact CB-CB 4.23Å; A1067-K1070 CarbonylContact O-C 3.57Å; A1067-K1070 PolarHBondContact O-N 2.97Å; A1067-L1071 PolarHBondContact O-N 2.97Å; A1067-L1071 VanDerWaalsContact O-N 3.11Å
1068	W	94.9	Very high	94.3	Very high	45 Å²	45	68.2 Å²	68.2	17%	0.17	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-47.9	-41.6	-172.5	-66.8	99.5	0	0	0	115.3	A813 T816 L817 K1058 F1063 V1066 K1070 L1071	A813-W1068 HydrophobicContact CB-CH2 3.69Å; A813-W1068 HydrophobicContact CB-CZ2 4.5Å; A813-W1068 HydrophobicContact CB-CZ3 3.73Å; A813-W1068 WeakPolarHBondContact O-CZ3 3.35Å; T816-W1068 HydrophobicContact CG2-CH2 4.24Å; T816-W1068 HydrophobicContact CG2-CZ3 4.28Å; L817-W1068 HydrophobicContact CD1-CE3 4.45Å; L817-W1068 HydrophobicContact CD2-CE3 3.85Å; L817-W1068 HydrophobicContact CD2-CZ3 4.18Å; L817-W1068 HydrophobicContact CG-CE3 4.11Å; L817-W1068 HydrophobicContact CG-CZ3 4.2Å; K1058-W1068 HydrophobicContact CB-CD2 4.33Å; K1058-W1068 HydrophobicContact CB-CH2 4.36Å; K1058-W1068 HydrophobicContact CB-CZ2 3.77Å; K1058-W1068 HydrophobicContact CD-CD2 3.94Å; K1058-W1068 HydrophobicContact CD-CE3 4Å; K1058-W1068 HydrophobicContact CD-CG 4.41Å; K1058-W1068 HydrophobicContact CD-CZ3 4.3Å; K1058-W1068 HydrophobicContact CG-CD2 3.91Å; K1058-W1068 HydrophobicContact CG-CE3 4Å; K1058-W1068 HydrophobicContact CG-CH2 3.7Å; K1058-W1068 HydrophobicContact CG-CZ2 3.61Å; K1058-W1068 HydrophobicContact CG-CZ3 3.88Å; K1058-W1068 PolarHBondContact O-NE1 2.82Å; F1063-W1068 HydrophobicContact CB-CZ2 3.66Å; F1063-W1068 HydrophobicContact CD1-CH2 4.02Å; F1063-W1068 AromaticContact CD1-CZ2 3.95Å; F1063-W1068 HydrophobicContact CD1-CZ2 3.95Å; F1063-W1068 HydrophobicContact CD2-CZ2 4.14Å; F1063-W1068 HydrophobicContact CE1-CH2 4.27Å; F1063-W1068 HydrophobicContact CG-CH2 4.16Å; F1063-W1068 AromaticContact CG-CZ2 3.68Å; F1063-W1068 HydrophobicContact CG-CZ2 3.68Å; V1066-W1068 VanDerWaalsContact C-N 3.35Å; V1066-W1068 HydrophobicContact CB-CZ2 4.44Å; V1066-W1068 HydrophobicContact CG1-CD2 3.85Å; V1066-W1068 HydrophobicContact CG1-CE3 4.17Å; V1066-W1068 HydrophobicContact CG1-CG 4.23Å; V1066-W1068 HydrophobicContact CG1-CH2 4.48Å; V1066-W1068 HydrophobicContact CG1-CZ2 4.16Å; V1066-W1068 HydrophobicContact CG1-CZ3 4.49Å; V1066-W1068 VanDerWaalsContact O-CD1 3.3Å; V1066-W1068 PolarHBondContact O-N 3.21Å; W1068-K1070 VanDerWaalsContact C-N 3.26Å; W1068-K1070 PolarHBondContact O-N 3.28Å; W1068-L1071 HydrophobicContact CE3-CD2 4.48Å
1069	D	91.9	Very high	94.2	Very high	158 Å²	158	69.1 Å²	69.1	85%	0.845	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-74.9	-12.3	-179.2	-56.4	-59.2	0	0	0	114.2	A1067 Q1073	A1067-D1069 VanDerWaalsContact C-N 3.29Å; A1067-D1069 PolarHBondContact O-N 3.42Å; A1067-D1069 VanDerWaalsContact O-N 3.12Å; D1069-Q1073 PolarHBondContact O-OE1 2.83Å
1070	K	91.9	Very high	94.1	Very high	149 Å²	149	65.1 Å²	65.1	65%	0.648	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-111.8	-4.5	179.3	-63.7	-175.8	179.4	-179.5	0	113.4	A1067 W1068 V1072 Q1073 Q1074	A1067-K1070 HydrophobicContact CB-CB 4.23Å; A1067-K1070 CarbonylContact O-C 3.57Å; A1067-K1070 PolarHBondContact O-N 2.97Å; W1068-K1070 VanDerWaalsContact C-N 3.26Å; W1068-K1070 PolarHBondContact O-N 3.28Å; K1070-V1072 VanDerWaalsContact C-N 3.26Å; K1070-V1072 PolarHBondContact O-N 3.31Å; K1070-Q1073 VanDerWaalsContact C-OE1 3.27Å; K1070-Q1073 VanDerWaalsContact CA-OE1 3.31Å; K1070-Q1073 CarbonylContact O-C 3.41Å; K1070-Q1073 PolarHBondContact O-N 3.09Å; K1070-Q1073 PolarHBondContact O-OE1 2.86Å; K1070-Q1074 PolarHBondContact O-N 3.43Å
1071	L	92.9	Very high	93.9	Very high	3 Å²	3	69.7 Å²	69.7	2%	0.016	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-35	-170.6	-173	64	0	0	0	112.7	F810 A813 E814 L817 V1066 A1067 W1068 Q1073	F810-L1071 HydrophobicContact CD2-CD1 3.7Å; F810-L1071 HydrophobicContact CE2-CD1 3.5Å; F810-L1071 VanDerWaalsContact CE2-CD1 3.5Å; F810-L1071 HydrophobicContact CE2-CG 4.46Å; F810-L1071 HydrophobicContact CZ-CD1 4.28Å; A813-L1071 HydrophobicContact CB-CD2 3.68Å; E814-L1071 HydrophobicContact CG-CD2 4.01Å; E814-L1071 HydrophobicContact CG-CG 4.19Å; L817-L1071 HydrophobicContact CD1-CB 4.44Å; L817-L1071 HydrophobicContact CD1-CD2 3.92Å; V1066-L1071 HydrophobicContact CG1-CD1 4.38Å; V1066-L1071 HydrophobicContact CG1-CD2 4.34Å; A1067-L1071 PolarHBondContact O-N 2.97Å; A1067-L1071 VanDerWaalsContact O-N 3.11Å; W1068-L1071 HydrophobicContact CE3-CD2 4.48Å; L1071-Q1073 VanDerWaalsContact C-N 3.29Å; L1071-Q1073 PolarHBondContact O-N 3.42Å
1072	V	90.2	Very high	93.7	Very high	56 Å²	56	67.6 Å²	67.6	34%	0.339	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-20	179.3	-174.9	0	0	0	0	112.4	W767 H844 K1070	W767-V1072 HydrophobicContact CH2-CG2 3.69Å; W767-V1072 HydrophobicContact CZ2-CG2 3.49Å; W767-V1072 VanDerWaalsContact CZ2-CG2 3.49Å; H844-V1072 PolarHBondContact CE1-O 2.9Å; K1070-V1072 VanDerWaalsContact C-N 3.26Å; K1070-V1072 PolarHBondContact O-N 3.31Å
1073	Q	91.4	Very high	93.4	Very high	141 Å²	141	77 Å²	77	66%	0.659	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-5.6	-179.8	-56.8	80.9	7.3	0	0	112.5	D1069 K1070 L1071	D1069-Q1073 PolarHBondContact O-OE1 2.83Å; K1070-Q1073 VanDerWaalsContact C-OE1 3.27Å; K1070-Q1073 VanDerWaalsContact CA-OE1 3.31Å; K1070-Q1073 CarbonylContact O-C 3.41Å; K1070-Q1073 PolarHBondContact O-N 3.09Å; K1070-Q1073 PolarHBondContact O-OE1 2.86Å; L1071-Q1073 VanDerWaalsContact C-N 3.29Å; L1071-Q1073 PolarHBondContact O-N 3.42Å
1074	Q	90.8	Very high	93.1	Very high	86 Å²	86	80.6 Å²	80.6	40%	0.402	42%	0.422	S	S	.	.	S	Bend	trans	-84.1	127.8	177.3	179.3	-172.8	-36.5	0	0	110	H844 K1070 P1076	H844-Q1074 PolarHBondContact CE1-O 3.16Å; K1070-Q1074 PolarHBondContact O-N 3.43Å; Q1074-P1076 VanDerWaalsContact O-CD 3.31Å; Q1074-P1076 WeakPolarHBondContact O-CD 3.45Å
1075	T	93	Very high	92.9	Very high	111 Å²	111	77.8 Å²	77.8	68%	0.681	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-52.7	121.9	171.7	-48	0	0	0	0	111.3	V1079	T1075-V1079 HydrophobicContact CG2-CG2 4.24Å
1076	P	94	Very high	92.8	Very high	8 Å²	8	76.4 Å²	76.4	5%	0.052	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-60.1	146.8	179.8	-29.4	38.2	0	0	0	113.6	F810 E842 G843 Q1074 Y1078	F810-P1076 HydrophobicContact CE1-CB 3.72Å; F810-P1076 HydrophobicContact CE1-CG 4.04Å; F810-P1076 HydrophobicContact CZ-CB 3.83Å; F810-P1076 HydrophobicContact CZ-CG 3.84Å; E842-P1076 VanDerWaalsContact O-CD 3.3Å; E842-P1076 WeakPolarHBondContact O-CD 3.31Å; E842-P1076 WeakPolarHBondContact O-CG 3.46Å; G843-P1076 VanDerWaalsContact C-CG 3.43Å; Q1074-P1076 VanDerWaalsContact O-CD 3.31Å; Q1074-P1076 WeakPolarHBondContact O-CD 3.45Å; P1076-Y1078 PolarHBondContact O-N 3.49Å; P1076-Y1078 VanDerWaalsContact O-N 3.09Å
1077	P	93.7	Very high	92.7	Very high	73 Å²	73	76.1 Å²	76.1	47%	0.474	39%	0.392	S	S	.	.	S	Bend	trans	-66.4	-8.5	175.6	-19.4	32	0	0	0	114.4	L807 F810	L807-P1077 HydrophobicContact CD1-CB 3.96Å; F810-P1077 HydrophobicContact CB-CG 3.93Å; F810-P1077 HydrophobicContact CD1-CG 4.49Å; F810-P1077 HydrophobicContact CD2-CG 4.09Å; F810-P1077 HydrophobicContact CG-CG 3.92Å
1078	Y	94.2	Very high	92.6	Very high	35 Å²	35	74.3 Å²	74.3	14%	0.137	38%	0.376	C	S	.	.			trans	-136.6	117.5	168.3	172.8	-108.8	0	0	0	109.7	L796 Y811 G843 P1076 P1080	L796-Y1078 HydrophobicContact CD1-CD1 3.8Å; L796-Y1078 HydrophobicContact CD1-CD2 4.45Å; L796-Y1078 HydrophobicContact CD1-CE1 3.5Å; L796-Y1078 VanDerWaalsContact CD1-CE1 3.5Å; L796-Y1078 HydrophobicContact CD1-CE2 4.22Å; L796-Y1078 HydrophobicContact CD1-CG 4.26Å; L796-Y1078 HydrophobicContact CD2-CD1 3.45Å; L796-Y1078 VanDerWaalsContact CD2-CD1 3.45Å; L796-Y1078 HydrophobicContact CD2-CE1 3.79Å; L796-Y1078 HydrophobicContact CD2-CG 4.2Å; L796-Y1078 HydrophobicContact CG-CD1 4.29Å; L796-Y1078 HydrophobicContact CG-CE1 4.25Å; Y811-Y1078 PolarHBondContact OH-O 3.16Å; G843-Y1078 WeakPolarHBondContact CA-O 3.27Å; P1076-Y1078 PolarHBondContact O-N 3.49Å; P1076-Y1078 VanDerWaalsContact O-N 3.09Å; Y1078-P1080 HydrophobicContact CE1-CB 4.23Å
1079	V	95.4	Very high	92.3	Very high	70 Å²	70	75.3 Å²	75.3	42%	0.424	39%	0.389	S	S	.	.			trans	-106.8	126.1	171.3	-173.7	0	0	0	0	107.8	R841 T1075	R841-V1079 WeakPolarHBondContact O-CG1 3.29Å; T1075-V1079 HydrophobicContact CG2-CG2 4.24Å
1080	P	93.9	Very high	92.3	Very high	7 Å²	7	68.6 Å²	68.6	5%	0.045	35%	0.354	C	S	.	.			trans	-70.7	135.5	-179.7	26.8	-32.6	0	0	0	111.7	I839 N840 Y1078 I1082	I839-P1080 HydrophobicContact CG2-CG 4.29Å; N840-P1080 WeakPolarHBondContact O-CG 3.23Å; Y1078-P1080 HydrophobicContact CE1-CB 4.23Å; P1080-I1082 HydrophobicContact CB-CD1 4.23Å; P1080-I1082 HydrophobicContact CB-CG1 4.49Å; P1080-I1082 HydrophobicContact CG-CD1 3.87Å; P1080-I1082 PolarHBondContact O-N 2.9Å
1081	T	93.9	Very high	92.1	Very high	106 Å²	106	63.4 Å²	63.4	65%	0.65	33%	0.331	S	S	*	.			trans	-71.3	120.6	171.8	-43.6	0	0	0	0	109.1	N1090	T1081-N1090 PolarHBondContact O-ND2 2.86Å
1082	I	93.3	Very high	91.4	Very high	26 Å²	26	66.8 Å²	66.8	13%	0.133	35%	0.349	C	S	.	.			trans	-134.3	113.8	-177.9	-69.8	155	0	0	0	107.1	P789 R841 P1080 D1084 D1087	P789-I1082 HydrophobicContact CB-CD1 3.78Å; P789-I1082 HydrophobicContact CB-CG1 4.15Å; P789-I1082 HydrophobicContact CB-CG2 4.38Å; P789-I1082 HydrophobicContact CG-CD1 3.61Å; P789-I1082 HydrophobicContact CG-CG1 4.49Å; R841-I1082 HydrophobicContact CB-CD1 3.9Å; R841-I1082 HydrophobicContact CG-CD1 3.83Å; P1080-I1082 HydrophobicContact CB-CD1 4.23Å; P1080-I1082 HydrophobicContact CB-CG1 4.49Å; P1080-I1082 HydrophobicContact CG-CD1 3.87Å; P1080-I1082 PolarHBondContact O-N 2.9Å; I1082-D1084 WeakPolarHBondContact CG2-O 3.17Å; I1082-D1087 HydrophobicContact CG2-CB 4.26Å
1083	R	92.3	Very high	91	Very high	199 Å²	199	68.2 Å²	68.2	75%	0.751	36%	0.36	S	S	*	.			trans	-73.1	-43.8	-173.7	-60.4	163.9	-161.9	-155.8	1.2	112.3	D1087	R1083-D1087 HydrophobicContact CB-CB 4.33Å; R1083-D1087 WeakPolarHBondContact CB-OD2 3.13Å; R1083-D1087 WeakPolarHBondContact CD-OD2 3.31Å; R1083-D1087 WeakPolarHBondContact CG-OD2 3.37Å; R1083-D1087 PolarHBondContact N-OD2 3.49Å; R1083-D1087 IonicContact NE-OD2 3.13Å
1084	D	91.7	Very high	90.3	Very high	78 Å²	78	63.7 Å²	63.7	42%	0.417	34%	0.341	S	S	.	.	S	Bend	trans	-156	176.3	-173.6	67	85.9	0	0	0	110.3	I1082 L1086 D1087	I1082-D1084 WeakPolarHBondContact CG2-O 3.17Å; D1084-L1086 PolarHBondContact O-N 2.87Å; D1084-L1086 VanDerWaalsContact OD1-CA 3.31Å; D1084-L1086 WeakPolarHBondContact OD1-CA 3.09Å; D1084-L1086 WeakPolarHBondContact OD1-CB 3.16Å; D1084-L1086 PolarHBondContact OD1-N 2.66Å; D1084-D1087 WeakPolarHBondContact O-CB 3.47Å; D1084-D1087 PolarHBondContact O-N 3.26Å; D1084-D1087 PolarHBondContact OD1-N 3.28Å
1085	E	89.9	Confident	89.2	Confident	119 Å²	119	63.6 Å²	63.6	56%	0.556	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-21.7	-176.6	-52.6	-172.7	147.5	0	0	114.4	R726 L733	R726-E1085 IonicContact NH2-OE2 2.7Å; R726-E1085 PolarHBondContact NH2-OE2 2.94Å; L733-E1085 HydrophobicContact CD1-CB 3.55Å; L733-E1085 WeakPolarHBondContact CD1-O 3.4Å
1086	L	91.8	Very high	87.7	Confident	65 Å²	65	61.5 Å²	61.5	34%	0.34	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	0.3	179.5	-51.1	-178.9	0	0	0	112	I711 L724 L733 D1084 T1088	I711-L1086 HydrophobicContact CD1-CD2 3.83Å; I711-L1086 HydrophobicContact CG2-CD2 4.45Å; L724-L1086 HydrophobicContact CD2-CD2 4.25Å; L733-L1086 HydrophobicContact CD1-CD2 3.74Å; L733-L1086 HydrophobicContact CD2-CD2 3.68Å; L733-L1086 HydrophobicContact CG-CD2 4.37Å; D1084-L1086 PolarHBondContact O-N 2.87Å; D1084-L1086 VanDerWaalsContact OD1-CA 3.31Å; D1084-L1086 WeakPolarHBondContact OD1-CA 3.09Å; D1084-L1086 WeakPolarHBondContact OD1-CB 3.16Å; D1084-L1086 PolarHBondContact OD1-N 2.66Å; L1086-T1088 PolarHBondContact O-N 3.45Å; L1086-T1088 PolarHBondContact O-OG1 2.87Å
1087	D	91.7	Very high	85.5	Confident	11 Å²	11	68.4 Å²	68.4	6%	0.059	36%	0.36	C	S	.	.			trans	-59.6	126.3	175.3	-167	-8.8	0	0	0	109.4	Y787 I1082 R1083 D1084 S1089	Y787-D1087 PolarHBondContact OH-O 2.77Å; I1082-D1087 HydrophobicContact CG2-CB 4.26Å; R1083-D1087 HydrophobicContact CB-CB 4.33Å; R1083-D1087 WeakPolarHBondContact CB-OD2 3.13Å; R1083-D1087 WeakPolarHBondContact CD-OD2 3.31Å; R1083-D1087 WeakPolarHBondContact CG-OD2 3.37Å; R1083-D1087 PolarHBondContact N-OD2 3.49Å; R1083-D1087 IonicContact NE-OD2 3.13Å; D1084-D1087 WeakPolarHBondContact O-CB 3.47Å; D1084-D1087 PolarHBondContact O-N 3.26Å; D1084-D1087 PolarHBondContact OD1-N 3.28Å; D1087-S1089 WeakPolarHBondContact OD1-CB 3.35Å; D1087-S1089 PolarHBondContact OD1-N 3.35Å; D1087-S1089 PolarHBondContact OD1-OG 2.89Å; D1087-S1089 PolarHBondContact OD2-OG 2.99Å
1088	T	91.1	Very high	83.3	Confident	14 Å²	14	73.7 Å²	73.7	9%	0.086	37%	0.371	C	S	.	.			trans	-136.9	23.2	-173.7	39.8	0	0	0	0	109.7	K712 L714 L724 Y787 L1086 N1090 F1091	K712-T1088 HydrophobicContact CD-CG2 4.22Å; K712-T1088 WeakPolarHBondContact CD-OG1 3.4Å; K712-T1088 PolarHBondContact NZ-OG1 3.37Å; L714-T1088 HydrophobicContact CD2-CG2 3.52Å; L724-T1088 HydrophobicContact CD2-CG2 4.06Å; Y787-T1088 WeakPolarHBondContact OH-CG2 3.36Å; L1086-T1088 PolarHBondContact O-N 3.45Å; L1086-T1088 PolarHBondContact O-OG1 2.87Å; T1088-N1090 VanDerWaalsContact C-N 3.27Å; T1088-N1090 PolarHBondContact O-N 3.45Å; T1088-F1091 HydrophobicContact CG2-CD2 4.3Å; T1088-F1091 PolarHBondContact O-N 3.33Å
1089	S	89.9	Confident	81	Confident	66 Å²	66	74.3 Å²	74.3	46%	0.462	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-10.8	178	60.5	0	0	0	0	113.9	D1087 F1091	D1087-S1089 WeakPolarHBondContact OD1-CB 3.35Å; D1087-S1089 PolarHBondContact OD1-N 3.35Å; D1087-S1089 PolarHBondContact OD1-OG 2.89Å; D1087-S1089 PolarHBondContact OD2-OG 2.99Å; S1089-F1091 VanDerWaalsContact C-N 3.33Å
1090	N	90.6	Very high	78.3	Confident	18 Å²	18	76.9 Å²	76.9	10%	0.096	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	4.4	169	-55.6	-58.3	0	0	0	113.1	P789 G790 G791 T1081 T1088	P789-N1090 PolarHBondContact O-ND2 3.28Å; P789-N1090 VanDerWaalsContact O-ND2 3.12Å; G790-N1090 WeakPolarHBondContact O-CB 3.47Å; G791-N1090 WeakPolarHBondContact CA-O 3.47Å; T1081-N1090 PolarHBondContact O-ND2 2.86Å; T1088-N1090 VanDerWaalsContact C-N 3.27Å; T1088-N1090 PolarHBondContact O-N 3.45Å
1091	F	87.4	Confident	75.8	Confident	39 Å²	39	85.3 Å²	85.3	17%	0.171	42%	0.421	C	S	.	.	S	Bend	trans	-109.2	144.8	174.2	-67.5	-97.6	0	0	0	110.8	L714 Y787 I788 T1088 S1089	L714-F1091 HydrophobicContact CB-CD1 4.19Å; L714-F1091 HydrophobicContact CB-CE1 4.26Å; L714-F1091 HydrophobicContact CD1-CE1 4.4Å; L714-F1091 HydrophobicContact CD1-CZ 4.43Å; L714-F1091 HydrophobicContact CD2-CD1 4.15Å; L714-F1091 HydrophobicContact CD2-CD2 4.13Å; L714-F1091 HydrophobicContact CD2-CE1 4.2Å; L714-F1091 HydrophobicContact CD2-CE2 4.18Å; L714-F1091 HydrophobicContact CD2-CG 4.11Å; L714-F1091 HydrophobicContact CD2-CZ 4.21Å; Y787-F1091 AromaticContact CE2-CE2 3.79Å; Y787-F1091 HydrophobicContact CE2-CE2 3.79Å; Y787-F1091 AromaticContact CE2-CZ 3.77Å; Y787-F1091 HydrophobicContact CE2-CZ 3.77Å; Y787-F1091 WeakPolarHBondContact OH-CE2 3.38Å; I788-F1091 VanDerWaalsContact O-CZ 3.28Å; I788-F1091 WeakPolarHBondContact O-CZ 3.41Å; T1088-F1091 HydrophobicContact CG2-CD2 4.3Å; T1088-F1091 PolarHBondContact O-N 3.33Å; S1089-F1091 VanDerWaalsContact C-N 3.33Å
1092	D	80.1	Confident	73.1	Confident	75 Å²	75	84.8 Å²	84.8	40%	0.401	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-63.2	135	175.6	-137.7	38.6	0	0	0	110.6	R960 V1094	R960-D1092 IonicContact CZ-OD2 3.44Å; R960-D1092 IonicContact NE-OD2 3.4Å; R960-D1092 IonicContact NH2-OD2 3.16Å; R960-D1092 PolarHBondContact NH2-OD2 3.15Å; D1092-V1094 PolarHBondContact O-N 3.12Å
1093	P	81.1	Confident	70.5	Confident	86 Å²	86	88.5 Å²	88.5	56%	0.558	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-68.3	126.9	179.7	27.1	-33.4	0	0	0	110.6	R960	R960-P1093 PolarHBondContact NH1-O 3.47Å; R960-P1093 PolarHBondContact NH2-O 3.14Å
1094	V	76.2	Confident	67.7	Low	45 Å²	45	82.1 Å²	82.1	27%	0.273	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-94.8	126	-177.8	-168.3	0	0	0	0	110.8	H713 V716 D1092 D1096	H713-V1094 WeakPolarHBondContact ND1-CG1 3.21Å; V716-V1094 HydrophobicContact CG2-CG1 4.12Å; D1092-V1094 PolarHBondContact O-N 3.12Å; V1094-D1096 PolarHBondContact O-N 2.56Å
1095	D	68.4	Low	64.7	Low	85 Å²	85	85.8 Å²	85.8	46%	0.455	47%	0.465	S	S	.	.			trans	-77.7	83.8	-176.9	-42.9	-46.3	0	0	0	111.2	R960 E1097	R960-D1095 IonicContact CZ-OD2 3.93Å; R960-D1095 IonicContact NH1-OD1 3.75Å; R960-D1095 PolarHBondContact NH1-OD1 3.41Å; R960-D1095 IonicContact NH1-OD2 2.74Å; R960-D1095 PolarHBondContact NH1-OD2 3.04Å; D1095-E1097 PolarHBondContact O-N 2.94Å
1096	D	60.7	Low	62	Low	66 Å²	66	87.4 Å²	87.4	35%	0.353	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-20.5	-174.5	-87.1	-28.6	0	0	0	114.5	H713 V1094 R1098 T1099	H713-D1096 IonicContact CE1-OD1 3.38Å; H713-D1096 IonicContact CG-OD1 2.7Å; H713-D1096 IonicContact ND1-OD1 3.36Å; H713-D1096 PolarHBondContact ND1-OD1 3Å; V1094-D1096 PolarHBondContact O-N 2.56Å; D1096-R1098 VanDerWaalsContact C-N 3.31Å; D1096-R1098 PolarHBondContact O-N 3.23Å; D1096-T1099 WeakPolarHBondContact O-CA 3.49Å; D1096-T1099 WeakPolarHBondContact O-CB 3.26Å; D1096-T1099 PolarHBondContact O-N 3.13Å
1097	E	48.7	Very low	59.2	Low	153 Å²	153	92.3 Å²	92.3	72%	0.715	50%	0.498	S	S	*	.	H	α-helix	trans	-57.9	-38.9	-178.4	-62.9	-163.5	137.9	0	0	113.4	D1095 T1099 L1100 Y1101	D1095-E1097 PolarHBondContact O-N 2.94Å; E1097-T1099 PolarHBondContact O-N 2.79Å; E1097-T1099 VanDerWaalsContact O-N 3.14Å; E1097-L1100 PolarHBondContact O-N 3.11Å; E1097-Y1101 WeakPolarHBondContact O-CD2 3.45Å
1098	R	47.2	Very low	56.3	Low	185 Å²	185	97.2 Å²	97.2	70%	0.698	53%	0.534	S	S	*	.	H	α-helix	trans	-63.4	-19.3	176.2	-71	-175.2	176.4	-175.2	-0.5	112.8	D1096 S1102	D1096-R1098 VanDerWaalsContact C-N 3.31Å; D1096-R1098 PolarHBondContact O-N 3.23Å; R1098-S1102 PolarHBondContact O-OG 2.93Å
1099	T	46.1	Very low	53.4	Low	48 Å²	48	103.4 Å²	103.4	29%	0.294	57%	0.566	S	S	.	*	H	α-helix	trans	-79.8	-36.6	176.9	-65.4	0	0	0	0	112.8	K721 D1096 E1097 S1103	K721-T1099 PolarHBondContact NZ-OG1 3.2Å; D1096-T1099 WeakPolarHBondContact O-CA 3.49Å; D1096-T1099 WeakPolarHBondContact O-CB 3.26Å; D1096-T1099 PolarHBondContact O-N 3.13Å; E1097-T1099 PolarHBondContact O-N 2.79Å; E1097-T1099 VanDerWaalsContact O-N 3.14Å; T1099-S1103 PolarHBondContact O-OG 3.36Å
1100	L	39	Very low	50.4	Low	123 Å²	123	106.5 Å²	106.5	64%	0.644	58%	0.577	S	S	*	*	H	α-helix	trans	-71.3	-46.1	-170.4	-75.8	162.2	0	0	0	111.5	E1097 S1102 S1103	E1097-L1100 PolarHBondContact O-N 3.11Å; L1100-S1102 PolarHBondContact O-N 2.9Å; L1100-S1103 PolarHBondContact O-N 2.81Å
1101	Y	40.4	Very low	47.6	Very low	185 Å²	185	113.8 Å²	113.8	73%	0.725	60%	0.604	S	S	*	*	H	α-helix	trans	-70.9	-31.5	-177.7	-66.2	-73.1	0	0	0	113.9	E1097 S1103 G1104	E1097-Y1101 WeakPolarHBondContact O-CD2 3.45Å; Y1101-S1103 PolarHBondContact O-N 3.03Å; Y1101-G1104 PolarHBondContact O-N 2.92Å
1102	S	36.7	Very low	44.7	Very low	95 Å²	95	115.7 Å²	115.7	66%	0.664	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-12	173.3	-59.5	0	0	0	0	114.2	R1098 L1100	R1098-S1102 PolarHBondContact O-OG 2.93Å; L1100-S1102 PolarHBondContact O-N 2.9Å
1103	S	39.6	Very low	42.2	Very low	104 Å²	104	117.8 Å²	117.8	73%	0.727	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-9.4	176.9	-54.9	0	0	0	0	113.5	T1099 L1100 Y1101	T1099-S1103 PolarHBondContact O-OG 3.36Å; L1100-S1103 PolarHBondContact O-N 2.81Å; Y1101-S1103 PolarHBondContact O-N 3.03Å
1104	G	33.2	Very low	39.9	Very low	64 Å²	64	119 Å²	119	66%	0.66	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	-11.8	-171.1	0	0	0	0	0	116.4	Y1101	Y1101-G1104 PolarHBondContact O-N 2.92Å
1105	N	29.2	Very low	37.8	Very low	156 Å²	156	123.8 Å²	123.8	83%	0.834	67%	0.673	S	S	*	*			trans	-137	31.1	-164.8	-129.5	15.7	0	0	0	115.2
1106	N	33.2	Very low	36.1	Very low	153 Å²	153	126.4 Å²	126.4	82%	0.818	69%	0.687	S	S	*	*	S	Bend	trans	-97.8	128.4	160.6	-99.8	-48.3	0	0	0	109.2
1107	H	33	Very low	35.3	Very low	167 Å²	167	127.7 Å²	127.7	77%	0.773	70%	0.698	S	S	*	*			trans	-51.7	153.5	-175.6	-115.3	-106.3	0	0	0	113.5	L1109	H1107-L1109 PolarHBondContact O-N 2.74Å
1108	S	29.9	Very low	35.5	Very low	115 Å²	115	127.3 Å²	127.3	80%	0.804	70%	0.696	S	S	*	*			trans	-67.4	71.8	159.9	57	0	0	0	0	110.6	D1110	S1108-D1110 PolarHBondContact O-N 3.49Å
1109	L	30.9	Very low	36	Very low	144 Å²	144	121.1 Å²	121.1	75%	0.754	68%	0.676	S	S	*	*			trans	-69.9	103.1	157	-77.3	173.7	0	0	0	106.8	H1107 Y1111	H1107-L1109 PolarHBondContact O-N 2.74Å; L1109-Y1111 PolarHBondContact O-N 3.19Å
1110	D	27.1	Very low	36.4	Very low	131 Å²	131	121.2 Å²	121.2	70%	0.701	68%	0.678	S	S	*	*			trans	-53	126.4	174.8	179.5	30.9	0	0	0	109.6	S1108 S1112	S1108-D1110 PolarHBondContact O-N 3.49Å; D1110-S1112 VanDerWaalsContact CG-OG 3.25Å; D1110-S1112 PolarHBondContact O-N 2.62Å; D1110-S1112 WeakPolarHBondContact OD2-CB 3.44Å; D1110-S1112 PolarHBondContact OD2-OG 2.99Å
1111	Y	31.3	Very low	37.7	Very low	170 Å²	170	115.9 Å²	115.9	67%	0.667	65%	0.649	S	S	*	*			trans	-90	40.3	-170.5	-124.9	-90	0	0	0	111.4	L1109 S1113	L1109-Y1111 PolarHBondContact O-N 3.19Å; Y1111-S1113 PolarHBondContact O-N 2.76Å
1112	S	27.7	Very low	38.9	Very low	80 Å²	80	108.5 Å²	108.5	56%	0.559	62%	0.624	S	S	*	*			trans	-69	110.3	179.6	21.3	0	0	0	0	110.5	D1110	D1110-S1112 VanDerWaalsContact CG-OG 3.25Å; D1110-S1112 PolarHBondContact O-N 2.62Å; D1110-S1112 WeakPolarHBondContact OD2-CB 3.44Å; D1110-S1112 PolarHBondContact OD2-OG 2.99Å
1113	S	27.4	Very low	40.3	Very low	119 Å²	119	106.2 Å²	106.2	83%	0.832	60%	0.604	S	S	*	*	S	Bend	trans	66.5	51.4	157.3	-58.7	0	0	0	0	119.5	Y1111	Y1111-S1113 PolarHBondContact O-N 2.76Å
1114	T	31.2	Very low	42.2	Very low	110 Å²	110	101.3 Å²	101.3	68%	0.675	57%	0.57	S	S	*	*	S	Bend	trans	-137.6	122.3	142.3	45.1	0	0	0	0	114.2	N1116	T1114-N1116 PolarHBondContact O-N 3.39Å
1115	N	32.8	Very low	44.5	Very low	146 Å²	146	102.1 Å²	102.1	78%	0.781	56%	0.562	S	S	*	*			trans	38.6	65.1	155.1	-68.9	-13.9	0	0	0	118.3	T1117	N1115-T1117 PolarHBondContact O-OG1 3.01Å; N1115-T1117 PolarHBondContact O-N 2.99Å
1116	N	33.8	Very low	46.9	Very low	140 Å²	140	97 Å²	97	75%	0.749	53%	0.533	S	S	*	.			trans	-71.1	63.7	163.1	-166.6	-9	0	0	0	111.3	K635 T1114	K635-N1116 PolarHBondContact NZ-O 3.07Å; T1114-N1116 PolarHBondContact O-N 3.39Å
1117	T	42.2	Very low	49	Very low	94 Å²	94	91 Å²	91	58%	0.577	50%	0.499	S	S	*	.			trans	-88.5	114.1	-178.8	-30.9	0	0	0	0	107.5	N1115 L1119	N1115-T1117 PolarHBondContact O-OG1 3.01Å; N1115-T1117 PolarHBondContact O-N 2.99Å; T1117-L1119 PolarHBondContact O-N 2.73Å
1118	Q	53.9	Low	51.1	Low	144 Å²	144	84.3 Å²	84.3	67%	0.673	47%	0.467	S	S	*	.			trans	-70.1	95.4	179.5	-175.9	175.7	14	0	0	108.6	P1120	Q1118-P1120 VanDerWaalsContact O-CD 3.24Å; Q1118-P1120 WeakPolarHBondContact O-CD 3.3Å
1119	L	57.3	Low	52.6	Low	55 Å²	55	81.1 Å²	81.1	29%	0.288	44%	0.439	S	S	.	.			trans	-49	110.7	-175.4	-72.7	164.3	0	0	0	110.2	V745 F869 T1117 F1121	V745-L1119 HydrophobicContact CB-CD1 4.46Å; V745-L1119 HydrophobicContact CG1-CD2 4.41Å; V745-L1119 HydrophobicContact CG2-CD1 4.08Å; V745-L1119 HydrophobicContact CG2-CD2 4.36Å; F869-L1119 HydrophobicContact CE1-CD2 4.29Å; T1117-L1119 PolarHBondContact O-N 2.73Å; L1119-F1121 HydrophobicContact CB-CE2 4.29Å; L1119-F1121 WeakPolarHBondContact O-CD2 3.28Å; L1119-F1121 PolarHBondContact O-N 3.14Å
1120	P	55.5	Low	53.6	Low	51 Å²	51	80.9 Å²	80.9	33%	0.331	43%	0.432	S	S	.	.			trans	-75.8	115.1	-173	28.8	-34.6	0	0	0	110	V641 F869 Q1118 P1122	V641-P1120 HydrophobicContact CG1-CG 4.43Å; F869-P1120 HydrophobicContact CE1-CG 4.2Å; F869-P1120 HydrophobicContact CZ-CG 4.17Å; Q1118-P1120 VanDerWaalsContact O-CD 3.24Å; Q1118-P1120 WeakPolarHBondContact O-CD 3.3Å; P1120-P1122 WeakPolarHBondContact O-CD 3.25Å
1121	F	66.4	Low	54.8	Low	10 Å²	10	77.3 Å²	77.3	4%	0.044	41%	0.413	C	S	.	.			trans	-102.6	76.5	161	-71.3	-95.2	0	0	0	107.4	K741 V744 V745 L750 Q776 L781 L1119 F1124	K741-F1121 HydrophobicContact CB-CE2 3.92Å; K741-F1121 HydrophobicContact CD-CD2 4.05Å; K741-F1121 HydrophobicContact CD-CE2 4Å; K741-F1121 HydrophobicContact CG-CD2 4.11Å; K741-F1121 HydrophobicContact CG-CE2 3.66Å; K741-F1121 HydrophobicContact CG-CZ 4.38Å; V744-F1121 HydrophobicContact CB-CZ 4.37Å; V744-F1121 HydrophobicContact CG1-CE1 3.79Å; V744-F1121 HydrophobicContact CG1-CZ 3.89Å; V745-F1121 HydrophobicContact CG2-CE2 4.16Å; V745-F1121 HydrophobicContact CG2-CZ 3.77Å; L750-F1121 HydrophobicContact CB-CE1 4.47Å; L750-F1121 HydrophobicContact CD2-CD1 4.42Å; L750-F1121 HydrophobicContact CD2-CE1 3.92Å; L750-F1121 HydrophobicContact CD2-CZ 4.34Å; L750-F1121 HydrophobicContact CG-CE1 3.82Å; L750-F1121 HydrophobicContact CG-CZ 4.31Å; Q776-F1121 PolarHBondContact NE2-O 2.86Å; L781-F1121 HydrophobicContact CD1-CD1 3.71Å; L781-F1121 HydrophobicContact CD1-CE1 3.67Å; L781-F1121 HydrophobicContact CD1-CG 4.17Å; L781-F1121 HydrophobicContact CD1-CZ 4.09Å; L781-F1121 HydrophobicContact CD2-CB 3.96Å; L781-F1121 HydrophobicContact CD2-CD1 4.19Å; L781-F1121 HydrophobicContact CD2-CD2 4.04Å; L781-F1121 HydrophobicContact CD2-CG 3.81Å; L1119-F1121 HydrophobicContact CB-CE2 4.29Å; L1119-F1121 WeakPolarHBondContact O-CD2 3.28Å; L1119-F1121 PolarHBondContact O-N 3.14Å; F1121-F1124 HydrophobicContact CB-CB 4.19Å
1122	P	63.7	Low	55.4	Low	31 Å²	31	77.5 Å²	77.5	20%	0.201	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	141.6	-177.7	28.8	-35.5	0	0	0	109.5	F645 W865 P1120 F1124	F645-P1122 HydrophobicContact CD2-CB 4.32Å; W865-P1122 HydrophobicContact CH2-CG 4.33Å; W865-P1122 HydrophobicContact CZ3-CG 4.21Å; P1120-P1122 WeakPolarHBondContact O-CD 3.25Å; P1122-F1124 PolarHBondContact O-N 3.15Å
1123	N	68	Low	55.8	Low	46 Å²	46	78.5 Å²	78.5	25%	0.246	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	15.6	172.2	-51	-39.9	0	0	0	115.8	Q648 T1125	Q648-N1123 PolarHBondContact NE2-ND2 2.8Å; Q648-N1123 PolarHBondContact OE1-ND2 3.48Å; N1123-T1125 PolarHBondContact O-N 2.86Å
1124	F	79.5	Confident	55.9	Low	1 Å²	1	77.8 Å²	77.8	0%	0.004	40%	0.404	C	S	.	.			trans	-67	-23.6	168.4	-175.8	-93.7	0	0	0	113	V753 R757 S774 F775 Q776 L781 L783 F1121 P1122 F1126	V753-F1124 HydrophobicContact CG1-CD2 4.26Å; V753-F1124 HydrophobicContact CG1-CE2 3.62Å; V753-F1124 HydrophobicContact CG1-CZ 4.47Å; R757-F1124 HydrophobicContact CB-CD2 4.23Å; R757-F1124 HydrophobicContact CB-CE2 3.9Å; R757-F1124 WeakPolarHBondContact CD-O 3.26Å; R757-F1124 HydrophobicContact CG-CD2 4Å; R757-F1124 HydrophobicContact CG-CE2 3.9Å; R757-F1124 HydrophobicContact CG-CZ 4.47Å; S774-F1124 WeakPolarHBondContact CB-O 3.41Å; S774-F1124 PolarHBondContact OG-O 3.22Å; F775-F1124 VanDerWaalsContact O-CE1 3.3Å; F775-F1124 WeakPolarHBondContact O-CE1 3.43Å; Q776-F1124 HydrophobicContact CB-CD1 4.47Å; L781-F1124 HydrophobicContact CB-CD1 4.3Å; L781-F1124 HydrophobicContact CB-CE1 3.69Å; L781-F1124 HydrophobicContact CB-CE2 4.35Å; L781-F1124 HydrophobicContact CB-CZ 3.72Å; L781-F1124 HydrophobicContact CD1-CD2 4.37Å; L781-F1124 HydrophobicContact CD1-CE2 4.19Å; L781-F1124 HydrophobicContact CD1-CZ 4.38Å; L781-F1124 HydrophobicContact CD2-CD1 3.86Å; L781-F1124 HydrophobicContact CD2-CE1 4.14Å; L781-F1124 HydrophobicContact CD2-CG 4.07Å; L781-F1124 HydrophobicContact CG-CE1 4.4Å; L781-F1124 HydrophobicContact CG-CZ 4.45Å; L783-F1124 HydrophobicContact CD2-CE1 4.25Å; L783-F1124 HydrophobicContact CD2-CE2 4.05Å; L783-F1124 HydrophobicContact CD2-CZ 3.44Å; L783-F1124 VanDerWaalsContact CD2-CZ 3.44Å; L783-F1124 HydrophobicContact CG-CZ 4.08Å; F1121-F1124 HydrophobicContact CB-CB 4.19Å; P1122-F1124 PolarHBondContact O-N 3.15Å; F1124-F1126 PolarHBondContact O-N 3.38Å
1125	T	79.9	Confident	55.9	Low	81 Å²	81	78.6 Å²	78.6	50%	0.497	41%	0.409	S	S	.	.			trans	-79.6	117.5	-176.3	-55.4	0	0	0	0	111.6	S774 N1123	S774-T1125 CarbonylContact O-C 3.6Å; S774-T1125 VanDerWaalsContact O-CA 3.29Å; S774-T1125 WeakPolarHBondContact O-CA 3.33Å; N1123-T1125 PolarHBondContact O-N 2.86Å
1126	F	80.5	Confident	55.9	Low	49 Å²	49	75.7 Å²	75.7	22%	0.215	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	158.5	178.6	158.7	-89.7	0	0	0	111.4	R757 A761 L771 F773 S774 F1124 R1128	R757-F1126 VanDerWaalsContact NH1-CB 3.29Å; A761-F1126 HydrophobicContact CB-CD1 3.97Å; A761-F1126 HydrophobicContact CB-CD2 4.03Å; A761-F1126 HydrophobicContact CB-CE1 3.77Å; A761-F1126 HydrophobicContact CB-CE2 3.82Å; A761-F1126 HydrophobicContact CB-CG 4.1Å; A761-F1126 HydrophobicContact CB-CZ 3.68Å; L771-F1126 HydrophobicContact CD2-CD1 3.72Å; L771-F1126 HydrophobicContact CD2-CE1 4.02Å; L771-F1126 HydrophobicContact CG-CD1 4.3Å; L771-F1126 HydrophobicContact CG-CE1 4.33Å; F773-F1126 WeakPolarHBondContact CA-O 3.32Å; S774-F1126 PolarHBondContact N-O 3.16Å; S774-F1126 PolarHBondContact O-N 2.95Å; S774-F1126 VanDerWaalsContact O-O 3.14Å; S774-F1126 WeakPolarHBondContact OG-CB 3.35Å; S774-F1126 PolarHBondContact OG-N 2.97Å; S774-F1126 VanDerWaalsContact OG-N 3.07Å; F1124-F1126 PolarHBondContact O-N 3.38Å; F1126-R1128 HydrophobicContact CE1-CB 4.12Å; F1126-R1128 HydrophobicContact CZ-CB 3.99Å; F1126-R1128 HydrophobicContact CZ-CG 4.4Å
1127	K	78.1	Confident	55.8	Low	26 Å²	26	74.7 Å²	74.7	11%	0.113	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	138.9	168.6	-55.4	-172.7	-175.5	179.5	0	109	M698 A701 F772 F773 F1129	M698-K1127 PolarHBondContact O-NZ 2.76Å; A701-K1127 WeakPolarHBondContact O-CE 3.25Å; A701-K1127 PolarHBondContact O-NZ 2.73Å; F772-K1127 CarbonylContact O-C 3.57Å; F772-K1127 WeakPolarHBondContact O-CA 3.49Å; F773-K1127 HydrophobicContact CD1-CB 3.99Å; F773-K1127 HydrophobicContact CD1-CD 4.29Å; F773-K1127 HydrophobicContact CD1-CG 3.93Å; K1127-F1129 WeakPolarHBondContact O-CE2 3.29Å; K1127-F1129 WeakPolarHBondContact O-CD2 3.38Å; K1127-F1129 HydrophobicContact CG-CZ 4.37Å; K1127-F1129 HydrophobicContact CD-CZ 4.13Å; K1127-F1129 HydrophobicContact CD-CE1 4.46Å; K1127-F1129 HydrophobicContact CB-CE2 3.81Å; K1127-F1129 HydrophobicContact CB-CE1 4.14Å; K1127-F1129 HydrophobicContact CB-CD2 4.47Å; K1127-F1129 HydrophobicContact CB-CZ 3.62Å
1128	R	76.6	Confident	55.1	Low	28 Å²	28	79 Å²	79	11%	0.106	40%	0.404	C	S	.	.			trans	-83.2	150.5	168.2	-156.4	178.3	-73.3	-111	-3.3	109.6	L760 A763 D764 L771 F772 F1126 D1131	L760-R1128 PolarHBondContact O-NH2 2.82Å; A763-R1128 VanDerWaalsContact O-CZ 3.28Å; A763-R1128 PolarHBondContact O-NH1 3.03Å; A763-R1128 PolarHBondContact O-NH2 3.5Å; D764-R1128 IonicContact OD1-CZ 2.63Å; D764-R1128 IonicContact OD1-NH1 1.94Å; D764-R1128 PolarHBondContact OD1-NH1 3.22Å; L771-R1128 PolarHBondContact O-NE 3.12Å; F772-R1128 PolarHBondContact O-N 2.89Å; F1126-R1128 HydrophobicContact CE1-CB 4.12Å; F1126-R1128 HydrophobicContact CZ-CB 3.99Å; F1126-R1128 HydrophobicContact CZ-CG 4.4Å; R1128-D1131 WeakPolarHBondContact CD-OD2 3.45Å; R1128-D1131 WeakPolarHBondContact CG-OD2 3.3Å
1129	F	60	Low	53.8	Low	48 Å²	48	77.9 Å²	77.9	21%	0.211	41%	0.407	C	S	.	.			trans	-136.1	2.4	-160.4	-78	-62.6	0	0	0	117	H695 M698 Q699 K1127	H695-F1129 AromaticContact CE1-CD2 3.27Å; H695-F1129 WeakPolarHBondContact CE1-CD2 3.39Å; H695-F1129 AromaticContact CE1-CE2 3.77Å; H695-F1129 AromaticContact CE1-CG 3.65Å; H695-F1129 WeakPolarHBondContact ND1-CB 3.29Å; H695-F1129 AromaticContact ND1-CD1 3.74Å; H695-F1129 AromaticContact ND1-CD2 3.37Å; H695-F1129 WeakPolarHBondContact ND1-CD2 3.17Å; H695-F1129 AromaticContact ND1-CE2 3.94Å; H695-F1129 AromaticContact ND1-CG 3.23Å; H695-F1129 WeakPolarHBondContact ND1-CG 3.46Å; M698-F1129 HydrophobicContact CB-CD1 4.49Å; M698-F1129 HydrophobicContact CB-CE1 3.61Å; M698-F1129 HydrophobicContact CB-CZ 4.4Å; M698-F1129 HydrophobicContact CE-CD1 4.49Å; M698-F1129 HydrophobicContact CE-CE1 4.35Å; Q699-F1129 HydrophobicContact CB-CZ 4.4Å; Q699-F1129 HydrophobicContact CG-CE2 3.75Å; Q699-F1129 HydrophobicContact CG-CZ 3.64Å; K1127-F1129 WeakPolarHBondContact O-CE2 3.29Å; K1127-F1129 WeakPolarHBondContact O-CD2 3.38Å; K1127-F1129 HydrophobicContact CG-CZ 4.37Å; K1127-F1129 HydrophobicContact CD-CZ 4.13Å; K1127-F1129 HydrophobicContact CD-CE1 4.46Å; K1127-F1129 HydrophobicContact CB-CE2 3.81Å; K1127-F1129 HydrophobicContact CB-CE1 4.14Å; K1127-F1129 HydrophobicContact CB-CD2 4.47Å; K1127-F1129 HydrophobicContact CB-CZ 3.62Å
1130	F	53.4	Low	52.6	Low	138 Å²	138	84.4 Å²	84.4	61%	0.605	45%	0.453	S	S	*	.	S	Bend	trans	-122.6	-5.8	-174.2	-64.7	-69	0	0	0	114.9	R1132	F1130-R1132 PolarHBondContact O-N 2.67Å
1131	D	50.9	Low	52.5	Low	57 Å²	57	86.1 Å²	86.1	31%	0.305	46%	0.459	S	S	.	.			trans	-99.7	41.7	-173	-39.6	-84.1	0	0	0	113.2	K770 F772 R1128	K770-D1131 WeakPolarHBondContact CE-OD1 3.34Å; K770-D1131 IonicContact NZ-OD1 3.84Å; K770-D1131 PolarHBondContact NZ-OD1 3.3Å; F772-D1131 HydrophobicContact CE1-CB 4.31Å; R1128-D1131 WeakPolarHBondContact CD-OD2 3.45Å; R1128-D1131 WeakPolarHBondContact CG-OD2 3.3Å
1132	R	43.7	Very low	51.8	Low	174 Å²	174	90.1 Å²	90.1	66%	0.657	48%	0.481	S	S	*	.	S	Bend	trans	-89.9	118	155.7	-80.6	-172.7	169.7	-159.4	-5.7	106.3	F1130	F1130-R1132 PolarHBondContact O-N 2.67Å
1133	D	37.7	Very low	51.1	Low	100 Å²	100	93.4 Å²	93.4	54%	0.535	50%	0.496	S	S	.	.			trans	-49.3	137.2	171.8	-65.3	-66.5	0	0	0	109.9	T1135 T1136	D1133-T1135 VanDerWaalsContact O-N 3.09Å; D1133-T1135 PolarHBondContact O-N 3.16Å; D1133-T1135 WeakPolarHBondContact CB-OG1 3.5Å; D1133-T1135 VanDerWaalsContact CB-OG1 3.31Å; D1133-T1136 PolarHBondContact O-N 3.17Å
1134	P	28.9	Very low	50.1	Low	105 Å²	105	96.2 Å²	96.2	68%	0.682	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-59.7	-24.4	179.6	23.5	-32.7	0	0	0	112.1	T1136 I1137	P1134-T1136 VanDerWaalsContact C-N 3.26Å; P1134-T1136 PolarHBondContact O-N 3.44Å; P1134-I1137 PolarHBondContact O-N 3.4Å
1135	T	31	Very low	48.3	Very low	127 Å²	127	102.1 Å²	102.1	78%	0.779	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-64.6	-22.3	171.9	56.1	0	0	0	0	114.1	D1133 I1137	D1133-T1135 VanDerWaalsContact O-N 3.09Å; D1133-T1135 PolarHBondContact O-N 3.16Å; D1133-T1135 WeakPolarHBondContact CB-OG1 3.5Å; D1133-T1135 VanDerWaalsContact CB-OG1 3.31Å; T1135-I1137 VanDerWaalsContact C-N 3.29Å
1136	T	33.4	Very low	46.1	Very low	85 Å²	85	103.5 Å²	103.5	52%	0.521	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-91.5	9.9	177.3	-44.3	0	0	0	0	111.9	D1133 P1134 Q1138	D1133-T1136 PolarHBondContact O-N 3.17Å; P1134-T1136 VanDerWaalsContact C-N 3.26Å; P1134-T1136 PolarHBondContact O-N 3.44Å; T1136-Q1138 VanDerWaalsContact C-N 3.29Å; T1136-Q1138 PolarHBondContact O-N 3.19Å; T1136-Q1138 VanDerWaalsContact O-N 3.14Å
1137	I	31.2	Very low	43.7	Very low	118 Å²	118	107.4 Å²	107.4	61%	0.605	57%	0.57	S	S	*	*			trans	-81.2	84.1	162.2	-54.6	179.5	0	0	0	107.7	P1134 T1135 T1139	P1134-I1137 PolarHBondContact O-N 3.4Å; T1135-I1137 VanDerWaalsContact C-N 3.29Å; I1137-T1139 PolarHBondContact O-N 3.48Å; I1137-T1139 VanDerWaalsContact O-N 3.15Å
1138	Q	27.6	Very low	41	Very low	184 Å²	184	113.7 Å²	113.7	86%	0.86	61%	0.605	S	S	*	*			trans	-56.6	119.1	153.8	-75.5	178.3	-25.2	0	0	107.6	T1136	T1136-Q1138 VanDerWaalsContact C-N 3.29Å; T1136-Q1138 PolarHBondContact O-N 3.19Å; T1136-Q1138 VanDerWaalsContact O-N 3.14Å
1139	T	26	Very low	38.1	Very low	121 Å²	121	120.8 Å²	120.8	74%	0.742	65%	0.646	S	S	*	*			trans	-56.4	149.2	159.8	42.5	0	0	0	0	109.3	I1137	I1137-T1139 PolarHBondContact O-N 3.48Å; I1137-T1139 VanDerWaalsContact O-N 3.15Å
1140	P	33.1	Very low	36.1	Very low	193 Å²	193	127.5 Å²	127.5	100%	1.253	69%	0.686	S	S	*	*			trans	-62.6	0	-170.7	29.1	-37.3	0	0	0	113.7

Retrieved 1,140 of 1,140 residues in 1333.4 ms (Link to these results)

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