DHX30_MOUSE Loading...

Isoform 3 of ATP-dependent RNA helicase DHX30 AlphaSync

Canonical isoform description: RNA-dependent helicase¹. Plays an important role in the assembly of the mitochondrial large ribosomal subunit (By similarity). Required for optimal function of the zinc-finger antiviral protein ZC3HAV1 (By similarity). Associates with mitochondrial DNA (By similarity). Involved in nervous system development and differentiation through its involvement in the up-regulation of a number of genes which are required for neurogenesis, including GSC, NCAM1, neurogenin, and NEUROD².

AlphaFold DB , UniProt , Accession Q99PU8-3 (canonical: Q99PU8), Species MOUSE (Mus musculus, Mouse), Gene Dhx30, Length 1,223 aa.

						>DHX30_MOUSE|Q99PU8-3|Dhx30
MAAARRLMALAAGVSPRLRPPDPLVASGRQGCSRGFSSSFVRSDGTQEAAEVESEVAPSEPGEGDGSMVNASRDLLKEFPQPKNLLNSVIGRALGISHAKDKLVYVHTNGPKKKKVTLHIKWPKSVEVEGYGSKKIDAERQAAAAACQLFKGWGLLGPRNELFDAAKYRVLADRFGSPADSWWRPEPTMPPTSWRQLNPENIRPGGPAGLSRSLGREEEEDEEEELEEGTIDVTEFLSMTQQDSHNPLRDSRGGSFEMTDDDSAIRALTQFPLPKNLLAKVIQIATSSSTAKNLMQFHTVGTKTKLATLTLLWPCPMTFVAKGRRKAEAENKAAALACKKLKSLGLVDRNNEPLTHAMYNLASLRELGETQRRPCTIQVPEPILRKIEAFLSHYPVDSSWISPELRLQSDDILPLGKDSGPLSDPITGKPYMPLSEAEEVRLSQSLLELWRRRGPIWQEAPQLPVDPHRDTILSAIEQHPVVVISGDTGCGKTTRIPQLLLERYVTEGRGARCNVIITQPRRISAVSVAQRVSHELGPSLRRNVGFQVRLESKPPARGGALLFCTVGILLRKLQSNPSLEGVSHVIVDEVHERDVNTDFLLILLKGLQRLNPALRLVLMSATGDNERFSRYFGGCPVIKVPGFMYPVKEHYLEDILAKLGKHQYPHRHRHHESEDECALDLDLVTDLVLHIDARGEPGGILCFLPGWQEIKGVQQRLQEALGMHESKYLILPVHSNIPMMDQKAIFQQPPLGVRKIVLATNIAETSITVNDIVHVVDSGLHKEERYDLKTKVSCLETVWVSRANVIQRRGRAGRCQSGFAYHLFPRSRLEKMVPFQVPEILRTPLENLVLQAKIHMPEKTAVEFLSKAVDSPNIKAVDEAVILLQEIGVLDQREYLTTLGQRLAHISTDPRLAKAIVLAAIFRCLHPLLVVVSCLTRDPFSSSLQNRAEVDKVKALLSHDSGSDHLAFVRAVAGWEEVLRWQDRTSRENYLEENLLYAPSLRFIHGLIKQFSENIYEAFLVGKPSDCTLPSAQCNEYSEEEELVKGVLMAGLYPNLIQVRQGKVTRQGKFKPNSVTYRTKSGNILLHKSTINREATRLRSRWLTYFMAVKSNGSVFVRDSSQVHPLAVLLLTDGDVHIRDDGRRATISLSDSDLLRLEGDSRTVRLLREFRRALGRMVERSLRSELAALPLSVQQEHGQLLALLAELLRGPCGSFDMRKTADD
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	39	Very low	34	Very low	215 Å²	215	137.5 Å²	137.5	100%	1.059	77%	0.767	S	S	*	*				0	-30.4	0	-79.1	-130.7	-110.2	0	0	115.3
2	A	34.8	Very low	33.5	Very low	83 Å²	83	134.8 Å²	134.8	69%	0.686	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-30.8	-178.8	0	0	0	0	0	115.1	R5	A2-R5 PolarHBondContact O-N 3.29Å
3	A	35.8	Very low	32.8	Very low	82 Å²	82	129.8 Å²	129.8	68%	0.678	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-32	-178.3	0	0	0	0	0	113.8	R5 R6	A3-R5 VanDerWaalsContact C-N 3.26Å; A3-R5 PolarHBondContact O-N 3.07Å; A3-R6 PolarHBondContact O-N 3.36Å
4	A	38.6	Very low	32.4	Very low	75 Å²	75	130 Å²	130	62%	0.62	77%	0.774	S	S	*	*	H	α-helix	trans	-72.4	-16.5	177.2	0	0	0	0	0	113.4
5	R	37.5	Very low	31.8	Very low	206 Å²	206	129.1 Å²	129.1	78%	0.777	78%	0.777	S	S	*	*	H	α-helix	trans	-78.7	-18.1	176.8	-76.3	-175.1	175.6	179.2	-0.7	114	A2 A3	A2-R5 PolarHBondContact O-N 3.29Å; A3-R5 VanDerWaalsContact C-N 3.26Å; A3-R5 PolarHBondContact O-N 3.07Å
6	R	33.2	Very low	31.5	Very low	212 Å²	212	127.4 Å²	127.4	80%	0.8	77%	0.769	S	S	*	*	H	α-helix	trans	-90.1	-21.2	-178.9	-73.2	-171.2	-179.9	-166.4	0.7	114.4	A3	A3-R6 PolarHBondContact O-N 3.36Å
7	L	33.1	Very low	31.1	Very low	145 Å²	145	133.4 Å²	133.4	76%	0.759	78%	0.775	S	S	*	*	H	α-helix	trans	-87.9	-21.4	-179.8	-86	156.7	0	0	0	114.1
8	M	32.4	Very low	30.7	Very low	163 Å²	163	134.8 Å²	134.8	80%	0.803	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-84.8	-9.8	176.7	-80.7	-72.2	-141.4	0	0	114.3	L10	M8-L10 VanDerWaalsContact C-N 3.34Å
9	A	31.5	Very low	30.2	Very low	84 Å²	84	140 Å²	140	69%	0.694	78%	0.784	S	S	*	*	G	3₁₀ helix	trans	-85.5	-1.7	179.2	0	0	0	0	0	114.2
10	L	28.8	Very low	30.4	Very low	157 Å²	157	138.5 Å²	138.5	82%	0.822	78%	0.78	S	S	*	*	G	3₁₀ helix	trans	-110.9	6.2	-175.1	-81.2	165.5	0	0	0	115.1	M8	M8-L10 VanDerWaalsContact C-N 3.34Å
11	A	29.8	Very low	30.7	Very low	90 Å²	90	136.5 Å²	136.5	74%	0.744	77%	0.773	S	S	*	*	S	Bend	trans	-109.2	7	-177.5	0	0	0	0	0	115.5
12	A	27.9	Very low	30.1	Very low	105 Å²	105	133.2 Å²	133.2	87%	0.868	76%	0.76	S	S	*	*	S	Bend	trans	-125.7	73.5	-177.9	0	0	0	0	0	112.1
13	G	23.8	Very low	30.1	Very low	70 Å²	70	134.2 Å²	134.2	72%	0.722	76%	0.759	S	S	*	*			trans	169	85.8	165.3	0	0	0	0	0	114.8
14	V	28.1	Very low	29.4	Very low	133 Å²	133	138.1 Å²	138.1	81%	0.806	77%	0.768	S	S	*	*			trans	-153.8	112.6	139.7	-179.5	0	0	0	0	108.4	P16	V14-P16 HydrophobicContact CG1-CG 4.34Å
15	S	22.6	Very low	28.8	Very low	117 Å²	117	141 Å²	141	82%	0.818	78%	0.777	S	S	*	*			trans	-84.4	146.8	150.7	-60.2	0	0	0	0	108.7
16	P	27.5	Very low	28	Very low	101 Å²	101	135.1 Å²	135.1	66%	0.656	77%	0.773	S	S	*	*			trans	-141.1	137.2	130.5	24.4	-3.6	0	0	0	114.7	V14	V14-P16 HydrophobicContact CG1-CG 4.34Å
17	R	25.3	Very low	27.4	Very low	230 Å²	230	131.2 Å²	131.2	87%	0.868	78%	0.778	S	S	*	*				58.5	109.5	128.2	-60.9	-178.1	176.3	-174.7	-1.6	118.3
18	L	23.1	Very low	26.9	Very low	159 Å²	159	127.6 Å²	127.6	83%	0.832	78%	0.776	S	S	*	*				69.9	104.3	83	-83.8	161.4	0	0	0	115.4
19	R	21.9	Very low	26.3	Very low	233 Å²	233	130.7 Å²	130.7	88%	0.879	78%	0.778	S	S	*	*			trans	58	162.6	134.6	-110	-170.8	-171.4	-176	3.1	119.3
20	P	34	Very low	25.9	Very low	109 Å²	109	134.9 Å²	134.9	71%	0.708	78%	0.784	S	S	*	*			cis	-138.6	-142.4	0.3	46.7	-24.2	0	0	0	113.1
21	P	37.1	Very low	25.5	Very low	98 Å²	98	130.9 Å²	130.9	64%	0.636	78%	0.78	S	S	*	*				-129.2	-165.3	-129.5	34.5	-6.8	0	0	0	115.7
22	D	24.9	Very low	25.3	Very low	146 Å²	146	133 Å²	133	78%	0.781	79%	0.788	S	S	*	*			trans	81.2	159.9	156.3	-63.8	-21.8	0	0	0	119.6
23	P	35.8	Very low	25	Very low	103 Å²	103	133.4 Å²	133.4	67%	0.669	79%	0.785	S	S	*	*				-138.3	177	-53.8	39.8	-23.4	0	0	0	113.1
24	L	21.2	Very low	25.1	Very low	165 Å²	165	141.8 Å²	141.8	86%	0.864	80%	0.795	S	S	*	*			trans	26.9	126.4	144.5	-69	159.2	0	0	0	120.8
25	V	25.2	Very low	24.7	Very low	135 Å²	135	138.5 Å²	138.5	82%	0.818	79%	0.787	S	S	*	*			trans	169.8	104.5	136.2	158.7	0	0	0	0	105.7
26	A	20.7	Very low	24.9	Very low	82 Å²	82	143.4 Å²	143.4	68%	0.678	79%	0.794	S	S	*	*				61.3	120.1	78.5	0	0	0	0	0	115.3
27	S	21.8	Very low	24.5	Very low	130 Å²	130	143.8 Å²	143.8	91%	0.909	80%	0.799	S	S	*	*			trans	80.5	137.3	156.3	80.3	0	0	0	0	119
28	G	21.8	Very low	24.5	Very low	69 Å²	69	137.8 Å²	137.8	71%	0.711	79%	0.792	S	S	*	*			trans	131.9	78.9	147.4	0	0	0	0	0	117.1
29	R	20.6	Very low	24.4	Very low	229 Å²	229	134.4 Å²	134.4	86%	0.864	78%	0.782	S	S	*	*				56.5	142.1	124	-96	179.8	173.4	-170.1	-1.7	121.5
30	Q	22.2	Very low	24.3	Very low	172 Å²	172	132.3 Å²	132.3	80%	0.804	78%	0.78	S	S	*	*			trans	84.8	96.6	149.8	-73.2	175.2	-8.7	0	0	117.8
31	G	20.7	Very low	23.8	Very low	73 Å²	73	133.8 Å²	133.8	75%	0.753	79%	0.787	S	S	*	*				76.5	108.6	98.6	0	0	0	0	0	116.4
32	C	25.5	Very low	22.9	Very low	133 Å²	133	139.3 Å²	139.3	90%	0.899	80%	0.795	S	S	*	*			trans	-147.3	100.8	141.6	-96.3	0	0	0	0	109.1
33	S	20.4	Very low	22.8	Very low	115 Å²	115	137 Å²	137	80%	0.804	79%	0.79	S	S	*	*			trans	-56	133.6	155.5	154.3	0	0	0	0	109.8
34	R	26.6	Very low	22.1	Very low	246 Å²	246	139.6 Å²	139.6	93%	0.928	80%	0.798	S	S	*	*			trans	-147.8	102.8	147.4	-100.8	-179.6	177.2	168.7	-1.2	108
35	G	20.5	Very low	22	Very low	63 Å²	63	134.8 Å²	134.8	65%	0.649	79%	0.789	S	S	*	*			trans	-74	155.2	171.4	0	0	0	0	0	112.1
36	F	26.1	Very low	21.8	Very low	220 Å²	220	135.7 Å²	135.7	97%	0.965	79%	0.794	S	S	*	*			trans	-120.3	116.2	146.1	-95.7	-84.8	0	0	0	107.8
37	S	19.7	Very low	21.6	Very low	109 Å²	109	140.5 Å²	140.5	76%	0.762	80%	0.803	S	S	*	*			trans	-81.1	148.8	170.9	163.4	0	0	0	0	109.6
38	S	23.9	Very low	21.6	Very low	104 Å²	104	143.3 Å²	143.3	73%	0.727	80%	0.802	S	S	*	*			trans	146.2	138.5	133.4	74	0	0	0	0	109
39	S	20.8	Very low	21.5	Very low	88 Å²	88	144.2 Å²	144.2	62%	0.615	80%	0.803	S	S	*	*			cis	166.4	129.6	-15.5	44.2	0	0	0	0	104.6
40	F	20.5	Very low	21.4	Very low	189 Å²	189	137.5 Å²	137.5	83%	0.829	80%	0.796	S	S	*	*			trans	69.6	135.6	152.3	-71.1	-115.1	0	0	0	116.4
41	V	24.8	Very low	21.2	Very low	141 Å²	141	137.8 Å²	137.8	86%	0.855	80%	0.797	S	S	*	*				-150.7	149.3	64.5	165.6	0	0	0	0	111.7
42	R	18.1	Very low	21.2	Very low	214 Å²	214	139.8 Å²	139.8	81%	0.808	80%	0.795	S	S	*	*			trans	-92.7	-176.9	-175.6	-107.4	179.3	168.7	-177.8	-4.3	113
43	S	21	Very low	20.8	Very low	98 Å²	98	141.9 Å²	141.9	69%	0.685	79%	0.791	S	S	*	*			trans	75.9	139.5	155.6	43.4	0	0	0	0	116.6
44	D	21.5	Very low	20.8	Very low	157 Å²	157	142.2 Å²	142.2	84%	0.84	79%	0.793	S	S	*	*			cis	-154.1	149	-0.1	-91.5	-29.8	0	0	0	104.2
45	G	19.4	Very low	20.4	Very low	64 Å²	64	139.4 Å²	139.4	66%	0.66	79%	0.791	S	S	*	*				89.8	99.8	56.1	0	0	0	0	0	110
46	T	21.5	Very low	20.5	Very low	153 Å²	153	143.4 Å²	143.4	94%	0.939	80%	0.802	S	S	*	*				179.1	136.1	129.2	29.8	0	0	0	0	112.1
47	Q	17.2	Very low	20.3	Very low	184 Å²	184	137.1 Å²	137.1	86%	0.86	79%	0.791	S	S	*	*			trans	-75.4	156.8	174.2	-66.6	156.4	-65.2	0	0	112.3
48	E	20.6	Very low	20.5	Very low	188 Å²	188	138 Å²	138	88%	0.879	79%	0.794	S	S	*	*			trans	-172.6	111.6	131.4	-103.2	170.3	-176.6	0	0	107.8
49	A	20.1	Very low	20.4	Very low	89 Å²	89	138.8 Å²	138.8	74%	0.736	80%	0.8	S	S	*	*				72.5	108.9	109.8	0	0	0	0	0	112.9
50	A	18.9	Very low	20.5	Very low	87 Å²	87	143.4 Å²	143.4	72%	0.719	81%	0.812	S	S	*	*				57.4	130.5	81.2	0	0	0	0	0	110.3
51	E	17.9	Very low	20.8	Very low	179 Å²	179	140.7 Å²	140.7	84%	0.836	81%	0.813	S	S	*	*			cis	175.7	172.3	30.1	-138.4	171.7	-149.3	0	0	106.4
52	V	20.3	Very low	20.6	Very low	114 Å²	114	137.5 Å²	137.5	69%	0.691	81%	0.808	S	S	*	*			trans	86	96.7	157.3	-158.9	0	0	0	0	119.8
53	E	17.4	Very low	21	Very low	178 Å²	178	137.2 Å²	137.2	83%	0.832	82%	0.816	S	S	*	*				22	131	119.1	-60.3	176.8	159.7	0	0	120.1
54	S	20.8	Very low	21.2	Very low	121 Å²	121	135.7 Å²	135.7	85%	0.846	82%	0.816	S	S	*	*				-171.2	129	127.3	33	0	0	0	0	111.7
55	E	18.2	Very low	21.6	Very low	188 Å²	188	134.7 Å²	134.7	88%	0.879	81%	0.81	S	S	*	*			trans	-63.6	138.9	168.2	-55.5	171	132.8	0	0	111.2
56	V	22.6	Very low	22	Very low	147 Å²	147	134.1 Å²	134.1	89%	0.891	80%	0.804	S	S	*	*			trans	-146.4	130.3	146	-176.1	0	0	0	0	110
57	A	21	Very low	22.5	Very low	87 Å²	87	131.6 Å²	131.6	72%	0.719	79%	0.793	S	S	*	*			trans	-72.2	177.2	-179.2	0	0	0	0	0	113.7
58	P	25.3	Very low	23.2	Very low	127 Å²	127	128.2 Å²	128.2	83%	0.825	78%	0.779	S	S	*	*			trans	-91.7	147.1	-150.2	36.4	-34.9	0	0	0	114.5
59	S	20.9	Very low	24.1	Very low	122 Å²	122	122.3 Å²	122.3	85%	0.853	76%	0.755	S	S	*	*			trans	-126.1	141.3	166.2	53.3	0	0	0	0	111.6
60	E	22.9	Very low	25.1	Very low	185 Å²	185	123.3 Å²	123.3	86%	0.864	75%	0.748	S	S	*	*			trans	-64.9	161.5	-170.1	-79.7	-172.5	159.6	0	0	115.4	G62	E60-G62 PolarHBondContact O-N 3Å
61	P	26.2	Very low	26.5	Very low	131 Å²	131	122 Å²	122	85%	0.851	74%	0.737	S	S	*	*			trans	-83.4	103.3	-155	31.8	-31.6	0	0	0	112.7
62	G	21.9	Very low	28.1	Very low	74 Å²	74	114.8 Å²	114.8	76%	0.763	71%	0.706	S	S	*	*			trans	-84.4	134	164.1	0	0	0	0	0	112.1	E60 G64	E60-G62 PolarHBondContact O-N 3Å; G62-G64 PolarHBondContact O-N 3.37Å
63	E	24.7	Very low	29.7	Very low	209 Å²	209	118.2 Å²	118.2	98%	0.977	71%	0.707	S	S	*	*			trans	-56.8	115.6	-176.7	-61.7	175.9	137.3	0	0	113.5
64	G	25.3	Very low	32.3	Very low	65 Å²	65	113.8 Å²	113.8	67%	0.67	69%	0.689	S	S	*	*			trans	-149.6	64.5	176.2	0	0	0	0	0	112.6	G62 G66	G62-G64 PolarHBondContact O-N 3.37Å; G64-G66 PolarHBondContact O-N 2.69Å
65	D	30.5	Very low	35	Very low	137 Å²	137	109.2 Å²	109.2	73%	0.733	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	42	-174.7	-163.3	21.6	0	0	0	114.2
66	G	27.6	Very low	38	Very low	51 Å²	51	103.3 Å²	103.3	53%	0.526	63%	0.629	S	S	.	*	T	Hydrogen-bonded Turn	trans	-119	-27.2	-177.8	0	0	0	0	0	115.7	G64	G64-G66 PolarHBondContact O-N 2.69Å
67	S	32.8	Very low	40.8	Very low	101 Å²	101	103.6 Å²	103.6	71%	0.706	62%	0.618	S	S	*	*	S	Bend	trans	-83.9	-41.5	-173.3	168.5	0	0	0	0	112.9	V69	S67-V69 PolarHBondContact O-N 3.1Å
68	M	32.1	Very low	43.7	Very low	113 Å²	113	103.1 Å²	103.1	56%	0.557	60%	0.601	S	S	*	*	H	α-helix	trans	-73.9	-27.2	-170.1	-131.8	176.4	82.5	0	0	114.1	S72 Y131	M68-S72 WeakPolarHBondContact O-CB 3.18Å; M68-S72 PolarHBondContact O-N 3.1Å; M68-S72 PolarHBondContact O-OG 3.49Å; M68-Y131 HydrophobicContact CE-CD2 4.21Å; M68-Y131 HydrophobicContact CE-CE2 4.43Å
69	V	39.7	Very low	46.7	Very low	63 Å²	63	97.2 Å²	97.2	38%	0.382	56%	0.563	S	S	.	*	H	α-helix	trans	-72.6	-31.4	-176.9	-177.9	0	0	0	0	111.9	S67 R73	S67-V69 PolarHBondContact O-N 3.1Å; V69-R73 PolarHBondContact O-N 3.26Å
70	N	40.6	Very low	49.6	Very low	110 Å²	110	95.2 Å²	95.2	59%	0.588	55%	0.547	S	S	*	.	H	α-helix	trans	-74.8	-46.6	177.8	-78.1	-12.5	0	0	0	111.6	S72 R73 D74	N70-S72 PolarHBondContact O-N 3.35Å; N70-R73 PolarHBondContact O-N 3.09Å; N70-R73 VanDerWaalsContact O-N 3.11Å; N70-D74 PolarHBondContact O-N 3.48Å
71	A	48.1	Very low	52.7	Low	60 Å²	60	92.5 Å²	92.5	50%	0.496	53%	0.534	S	S	.	.	H	α-helix	trans	-57	-37.5	175.2	0	0	0	0	0	112.4	R73	A71-R73 PolarHBondContact O-N 3.47Å
72	S	50.8	Low	55.7	Low	27 Å²	27	86.3 Å²	86.3	19%	0.189	49%	0.494	C	S	.	.	H	α-helix	trans	-65.7	-33.3	179.2	-59.3	0	0	0	0	113.8	M68 N70 Q141	M68-S72 WeakPolarHBondContact O-CB 3.18Å; M68-S72 PolarHBondContact O-N 3.1Å; M68-S72 PolarHBondContact O-OG 3.49Å; N70-S72 PolarHBondContact O-N 3.35Å; S72-Q141 VanDerWaalsContact CB-NE2 3.32Å; S72-Q141 PolarHBondContact OG-NE2 3.13Å
73	R	55.1	Low	59	Low	186 Å²	186	84.8 Å²	84.8	70%	0.702	47%	0.467	S	S	*	.	H	α-helix	trans	-80.9	-27.1	-176.3	-115.4	179.5	167.1	178.5	-4.5	112.8	V69 N70 A71	V69-R73 PolarHBondContact O-N 3.26Å; N70-R73 PolarHBondContact O-N 3.09Å; N70-R73 VanDerWaalsContact O-N 3.11Å; A71-R73 PolarHBondContact O-N 3.47Å
74	D	71.1	Confident	61.9	Low	85 Å²	85	79 Å²	79	46%	0.455	44%	0.443	S	S	.	.	H	α-helix	trans	-80.4	-31.2	-178.2	-68.1	-30.7	0	0	0	112.3	N70 L76 K77 E78	N70-D74 PolarHBondContact O-N 3.48Å; D74-L76 PolarHBondContact O-N 3.35Å; D74-K77 WeakPolarHBondContact O-CB 3.34Å; D74-K77 PolarHBondContact O-N 2.74Å; D74-K77 IonicContact OD1-NZ 3.84Å; D74-K77 PolarHBondContact OD1-NZ 3.39Å; D74-E78 PolarHBondContact O-N 3.19Å; D74-E78 VanDerWaalsContact O-N 3.11Å
75	L	77.8	Confident	64.9	Low	26 Å²	26	77.3 Å²	77.3	14%	0.136	42%	0.418	C	S	.	.	H	α-helix	trans	-63.9	-38.7	175.4	-65.9	174.2	0	0	0	113.9	K77 E78 F79 A144 A145 Q148	L75-K77 VanDerWaalsContact C-N 3.28Å; L75-K77 PolarHBondContact O-N 2.65Å; L75-E78 PolarHBondContact O-N 3.02Å; L75-F79 WeakPolarHBondContact O-CD2 3.19Å; L75-F79 PolarHBondContact O-N 3.41Å; L75-A144 HydrophobicContact CB-CB 4.2Å; L75-A145 HydrophobicContact CD1-CB 4.46Å; L75-Q148 HydrophobicContact CD2-CB 4.13Å; L75-Q148 HydrophobicContact CD2-CG 4.01Å
76	L	81.5	Confident	67.6	Low	63 Å²	63	70.8 Å²	70.8	33%	0.33	38%	0.383	S	S	.	.	H	α-helix	trans	-73.8	-19.1	177.7	-74.1	170.8	0	0	0	113.1	D74 F79 P82 R140 A144	D74-L76 PolarHBondContact O-N 3.35Å; L76-F79 CarbonylContact O-C 3.48Å; L76-P82 HydrophobicContact CD2-CG 4.34Å; L76-R140 HydrophobicContact CD2-CB 4.11Å; L76-A144 HydrophobicContact CD2-CB 3.97Å; L76-A144 HydrophobicContact CG-CB 4.47Å
77	K	80.1	Confident	70.5	Confident	153 Å²	153	71.3 Å²	71.3	67%	0.665	37%	0.373	S	S	*	.	H	α-helix	trans	-75.9	-40.7	169.1	-68	174.3	-171.1	157.6	0	110.9	D74 L75	D74-K77 WeakPolarHBondContact O-CB 3.34Å; D74-K77 PolarHBondContact O-N 2.74Å; D74-K77 IonicContact OD1-NZ 3.84Å; D74-K77 PolarHBondContact OD1-NZ 3.39Å; L75-K77 VanDerWaalsContact C-N 3.28Å; L75-K77 PolarHBondContact O-N 2.65Å
78	E	82.5	Confident	73	Confident	78 Å²	78	69.1 Å²	69.1	36%	0.364	36%	0.358	S	S	.	.	H	α-helix	trans	-69.9	-36.8	177.9	-170	176.8	179.4	0	0	112.2	D74 L75 P80 K151 N160	D74-E78 PolarHBondContact O-N 3.19Å; D74-E78 VanDerWaalsContact O-N 3.11Å; L75-E78 PolarHBondContact O-N 3.02Å; E78-P80 WeakPolarHBondContact O-CD 3.41Å; E78-K151 IonicContact OE1-NZ 2.92Å; E78-K151 PolarHBondContact OE1-NZ 3.45Å; E78-N160 PolarHBondContact O-ND2 2.8Å
79	F	88.7	Confident	75.6	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.009	33%	0.332	C	S	.	.			trans	-122.7	82.9	179.3	-53.9	-79.7	0	0	0	110.7	L75 L76 Q81 P82 L85 A144 C147 Q148 K151 L156 N160	L75-F79 WeakPolarHBondContact O-CD2 3.19Å; L75-F79 PolarHBondContact O-N 3.41Å; L76-F79 CarbonylContact O-C 3.48Å; F79-Q81 VanDerWaalsContact C-N 3.33Å; F79-Q81 PolarHBondContact O-N 2.93Å; F79-P82 HydrophobicContact CB-CB 4.16Å; F79-P82 WeakPolarHBondContact O-CD 3.41Å; F79-L85 HydrophobicContact CD1-CD2 3.77Å; F79-L85 HydrophobicContact CE1-CD2 4.27Å; F79-A144 HydrophobicContact CB-CB 4.47Å; F79-C147 HydrophobicContact CB-CB 4.31Å; F79-C147 HydrophobicContact CD1-CB 3.46Å; F79-C147 VanDerWaalsContact CD1-CB 3.46Å; F79-C147 HydrophobicContact CD2-CB 4.03Å; F79-C147 HydrophobicContact CE1-CB 3.62Å; F79-C147 HydrophobicContact CE2-CB 4.21Å; F79-C147 HydrophobicContact CG-CB 3.66Å; F79-C147 HydrophobicContact CZ-CB 4Å; F79-Q148 HydrophobicContact CE2-CB 4.06Å; F79-K151 HydrophobicContact CE1-CD 4.25Å; F79-K151 HydrophobicContact CZ-CB 4.32Å; F79-K151 HydrophobicContact CZ-CD 3.81Å; F79-L156 HydrophobicContact CE1-CD1 4.32Å; F79-N160 WeakPolarHBondContact CD1-ND2 3.38Å; F79-N160 HydrophobicContact CE1-CB 4.5Å; F79-N160 VanDerWaalsContact CE1-CG 3.48Å; F79-N160 WeakPolarHBondContact CE1-OD1 3.09Å
80	P	81.7	Confident	77.7	Confident	81 Å²	81	60.7 Å²	60.7	53%	0.526	31%	0.313	S	S	.	.	S	Bend	trans	-67.4	-30.3	-175.2	23.4	-32.7	0	0	0	113.7	E78 R140	E78-P80 WeakPolarHBondContact O-CD 3.41Å; P80-R140 PolarHBondContact O-NH2 3.27Å
81	Q	87.8	Confident	79.6	Confident	127 Å²	127	56.1 Å²	56.1	59%	0.593	29%	0.292	S	S	*	.	S	Bend	trans	-125.1	68.8	176.9	-64.1	-167.9	-2.5	0	0	111.9	F79 N84 L85	F79-Q81 VanDerWaalsContact C-N 3.33Å; F79-Q81 PolarHBondContact O-N 2.93Å; Q81-N84 HydrophobicContact CB-CB 4.29Å; Q81-N84 PolarHBondContact O-N 2.84Å; Q81-N84 PolarHBondContact OE1-ND2 3.17Å; Q81-L85 WeakPolarHBondContact O-CB 3.48Å; Q81-L85 PolarHBondContact O-N 3.24Å; Q81-L85 VanDerWaalsContact O-N 3.1Å
82	P	89.7	Confident	81.2	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.013	29%	0.293	C	S	.	.	H	α-helix	trans	-71.6	-37.4	-167.6	28	-32.2	0	0	0	113.1	L76 F79 N84 L85 L86 R140 A143 A144 C147	L76-P82 HydrophobicContact CD2-CG 4.34Å; F79-P82 HydrophobicContact CB-CB 4.16Å; F79-P82 WeakPolarHBondContact O-CD 3.41Å; P82-N84 PolarHBondContact O-N 3.46Å; P82-L85 PolarHBondContact O-N 2.98Å; P82-L86 WeakPolarHBondContact O-CG 3.4Å; P82-L86 PolarHBondContact O-N 3.47Å; P82-R140 HydrophobicContact CG-CB 4.36Å; P82-R140 VanDerWaalsContact CG-O 3.22Å; P82-R140 WeakPolarHBondContact CG-O 3.29Å; P82-A143 HydrophobicContact CB-CB 3.81Å; P82-A143 HydrophobicContact CG-CB 4.02Å; P82-A144 HydrophobicContact CB-CB 3.98Å; P82-A144 HydrophobicContact CG-CB 4.11Å; P82-C147 PolarHBondContact O-SG 2.73Å
83	K	90.3	Very high	82.6	Confident	42 Å²	42	59 Å²	59	18%	0.183	29%	0.289	C	S	.	.	H	α-helix	trans	-58.8	-47.2	176	-67.5	-176.6	70.2	176	0	111.4	L86 N87 E139 A143	K83-L86 PolarHBondContact O-N 2.93Å; K83-N87 PolarHBondContact O-N 3.32Å; K83-N87 PolarHBondContact O-ND2 2.91Å; K83-E139 HydrophobicContact CD-CB 4.47Å; K83-E139 IonicContact NZ-OE2 3.86Å; K83-E139 PolarHBondContact NZ-OE2 2.93Å; K83-A143 HydrophobicContact CG-CB 3.88Å
84	N	86.6	Confident	83.7	Confident	88 Å²	88	53.4 Å²	53.4	47%	0.471	27%	0.272	S	S	.	.	H	α-helix	trans	-65	-40.8	179	-68.2	-6.2	0	0	0	111.5	Q81 P82 N87 S88	Q81-N84 HydrophobicContact CB-CB 4.29Å; Q81-N84 PolarHBondContact O-N 2.84Å; Q81-N84 PolarHBondContact OE1-ND2 3.17Å; P82-N84 PolarHBondContact O-N 3.46Å; N84-N87 PolarHBondContact O-N 3.49Å; N84-S88 VanDerWaalsContact O-CB 3.31Å; N84-S88 WeakPolarHBondContact O-CB 3.28Å; N84-S88 PolarHBondContact O-N 3.31Å; N84-S88 PolarHBondContact O-OG 2.95Å
85	L	87.3	Confident	83.8	Confident	28 Å²	28	52.5 Å²	52.5	15%	0.147	28%	0.283	C	S	.	.	H	α-helix	trans	-63.9	-46	179.1	-172.2	63.6	0	0	0	111.4	F79 Q81 P82 S88 V89 C147 L156 N160 L162	F79-L85 HydrophobicContact CD1-CD2 3.77Å; F79-L85 HydrophobicContact CE1-CD2 4.27Å; Q81-L85 WeakPolarHBondContact O-CB 3.48Å; Q81-L85 PolarHBondContact O-N 3.24Å; Q81-L85 VanDerWaalsContact O-N 3.1Å; P82-L85 PolarHBondContact O-N 2.98Å; L85-S88 PolarHBondContact O-N 2.92Å; L85-V89 WeakPolarHBondContact O-CG2 3.28Å; L85-V89 PolarHBondContact O-N 3.31Å; L85-C147 HydrophobicContact CD2-CB 4.4Å; L85-L156 HydrophobicContact CD1-CD2 3.78Å; L85-L156 HydrophobicContact CD2-CD1 3.83Å; L85-L156 HydrophobicContact CD2-CD2 4Å; L85-L156 HydrophobicContact CG-CD1 4.29Å; L85-L156 HydrophobicContact CG-CD2 3.91Å; L85-N160 HydrophobicContact CD2-CB 3.94Å; L85-L162 HydrophobicContact CD1-CD2 4.23Å
86	L	88.7	Confident	83.6	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61	-47.3	175.4	-71.6	171.9	0	0	0	112.4	P82 K83 S88 V89 I90 L103 L118 A143 A146 F150	P82-L86 WeakPolarHBondContact O-CG 3.4Å; P82-L86 PolarHBondContact O-N 3.47Å; K83-L86 PolarHBondContact O-N 2.93Å; L86-S88 VanDerWaalsContact C-N 3.26Å; L86-S88 PolarHBondContact O-N 3.09Å; L86-V89 PolarHBondContact O-N 2.92Å; L86-I90 WeakPolarHBondContact O-CG1 3.49Å; L86-I90 PolarHBondContact O-N 3.18Å; L86-L103 HydrophobicContact CB-CD1 3.86Å; L86-L103 HydrophobicContact CD1-CD2 4.45Å; L86-L118 HydrophobicContact CD1-CD2 4.01Å; L86-A143 HydrophobicContact CD1-CB 3.8Å; L86-A146 HydrophobicContact CD1-CB 3.74Å; L86-A146 HydrophobicContact CD2-CB 4.06Å; L86-F150 HydrophobicContact CD2-CD1 4.36Å; L86-F150 HydrophobicContact CD2-CD2 3.8Å; L86-F150 HydrophobicContact CD2-CE1 4.34Å; L86-F150 HydrophobicContact CD2-CE2 3.79Å; L86-F150 HydrophobicContact CD2-CG 4.12Å; L86-F150 HydrophobicContact CD2-CZ 4.08Å
87	N	87.1	Confident	82.5	Confident	62 Å²	62	56.6 Å²	56.6	33%	0.332	31%	0.313	S	S	.	.	H	α-helix	trans	-58.6	-41.2	176.2	-85.7	-34.9	0	0	0	111.2	K83 N84 G91 A99	K83-N87 PolarHBondContact O-N 3.32Å; K83-N87 PolarHBondContact O-ND2 2.91Å; N84-N87 PolarHBondContact O-N 3.49Å; N87-G91 WeakPolarHBondContact O-CA 3.42Å; N87-G91 PolarHBondContact O-N 3.45Å; N87-A99 WeakPolarHBondContact OD1-CB 3.38Å
88	S	85.1	Confident	81.5	Confident	55 Å²	55	53.8 Å²	53.8	39%	0.385	30%	0.302	S	S	.	.	H	α-helix	trans	-67.7	-42	179.1	-58.2	0	0	0	0	112.3	N84 L85 L86 R92	N84-S88 VanDerWaalsContact O-CB 3.31Å; N84-S88 WeakPolarHBondContact O-CB 3.28Å; N84-S88 PolarHBondContact O-N 3.31Å; N84-S88 PolarHBondContact O-OG 2.95Å; L85-S88 PolarHBondContact O-N 2.92Å; L86-S88 VanDerWaalsContact C-N 3.26Å; L86-S88 PolarHBondContact O-N 3.09Å; S88-R92 WeakPolarHBondContact O-CB 3.32Å; S88-R92 PolarHBondContact O-N 3.2Å
89	V	86.5	Confident	80.8	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63	-51.3	176.3	173.8	0	0	0	0	110.4	L85 L86 R92 A93 W122 F150 L156 L162 Y168	L85-V89 WeakPolarHBondContact O-CG2 3.28Å; L85-V89 PolarHBondContact O-N 3.31Å; L86-V89 PolarHBondContact O-N 2.92Å; V89-R92 PolarHBondContact O-N 3.32Å; V89-A93 WeakPolarHBondContact O-CB 3.4Å; V89-A93 PolarHBondContact O-N 3.32Å; V89-W122 HydrophobicContact CG1-CZ3 4.36Å; V89-F150 HydrophobicContact CB-CD2 4.15Å; V89-F150 HydrophobicContact CB-CE2 4.17Å; V89-F150 HydrophobicContact CG1-CD2 3.72Å; V89-F150 HydrophobicContact CG1-CE2 3.75Å; V89-F150 HydrophobicContact CG2-CD2 4.4Å; V89-L156 HydrophobicContact CG2-CD2 3.49Å; V89-L156 VanDerWaalsContact CG2-CD2 3.49Å; V89-L156 HydrophobicContact CG2-CG 4.04Å; V89-L162 HydrophobicContact CB-CD2 4.26Å; V89-L162 HydrophobicContact CG2-CD2 3.4Å; V89-L162 VanDerWaalsContact CG2-CD2 3.4Å; V89-Y168 HydrophobicContact CG1-CE1 3.83Å
90	I	84.4	Confident	79.7	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-68	-42.7	-177.1	-63.1	178.4	0	0	0	110.8	L86 R92 A93 L94 I96 A99 K102 L103 W122 F150	L86-I90 WeakPolarHBondContact O-CG1 3.49Å; L86-I90 PolarHBondContact O-N 3.18Å; I90-R92 VanDerWaalsContact C-N 3.33Å; I90-R92 PolarHBondContact O-N 3.43Å; I90-A93 PolarHBondContact O-N 3.2Å; I90-L94 HydrophobicContact CG2-CD1 3.72Å; I90-L94 HydrophobicContact CG2-CG 4.33Å; I90-L94 WeakPolarHBondContact O-CB 3.42Å; I90-L94 PolarHBondContact O-N 3.04Å; I90-I96 HydrophobicContact CG2-CD1 4.32Å; I90-A99 HydrophobicContact CB-CB 3.78Å; I90-A99 HydrophobicContact CD1-CB 4.16Å; I90-A99 HydrophobicContact CG2-CB 3.55Å; I90-K102 HydrophobicContact CD1-CB 4.42Å; I90-K102 HydrophobicContact CG2-CB 4.26Å; I90-K102 HydrophobicContact CG2-CG 4.3Å; I90-L103 HydrophobicContact CD1-CD1 3.8Å; I90-L103 HydrophobicContact CD1-CD2 3.76Å; I90-L103 HydrophobicContact CD1-CG 3.63Å; I90-W122 HydrophobicContact CG1-CE3 4.08Å; I90-F150 HydrophobicContact CD1-CE2 4.49Å; I90-F150 HydrophobicContact CD1-CZ 4.28Å; I90-F150 HydrophobicContact CG1-CE2 4.07Å; I90-F150 HydrophobicContact CG1-CZ 4.26Å
91	G	80.6	Confident	79.3	Confident	13 Å²	13	59.7 Å²	59.7	13%	0.134	33%	0.325	C	S	.	.	H	α-helix	trans	-60.4	-42.6	177	0	0	0	0	0	112.1	N87 G95 I96	N87-G91 WeakPolarHBondContact O-CA 3.42Å; N87-G91 PolarHBondContact O-N 3.45Å; G91-G95 CarbonylContact O-C 3.5Å; G91-G95 VanDerWaalsContact O-CA 3.24Å; G91-G95 WeakPolarHBondContact O-CA 3.48Å; G91-G95 PolarHBondContact O-N 2.95Å; G91-I96 WeakPolarHBondContact CA-O 3.31Å; G91-I96 PolarHBondContact O-N 2.63Å; G91-I96 VanDerWaalsContact O-N 3.15Å
92	R	81	Confident	78.9	Confident	136 Å²	136	57.3 Å²	57.3	51%	0.513	31%	0.312	S	S	.	.	H	α-helix	trans	-74.8	-32.8	178.4	-164.5	162.6	-177.7	98.2	-1.7	113.4	S88 V89 I90 F163 Y168	S88-R92 WeakPolarHBondContact O-CB 3.32Å; S88-R92 PolarHBondContact O-N 3.2Å; V89-R92 PolarHBondContact O-N 3.32Å; I90-R92 VanDerWaalsContact C-N 3.33Å; I90-R92 PolarHBondContact O-N 3.43Å; R92-F163 VanDerWaalsContact CD-O 3.32Å; R92-F163 WeakPolarHBondContact CD-O 3.49Å; R92-F163 PolarHBondContact NE-O 3.47Å; R92-Y168 HydrophobicContact CB-CE2 4.36Å; R92-Y168 HydrophobicContact CG-CD2 4.4Å; R92-Y168 HydrophobicContact CG-CE2 4.35Å
93	A	80.3	Confident	78.6	Confident	13 Å²	13	57.8 Å²	57.8	11%	0.107	31%	0.314	C	S	.	.	H	α-helix	trans	-72.9	-39.3	177.2	0	0	0	0	0	113	V89 I90 W122 Y168	V89-A93 WeakPolarHBondContact O-CB 3.4Å; V89-A93 PolarHBondContact O-N 3.32Å; I90-A93 PolarHBondContact O-N 3.2Å; A93-W122 HydrophobicContact CB-CH2 3.31Å; A93-W122 HydrophobicContact CB-CZ2 3.68Å; A93-W122 HydrophobicContact CB-CZ3 3.87Å; A93-Y168 HydrophobicContact CB-CD1 4.08Å; A93-Y168 HydrophobicContact CB-CD2 4.18Å; A93-Y168 HydrophobicContact CB-CG 3.74Å
94	L	78.4	Confident	78.4	Confident	68 Å²	68	58.4 Å²	58.4	36%	0.356	32%	0.322	S	S	.	.	H	α-helix	trans	-99.2	-9.6	-176.9	-62.3	-179.6	0	0	0	113.9	I90 I96 K102 W122	I90-L94 HydrophobicContact CG2-CD1 3.72Å; I90-L94 HydrophobicContact CG2-CG 4.33Å; I90-L94 WeakPolarHBondContact O-CB 3.42Å; I90-L94 PolarHBondContact O-N 3.04Å; L94-I96 VanDerWaalsContact C-N 3.32Å; L94-I96 HydrophobicContact CB-CD1 4.09Å; L94-I96 HydrophobicContact CB-CG1 4.04Å; L94-I96 HydrophobicContact CB-CG2 4.28Å; L94-I96 HydrophobicContact CD1-CD1 3.93Å; L94-K102 HydrophobicContact CD1-CG 4.22Å; L94-W122 HydrophobicContact CD1-CG 4.29Å; L94-W122 HydrophobicContact CD2-CG 4.43Å
95	G	73	Confident	78.5	Confident	66 Å²	66	56.5 Å²	56.5	68%	0.68	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	26.8	-175.8	0	0	0	0	0	113.9	G91	G91-G95 CarbonylContact O-C 3.5Å; G91-G95 VanDerWaalsContact O-CA 3.24Å; G91-G95 WeakPolarHBondContact O-CA 3.48Å; G91-G95 PolarHBondContact O-N 2.95Å
96	I	73.8	Confident	78.4	Confident	65 Å²	65	58 Å²	58	33%	0.333	32%	0.319	S	S	.	.			trans	-107.6	148.5	-178.5	63.1	-176.9	0	0	0	111.4	I90 G91 L94 H98	I90-I96 HydrophobicContact CG2-CD1 4.32Å; G91-I96 WeakPolarHBondContact CA-O 3.31Å; G91-I96 PolarHBondContact O-N 2.63Å; G91-I96 VanDerWaalsContact O-N 3.15Å; L94-I96 VanDerWaalsContact C-N 3.32Å; L94-I96 HydrophobicContact CB-CD1 4.09Å; L94-I96 HydrophobicContact CB-CG1 4.04Å; L94-I96 HydrophobicContact CB-CG2 4.28Å; L94-I96 HydrophobicContact CD1-CD1 3.93Å; I96-H98 WeakPolarHBondContact CD1-O 3.43Å
97	S	59.2	Low	78.3	Confident	109 Å²	109	61.7 Å²	61.7	76%	0.762	34%	0.336	S	S	*	.	S	Bend	trans	-70.9	-32.3	179.4	51.2	0	0	0	0	113.3
98	H	59.6	Low	77.9	Confident	95 Å²	95	61.6 Å²	61.6	44%	0.44	34%	0.337	S	S	.	.			trans	-142.4	139.4	-179.7	-58.5	-73.2	0	0	0	112.3	I96 K100 E222	I96-H98 WeakPolarHBondContact CD1-O 3.43Å; H98-K100 HydrophobicContact CB-CG 4.41Å; H98-E222 IonicContact CE1-OE1 2.67Å; H98-E222 PolarHBondContact CE1-OE1 3.22Å
99	A	67.4	Low	77.3	Confident	0 Å²	0	66 Å²	66	0%	0	36%	0.357	C	S	.	.			trans	-94.1	21.5	-179.6	0	0	0	0	0	113.8	N87 I90 D101 K102 L103	N87-A99 WeakPolarHBondContact OD1-CB 3.38Å; I90-A99 HydrophobicContact CB-CB 3.78Å; I90-A99 HydrophobicContact CD1-CB 4.16Å; I90-A99 HydrophobicContact CG2-CB 3.55Å; A99-D101 VanDerWaalsContact C-N 3.31Å; A99-D101 PolarHBondContact O-N 2.82Å; A99-K102 HydrophobicContact CB-CB 4.43Å; A99-K102 CarbonylContact O-C 3.45Å; A99-K102 WeakPolarHBondContact O-CA 3.29Å; A99-K102 WeakPolarHBondContact O-CB 3.31Å; A99-K102 PolarHBondContact O-N 3.34Å; A99-L103 HydrophobicContact CB-CD1 4.02Å; A99-L103 HydrophobicContact CB-CG 4.35Å; A99-L103 PolarHBondContact O-N 3.03Å
100	K	65.2	Low	76.1	Confident	156 Å²	156	67.6 Å²	67.6	68%	0.678	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-43.8	-172.8	-72.7	-174	178.3	-177.6	0	112.7	H98 K102 L103	H98-K100 HydrophobicContact CB-CG 4.41Å; K100-K102 PolarHBondContact O-N 2.78Å; K100-L103 CarbonylContact O-C 3.54Å; K100-L103 PolarHBondContact O-N 3.32Å
101	D	72.7	Confident	75	Confident	129 Å²	129	74.3 Å²	74.3	69%	0.69	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-16.1	-179.7	-59.2	-16.4	0	0	0	113.7	A99 K121	A99-D101 VanDerWaalsContact C-N 3.31Å; A99-D101 PolarHBondContact O-N 2.82Å; D101-K121 WeakPolarHBondContact O-CD 3.31Å; D101-K121 PolarHBondContact O-NZ 3.45Å
102	K	79.6	Confident	74.3	Confident	77 Å²	77	83.4 Å²	83.4	34%	0.335	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-21.3	-178.4	-54.4	-58.3	-176.6	-175.4	0	112.9	I90 L94 A99 K100 I120 K121	I90-K102 HydrophobicContact CD1-CB 4.42Å; I90-K102 HydrophobicContact CG2-CB 4.26Å; I90-K102 HydrophobicContact CG2-CG 4.3Å; L94-K102 HydrophobicContact CD1-CG 4.22Å; A99-K102 HydrophobicContact CB-CB 4.43Å; A99-K102 CarbonylContact O-C 3.45Å; A99-K102 WeakPolarHBondContact O-CA 3.29Å; A99-K102 WeakPolarHBondContact O-CB 3.31Å; A99-K102 PolarHBondContact O-N 3.34Å; K100-K102 PolarHBondContact O-N 2.78Å; K102-I120 CarbonylContact O-C 3.26Å; K102-I120 VanDerWaalsContact O-CA 3.32Å; K102-I120 WeakPolarHBondContact O-CA 3.49Å; K102-K121 HydrophobicContact CD-CB 4.3Å; K102-K121 PolarHBondContact O-N 2.9Å
103	L	84.6	Confident	74	Confident	11 Å²	11	81.8 Å²	81.8	6%	0.058	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	93.5	179.4	-67.5	172.9	0	0	0	109.6	L86 I90 A99 K100 Y105 L118 H119 I120	L86-L103 HydrophobicContact CB-CD1 3.86Å; L86-L103 HydrophobicContact CD1-CD2 4.45Å; I90-L103 HydrophobicContact CD1-CD1 3.8Å; I90-L103 HydrophobicContact CD1-CD2 3.76Å; I90-L103 HydrophobicContact CD1-CG 3.63Å; A99-L103 HydrophobicContact CB-CD1 4.02Å; A99-L103 HydrophobicContact CB-CG 4.35Å; A99-L103 PolarHBondContact O-N 3.03Å; K100-L103 CarbonylContact O-C 3.54Å; K100-L103 PolarHBondContact O-N 3.32Å; L103-Y105 HydrophobicContact CB-CE2 4.39Å; L103-L118 HydrophobicContact CB-CD1 4.11Å; L103-L118 HydrophobicContact CD2-CD1 4.08Å; L103-L118 HydrophobicContact CD2-CD2 4.47Å; L103-H119 WeakPolarHBondContact CA-O 3.24Å; L103-I120 HydrophobicContact CD2-CB 4.29Å; L103-I120 HydrophobicContact CD2-CG1 3.9Å; L103-I120 HydrophobicContact CD2-CG2 3.95Å
104	V	85.3	Confident	74	Confident	56 Å²	56	85.6 Å²	85.6	34%	0.339	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	119.3	-179.1	-177.1	0	0	0	0	109.7	V106 L118 H119	V104-V106 HydrophobicContact CG1-CG2 4.23Å; V104-L118 WeakPolarHBondContact O-CA 3.4Å; V104-H119 HydrophobicContact CB-CB 4.33Å; V104-H119 PolarHBondContact N-O 2.78Å; V104-H119 PolarHBondContact O-N 3.17Å
105	Y	89.1	Confident	74.4	Confident	47 Å²	47	84.9 Å²	84.9	18%	0.184	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	116.3	176.1	-64	-95.7	0	0	0	109.9	L103 V116 L118 E139	L103-Y105 HydrophobicContact CB-CE2 4.39Å; Y105-V116 HydrophobicContact CD1-CG1 3.8Å; Y105-V116 HydrophobicContact CG-CG1 4.42Å; Y105-L118 HydrophobicContact CD1-CB 4.12Å; Y105-L118 HydrophobicContact CD1-CD1 3.84Å; Y105-L118 HydrophobicContact CD1-CG 4.4Å; Y105-L118 HydrophobicContact CD2-CD1 3.96Å; Y105-L118 HydrophobicContact CE1-CB 4.12Å; Y105-L118 HydrophobicContact CE1-CD1 3.64Å; Y105-L118 HydrophobicContact CE1-CD2 3.84Å; Y105-L118 HydrophobicContact CE1-CG 4.06Å; Y105-L118 HydrophobicContact CE2-CD1 3.73Å; Y105-L118 HydrophobicContact CG-CD1 4.01Å; Y105-E139 HydrophobicContact CD1-CB 4.13Å; Y105-E139 HydrophobicContact CD1-CG 3.88Å; Y105-E139 HydrophobicContact CE1-CB 4.15Å; Y105-E139 HydrophobicContact CE1-CG 4.38Å; Y105-E139 HydrophobicContact CG-CG 4.37Å
106	V	85.5	Confident	75.3	Confident	60 Å²	60	81.7 Å²	81.7	36%	0.364	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	117.8	176.6	178.7	0	0	0	0	109.3	V104 V116 T117 H119	V104-V106 HydrophobicContact CG1-CG2 4.23Å; V106-V116 WeakPolarHBondContact O-CA 3.36Å; V106-T117 PolarHBondContact N-O 3.37Å; V106-T117 PolarHBondContact O-N 2.84Å; V106-H119 WeakPolarHBondContact CG2-NE2 3.49Å
107	H	85.9	Confident	76	Confident	77 Å²	77	79.3 Å²	79.3	36%	0.356	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.2	-178.7	-53.9	-75.4	0	0	0	111	V116 K135 E139	H107-V116 WeakPolarHBondContact ND1-CG2 3.2Å; H107-K135 VanDerWaalsContact CD2-CE 3.44Å; H107-K135 WeakPolarHBondContact CD2-CE 3.34Å; H107-K135 WeakPolarHBondContact CE1-CE 3.45Å; H107-K135 WeakPolarHBondContact NE2-CE 3.38Å; H107-E139 IonicContact CE1-OE1 3.57Å; H107-E139 PolarHBondContact CE1-OE1 3.46Å; H107-E139 IonicContact NE2-OE1 3.88Å
108	T	79.2	Confident	77.5	Confident	60 Å²	60	74.1 Å²	74.1	37%	0.368	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.1	171.9	40	0	0	0	0	110.1	G110 K115	T108-G110 PolarHBondContact O-N 3.25Å; T108-K115 PolarHBondContact N-O 2.77Å; T108-K115 PolarHBondContact O-N 3.23Å; T108-K115 VanDerWaalsContact O-N 3.12Å; T108-K115 VanDerWaalsContact O-O 3.09Å; T108-K115 WeakPolarHBondContact OG1-CB 3.3Å; T108-K115 WeakPolarHBondContact OG1-CG 3.35Å; T108-K115 PolarHBondContact OG1-O 3.46Å
109	N	71.9	Confident	78.9	Confident	148 Å²	148	71.8 Å²	71.8	79%	0.791	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	101.4	178.2	-80.5	-23.9	0	0	0	109.8
110	G	61.2	Low	80	Confident	34 Å²	34	71.9 Å²	71.9	35%	0.351	37%	0.367	S	S	.	.			trans	-84	157.5	170.7	0	0	0	0	0	112.7	T108 K112 K113	T108-G110 PolarHBondContact O-N 3.25Å; G110-K112 VanDerWaalsContact C-N 3.31Å; G110-K112 PolarHBondContact O-N 2.96Å; G110-K113 WeakPolarHBondContact CA-O 3.47Å
111	P	62.1	Low	80.8	Confident	140 Å²	140	69.2 Å²	69.2	91%	0.909	36%	0.355	S	S	*	.	S	Bend	trans	-68	-19.7	-172.8	23.3	-32.7	0	0	0	115.4
112	K	64.9	Low	81.4	Confident	205 Å²	205	64.2 Å²	64.2	89%	0.891	33%	0.326	S	S	*	.	S	Bend	trans	-132.3	-21.2	179.8	-72.4	-177.7	179.8	172.6	0	115.3	G110	G110-K112 VanDerWaalsContact C-N 3.31Å; G110-K112 PolarHBondContact O-N 2.96Å
113	K	75.6	Confident	81.2	Confident	101 Å²	101	60.7 Å²	60.7	44%	0.439	31%	0.311	S	S	.	.	S	Bend	trans	-141	147.8	179.5	-67.5	179.3	-176.6	169	0	108.8	G110	G110-K113 WeakPolarHBondContact CA-O 3.47Å
114	K	80.9	Confident	80.9	Confident	94 Å²	94	64.4 Å²	64.4	41%	0.409	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	125.5	172.9	-65.3	-159.1	177.3	-166.5	0	108.5	Y131 G132 K135 A138	K114-Y131 WeakPolarHBondContact O-CA 3.43Å; K114-G132 PolarHBondContact N-O 3.21Å; K114-G132 PolarHBondContact O-N 3.39Å; K114-K135 HydrophobicContact CD-CB 4.22Å; K114-A138 WeakPolarHBondContact O-CB 3.23Å
115	K	86	Confident	80.8	Confident	52 Å²	52	66.3 Å²	66.3	23%	0.226	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	136.4	177.5	178.1	179.5	174.4	163.9	0	108.7	T108 E129 G130 Y131	T108-K115 PolarHBondContact N-O 2.77Å; T108-K115 PolarHBondContact O-N 3.23Å; T108-K115 VanDerWaalsContact O-N 3.12Å; T108-K115 VanDerWaalsContact O-O 3.09Å; T108-K115 WeakPolarHBondContact OG1-CB 3.3Å; T108-K115 WeakPolarHBondContact OG1-CG 3.35Å; T108-K115 PolarHBondContact OG1-O 3.46Å; K115-E129 WeakPolarHBondContact CE-OE1 3.37Å; K115-E129 WeakPolarHBondContact CE-OE2 3.27Å; K115-E129 IonicContact NZ-OE1 3.64Å; K115-E129 PolarHBondContact NZ-OE1 3.31Å; K115-E129 IonicContact NZ-OE2 3.78Å; K115-E129 PolarHBondContact NZ-OE2 2.8Å; K115-G130 WeakPolarHBondContact CA-O 3.33Å; K115-Y131 HydrophobicContact CB-CD1 4.04Å; K115-Y131 HydrophobicContact CB-CE1 3.84Å; K115-Y131 HydrophobicContact CD-CE1 3.7Å; K115-Y131 WeakPolarHBondContact CD-OH 3.36Å; K115-Y131 VanDerWaalsContact CE-OH 3.31Å; K115-Y131 WeakPolarHBondContact CE-OH 3.33Å; K115-Y131 HydrophobicContact CG-CD1 4.18Å; K115-Y131 HydrophobicContact CG-CE1 3.62Å; K115-Y131 PolarHBondContact NZ-OH 3.28Å
116	V	91.2	Very high	80.7	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	125.4	174.6	177.5	0	0	0	0	108.7	Y105 V106 H107 E129 G130 A138 E139	Y105-V116 HydrophobicContact CD1-CG1 3.8Å; Y105-V116 HydrophobicContact CG-CG1 4.42Å; V106-V116 WeakPolarHBondContact O-CA 3.36Å; H107-V116 WeakPolarHBondContact ND1-CG2 3.2Å; V116-E129 CarbonylContact O-C 3.6Å; V116-E129 WeakPolarHBondContact O-CA 3.31Å; V116-G130 PolarHBondContact N-O 3.25Å; V116-G130 PolarHBondContact O-N 2.63Å; V116-A138 HydrophobicContact CB-CB 4.02Å; V116-A138 HydrophobicContact CG2-CB 3.46Å; V116-A138 VanDerWaalsContact CG2-CB 3.46Å; V116-E139 HydrophobicContact CG1-CG 4.06Å; V116-E139 HydrophobicContact CG2-CG 4.3Å
117	T	88.8	Confident	80.8	Confident	14 Å²	14	68.8 Å²	68.8	9%	0.086	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	114.5	172.3	-54.3	0	0	0	0	107.8	V106 E127 V128 E129	V106-T117 PolarHBondContact N-O 3.37Å; V106-T117 PolarHBondContact O-N 2.84Å; T117-E127 HydrophobicContact CG2-CB 4.11Å; T117-V128 CarbonylContact C-O 3.55Å; T117-E129 HydrophobicContact CG2-CG 4.41Å
118	L	91.8	Very high	81	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	112.2	174.3	172.5	56.3	0	0	0	109	L86 L103 V104 Y105 I120 E127 V128 A142 A146	L86-L118 HydrophobicContact CD1-CD2 4.01Å; L103-L118 HydrophobicContact CB-CD1 4.11Å; L103-L118 HydrophobicContact CD2-CD1 4.08Å; L103-L118 HydrophobicContact CD2-CD2 4.47Å; V104-L118 WeakPolarHBondContact O-CA 3.4Å; Y105-L118 HydrophobicContact CD1-CB 4.12Å; Y105-L118 HydrophobicContact CD1-CD1 3.84Å; Y105-L118 HydrophobicContact CD1-CG 4.4Å; Y105-L118 HydrophobicContact CD2-CD1 3.96Å; Y105-L118 HydrophobicContact CE1-CB 4.12Å; Y105-L118 HydrophobicContact CE1-CD1 3.64Å; Y105-L118 HydrophobicContact CE1-CD2 3.84Å; Y105-L118 HydrophobicContact CE1-CG 4.06Å; Y105-L118 HydrophobicContact CE2-CD1 3.73Å; Y105-L118 HydrophobicContact CG-CD1 4.01Å; L118-I120 HydrophobicContact CD2-CD1 4.4Å; L118-I120 HydrophobicContact CD2-CG1 4.2Å; L118-I120 HydrophobicContact CG-CG1 3.87Å; L118-E127 WeakPolarHBondContact O-CA 3.24Å; L118-V128 PolarHBondContact N-O 2.86Å; L118-V128 PolarHBondContact O-N 2.9Å; L118-A142 HydrophobicContact CB-CB 3.89Å; L118-A146 HydrophobicContact CD2-CB 3.81Å
119	H	89.1	Confident	81.5	Confident	46 Å²	46	67 Å²	67	21%	0.213	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	116	171.6	-55.7	-96.7	0	0	0	109.2	L103 V104 V106 E127	L103-H119 WeakPolarHBondContact CA-O 3.24Å; V104-H119 HydrophobicContact CB-CB 4.33Å; V104-H119 PolarHBondContact N-O 2.78Å; V104-H119 PolarHBondContact O-N 3.17Å; V106-H119 WeakPolarHBondContact CG2-NE2 3.49Å; H119-E127 IonicContact CE1-OE1 2.9Å; H119-E127 PolarHBondContact CE1-OE1 3.38Å; H119-E127 IonicContact CE1-OE2 3.9Å; H119-E127 WeakPolarHBondContact ND1-CG 3.27Å; H119-E127 IonicContact ND1-OE1 2.62Å; H119-E127 PolarHBondContact ND1-OE1 3.03Å; H119-E127 IonicContact ND1-OE2 2.62Å
120	I	90	Very high	82.3	Confident	2 Å²	2	60 Å²	60	1%	0.01	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.5	178.9	-49	171.9	0	0	0	107.4	K102 L103 L118 W122 S125 V126 V128 A146 F150	K102-I120 CarbonylContact O-C 3.26Å; K102-I120 VanDerWaalsContact O-CA 3.32Å; K102-I120 WeakPolarHBondContact O-CA 3.49Å; L103-I120 HydrophobicContact CD2-CB 4.29Å; L103-I120 HydrophobicContact CD2-CG1 3.9Å; L103-I120 HydrophobicContact CD2-CG2 3.95Å; L118-I120 HydrophobicContact CD2-CD1 4.4Å; L118-I120 HydrophobicContact CD2-CG1 4.2Å; L118-I120 HydrophobicContact CG-CG1 3.87Å; I120-W122 WeakPolarHBondContact CG2-O 3.44Å; I120-S125 CarbonylContact O-C 3.38Å; I120-S125 WeakPolarHBondContact O-CA 3.48Å; I120-V126 PolarHBondContact N-O 3.16Å; I120-V126 PolarHBondContact O-N 3Å; I120-V128 HydrophobicContact CD1-CG2 3.99Å; I120-A146 HydrophobicContact CD1-CB 3.42Å; I120-A146 VanDerWaalsContact CD1-CB 3.42Å; I120-F150 HydrophobicContact CD1-CE1 4.36Å; I120-F150 HydrophobicContact CG2-CE1 4.07Å; I120-F150 HydrophobicContact CG2-CZ 4.07Å
121	K	82.6	Confident	83.5	Confident	101 Å²	101	61.8 Å²	61.8	44%	0.439	30%	0.302	S	S	.	.			trans	-95.6	1.8	-178	-60.1	-175.1	-172	160.2	0	114.5	D101 K102	D101-K121 WeakPolarHBondContact O-CD 3.31Å; D101-K121 PolarHBondContact O-NZ 3.45Å; K102-K121 HydrophobicContact CD-CB 4.3Å; K102-K121 PolarHBondContact O-N 2.9Å
122	W	84.5	Confident	84.6	Confident	23 Å²	23	55.3 Å²	55.3	9%	0.087	26%	0.261	C	S	.	.	S	Bend	trans	-148.3	140.9	-178.5	-176.3	90.6	0	0	0	111.6	V89 I90 A93 L94 I120 K124 L155 Y168 A172	V89-W122 HydrophobicContact CG1-CZ3 4.36Å; I90-W122 HydrophobicContact CG1-CE3 4.08Å; A93-W122 HydrophobicContact CB-CH2 3.31Å; A93-W122 HydrophobicContact CB-CZ2 3.68Å; A93-W122 HydrophobicContact CB-CZ3 3.87Å; L94-W122 HydrophobicContact CD1-CG 4.29Å; L94-W122 HydrophobicContact CD2-CG 4.43Å; I120-W122 WeakPolarHBondContact CG2-O 3.44Å; W122-K124 VanDerWaalsContact C-N 3.35Å; W122-L155 HydrophobicContact CH2-CD1 4.48Å; W122-L155 HydrophobicContact CH2-CD2 4.29Å; W122-L155 HydrophobicContact CZ3-CD1 4.13Å; W122-Y168 HydrophobicContact CH2-CD1 4.5Å; W122-A172 HydrophobicContact CZ2-CB 4.03Å
123	P	74.9	Confident	85.3	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.019	25%	0.252	C	S	.	.	S	Bend	cis	-71	-22.7	0.7	31.8	-40.9	0	0	0	114.3	W153 L155 F175	P123-W153 HydrophobicContact CG-CE3 3.89Å; P123-W153 HydrophobicContact CG-CZ3 4.01Å; P123-L155 HydrophobicContact CG-CD1 3.87Å; P123-F175 HydrophobicContact CB-CB 3.83Å; P123-F175 HydrophobicContact CB-CD2 3.98Å; P123-F175 HydrophobicContact CB-CG 3.99Å; P123-F175 HydrophobicContact CG-CB 4.3Å; P123-F175 HydrophobicContact CG-CD1 4.49Å; P123-F175 HydrophobicContact CG-CD2 3.97Å; P123-F175 HydrophobicContact CG-CG 3.98Å
124	K	79.2	Confident	85.6	Confident	90 Å²	90	52.1 Å²	52.1	39%	0.391	26%	0.259	S	S	.	.	S	Bend	trans	-133.4	157	172.7	65.3	-179.6	-177.2	176.8	0	109.4	W122 V126 W153	W122-K124 VanDerWaalsContact C-N 3.35Å; K124-V126 HydrophobicContact CD-CG2 4.31Å; K124-V126 HydrophobicContact CG-CG2 3.85Å; K124-V126 PolarHBondContact O-N 3.01Å; K124-W153 HydrophobicContact CG-CH2 4.24Å
125	S	81.8	Confident	85.7	Confident	96 Å²	96	51.9 Å²	51.9	67%	0.671	26%	0.258	S	S	*	.			trans	-66	114.5	176.4	-65.2	0	0	0	0	110.9	I120	I120-S125 CarbonylContact O-C 3.38Å; I120-S125 WeakPolarHBondContact O-CA 3.48Å
126	V	87.5	Confident	85.6	Confident	31 Å²	31	53.6 Å²	53.6	19%	0.188	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	144.2	175.4	178.4	0	0	0	0	109.9	I120 K124 V128 L149 W153	I120-V126 PolarHBondContact N-O 3.16Å; I120-V126 PolarHBondContact O-N 3Å; K124-V126 HydrophobicContact CD-CG2 4.31Å; K124-V126 HydrophobicContact CG-CG2 3.85Å; K124-V126 PolarHBondContact O-N 3.01Å; V126-V128 HydrophobicContact CG1-CG2 4.11Å; V126-L149 HydrophobicContact CG1-CD1 3.86Å; V126-W153 HydrophobicContact CB-CH2 4.14Å; V126-W153 HydrophobicContact CG2-CH2 3.53Å; V126-W153 HydrophobicContact CG2-CZ2 3.88Å
127	E	88.3	Confident	85.3	Confident	127 Å²	127	56.3 Å²	56.3	59%	0.593	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	134.4	174.4	-55.3	-171.7	172.3	0	0	109.5	T117 L118 H119	T117-E127 HydrophobicContact CG2-CB 4.11Å; L118-E127 WeakPolarHBondContact O-CA 3.24Å; H119-E127 IonicContact CE1-OE1 2.9Å; H119-E127 PolarHBondContact CE1-OE1 3.38Å; H119-E127 IonicContact CE1-OE2 3.9Å; H119-E127 WeakPolarHBondContact ND1-CG 3.27Å; H119-E127 IonicContact ND1-OE1 2.62Å; H119-E127 PolarHBondContact ND1-OE1 3.03Å; H119-E127 IonicContact ND1-OE2 2.62Å
128	V	90.3	Very high	85.2	Confident	14 Å²	14	55.6 Å²	55.6	9%	0.085	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	133	180	-171.1	0	0	0	0	109.1	T117 L118 I120 V126 A145 A146 L149	T117-V128 CarbonylContact C-O 3.55Å; L118-V128 PolarHBondContact N-O 2.86Å; L118-V128 PolarHBondContact O-N 2.9Å; I120-V128 HydrophobicContact CD1-CG2 3.99Å; V126-V128 HydrophobicContact CG1-CG2 4.11Å; V128-A145 HydrophobicContact CG1-CB 3.34Å; V128-A146 HydrophobicContact CG2-CB 4.23Å; V128-L149 HydrophobicContact CG2-CD1 3.51Å
129	E	89.2	Confident	85.2	Confident	86 Å²	86	56.1 Å²	56.1	40%	0.402	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	142.3	-178.7	-57	-171.7	157.4	0	0	112	K115 V116 T117 Y131	K115-E129 WeakPolarHBondContact CE-OE1 3.37Å; K115-E129 WeakPolarHBondContact CE-OE2 3.27Å; K115-E129 IonicContact NZ-OE1 3.64Å; K115-E129 PolarHBondContact NZ-OE1 3.31Å; K115-E129 IonicContact NZ-OE2 3.78Å; K115-E129 PolarHBondContact NZ-OE2 2.8Å; V116-E129 CarbonylContact O-C 3.6Å; V116-E129 WeakPolarHBondContact O-CA 3.31Å; T117-E129 HydrophobicContact CG2-CG 4.41Å; E129-Y131 HydrophobicContact CB-CE2 3.94Å; E129-Y131 PolarHBondContact OE2-OH 2.93Å
130	G	88.8	Confident	85.3	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	147.1	173.1	0	0	0	0	0	111.7	K115 V116 A138	K115-G130 WeakPolarHBondContact CA-O 3.33Å; V116-G130 PolarHBondContact N-O 3.25Å; V116-G130 PolarHBondContact O-N 2.63Å; G130-A138 WeakPolarHBondContact CA-O 3.45Å
131	Y	86.5	Confident	85.3	Confident	73 Å²	73	60.2 Å²	60.2	29%	0.286	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	102.5	-170.7	-67.9	-89.2	0	0	0	111.5	M68 K114 K115 E129 Q141	M68-Y131 HydrophobicContact CE-CD2 4.21Å; M68-Y131 HydrophobicContact CE-CE2 4.43Å; K114-Y131 WeakPolarHBondContact O-CA 3.43Å; K115-Y131 HydrophobicContact CB-CD1 4.04Å; K115-Y131 HydrophobicContact CB-CE1 3.84Å; K115-Y131 HydrophobicContact CD-CE1 3.7Å; K115-Y131 WeakPolarHBondContact CD-OH 3.36Å; K115-Y131 VanDerWaalsContact CE-OH 3.31Å; K115-Y131 WeakPolarHBondContact CE-OH 3.33Å; K115-Y131 HydrophobicContact CG-CD1 4.18Å; K115-Y131 HydrophobicContact CG-CE1 3.62Å; K115-Y131 PolarHBondContact NZ-OH 3.28Å; E129-Y131 HydrophobicContact CB-CE2 3.94Å; E129-Y131 PolarHBondContact OE2-OH 2.93Å; Y131-Q141 VanDerWaalsContact C-OE1 3.23Å; Y131-Q141 PolarHBondContact O-OE1 2.93Å
132	G	84	Confident	85.8	Confident	4 Å²	4	55.4 Å²	55.4	4%	0.041	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	159	-172.9	0	0	0	0	0	114.7	K114 K134 A138	K114-G132 PolarHBondContact N-O 3.21Å; K114-G132 PolarHBondContact O-N 3.39Å; G132-K134 VanDerWaalsContact C-N 3.33Å; G132-A138 VanDerWaalsContact N-CB 3.29Å
133	S	80.1	Confident	86.1	Confident	100 Å²	100	54.3 Å²	54.3	70%	0.699	27%	0.271	S	S	*	.	S	Bend	trans	-70.5	-34.5	166.2	78	0	0	0	0	111.4	D137	S133-D137 PolarHBondContact OG-OD2 3.45Å
134	K	82.5	Confident	86.9	Confident	138 Å²	138	54.1 Å²	54.1	60%	0.6	27%	0.27	S	S	*	.	S	Bend	trans	-116.3	162.6	172.1	-60.7	178.9	-179.1	-178.7	0	110.4	G132 I136 D137 A138	G132-K134 VanDerWaalsContact C-N 3.33Å; K134-I136 VanDerWaalsContact C-N 3.28Å; K134-I136 HydrophobicContact CB-CG2 4.26Å; K134-I136 PolarHBondContact O-N 3.41Å; K134-D137 WeakPolarHBondContact CB-OD2 3.41Å; K134-D137 PolarHBondContact N-OD2 2.97Å; K134-D137 PolarHBondContact O-N 3.4Å; K134-A138 PolarHBondContact O-N 3.36Å; K134-A138 VanDerWaalsContact O-N 3.14Å
135	K	82.1	Confident	87.4	Confident	89 Å²	89	50.8 Å²	50.8	39%	0.387	26%	0.259	S	S	.	.	H	α-helix	trans	-54.3	-47.5	176.3	-174.2	-170.7	174	-169.5	0	110.6	H107 K114 D137 A138 E139	H107-K135 VanDerWaalsContact CD2-CE 3.44Å; H107-K135 WeakPolarHBondContact CD2-CE 3.34Å; H107-K135 WeakPolarHBondContact CE1-CE 3.45Å; H107-K135 WeakPolarHBondContact NE2-CE 3.38Å; K114-K135 HydrophobicContact CD-CB 4.22Å; K135-D137 PolarHBondContact O-N 3.37Å; K135-A138 WeakPolarHBondContact O-CB 3.36Å; K135-A138 PolarHBondContact O-N 3.19Å; K135-E139 WeakPolarHBondContact CE-OE1 3.44Å; K135-E139 PolarHBondContact O-N 2.92Å
136	I	84.5	Confident	87.9	Confident	89 Å²	89	46.2 Å²	46.2	46%	0.456	23%	0.227	S	C	.	.	H	α-helix	trans	-65.8	-34.1	-179.8	-155.3	161.3	0	0	0	113.3	K134 A138 R140	K134-I136 VanDerWaalsContact C-N 3.28Å; K134-I136 HydrophobicContact CB-CG2 4.26Å; K134-I136 PolarHBondContact O-N 3.41Å; I136-A138 VanDerWaalsContact C-N 3.34Å; I136-R140 WeakPolarHBondContact O-CB 3.31Å; I136-R140 VanDerWaalsContact O-CG 3.28Å; I136-R140 WeakPolarHBondContact O-CG 3.42Å; I136-R140 PolarHBondContact O-N 3.46Å
137	D	84.8	Confident	88.1	Confident	56 Å²	56	44.7 Å²	44.7	30%	0.299	22%	0.218	S	C	.	.	H	α-helix	trans	-68	-39.9	177.4	-59.5	-26.1	0	0	0	110.4	S133 K134 K135 R140 Q141	S133-D137 PolarHBondContact OG-OD2 3.45Å; K134-D137 WeakPolarHBondContact CB-OD2 3.41Å; K134-D137 PolarHBondContact N-OD2 2.97Å; K134-D137 PolarHBondContact O-N 3.4Å; K135-D137 PolarHBondContact O-N 3.37Å; D137-R140 PolarHBondContact O-N 3.15Å; D137-Q141 WeakPolarHBondContact O-CB 3.47Å; D137-Q141 PolarHBondContact O-N 3.27Å
138	A	87.8	Confident	88.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66	-42.7	178.5	0	0	0	0	0	111.1	K114 V116 G130 G132 K134 K135 I136 Q141 A142	K114-A138 WeakPolarHBondContact O-CB 3.23Å; V116-A138 HydrophobicContact CB-CB 4.02Å; V116-A138 HydrophobicContact CG2-CB 3.46Å; V116-A138 VanDerWaalsContact CG2-CB 3.46Å; G130-A138 WeakPolarHBondContact CA-O 3.45Å; G132-A138 VanDerWaalsContact N-CB 3.29Å; K134-A138 PolarHBondContact O-N 3.36Å; K134-A138 VanDerWaalsContact O-N 3.14Å; K135-A138 WeakPolarHBondContact O-CB 3.36Å; K135-A138 PolarHBondContact O-N 3.19Å; I136-A138 VanDerWaalsContact C-N 3.34Å; A138-Q141 PolarHBondContact O-N 2.81Å; A138-A142 WeakPolarHBondContact O-CB 3.38Å; A138-A142 PolarHBondContact O-N 3.44Å
139	E	91.6	Very high	88.1	Confident	11 Å²	11	45.5 Å²	45.5	5%	0.051	22%	0.223	C	C	.	.	H	α-helix	trans	-62	-47.1	172.8	-72.4	172.9	-151.7	0	0	112.3	K83 Y105 H107 V116 K135 Q141 A142 A143	K83-E139 HydrophobicContact CD-CB 4.47Å; K83-E139 IonicContact NZ-OE2 3.86Å; K83-E139 PolarHBondContact NZ-OE2 2.93Å; Y105-E139 HydrophobicContact CD1-CB 4.13Å; Y105-E139 HydrophobicContact CD1-CG 3.88Å; Y105-E139 HydrophobicContact CE1-CB 4.15Å; Y105-E139 HydrophobicContact CE1-CG 4.38Å; Y105-E139 HydrophobicContact CG-CG 4.37Å; H107-E139 IonicContact CE1-OE1 3.57Å; H107-E139 PolarHBondContact CE1-OE1 3.46Å; H107-E139 IonicContact NE2-OE1 3.88Å; V116-E139 HydrophobicContact CG1-CG 4.06Å; V116-E139 HydrophobicContact CG2-CG 4.3Å; K135-E139 WeakPolarHBondContact CE-OE1 3.44Å; K135-E139 PolarHBondContact O-N 2.92Å; E139-Q141 PolarHBondContact O-N 3.08Å; E139-A142 PolarHBondContact O-N 3.03Å; E139-A143 VanDerWaalsContact O-CB 3.28Å; E139-A143 WeakPolarHBondContact O-CB 3.27Å; E139-A143 PolarHBondContact O-N 2.82Å
140	R	91.2	Very high	88.1	Confident	107 Å²	107	41.4 Å²	41.4	40%	0.404	20%	0.204	S	C	.	.	H	α-helix	trans	-61.1	-37.1	178.5	-74.5	-180	83.6	173.5	7.8	111.2	L76 P80 P82 I136 D137 A144	L76-R140 HydrophobicContact CD2-CB 4.11Å; P80-R140 PolarHBondContact O-NH2 3.27Å; P82-R140 HydrophobicContact CG-CB 4.36Å; P82-R140 VanDerWaalsContact CG-O 3.22Å; P82-R140 WeakPolarHBondContact CG-O 3.29Å; I136-R140 WeakPolarHBondContact O-CB 3.31Å; I136-R140 VanDerWaalsContact O-CG 3.28Å; I136-R140 WeakPolarHBondContact O-CG 3.42Å; I136-R140 PolarHBondContact O-N 3.46Å; D137-R140 PolarHBondContact O-N 3.15Å; R140-A144 VanDerWaalsContact O-CB 3.32Å; R140-A144 WeakPolarHBondContact O-CB 3.44Å; R140-A144 PolarHBondContact O-N 3.22Å
141	Q	89.9	Confident	88	Confident	26 Å²	26	43.9 Å²	43.9	12%	0.121	21%	0.214	C	C	.	.	H	α-helix	trans	-69.6	-45.5	175.9	-173.5	178.6	0.1	0	0	112.3	S72 Y131 D137 A138 E139 A143 A144 A145	S72-Q141 VanDerWaalsContact CB-NE2 3.32Å; S72-Q141 PolarHBondContact OG-NE2 3.13Å; Y131-Q141 VanDerWaalsContact C-OE1 3.23Å; Y131-Q141 PolarHBondContact O-OE1 2.93Å; D137-Q141 WeakPolarHBondContact O-CB 3.47Å; D137-Q141 PolarHBondContact O-N 3.27Å; A138-Q141 PolarHBondContact O-N 2.81Å; E139-Q141 PolarHBondContact O-N 3.08Å; Q141-A143 VanDerWaalsContact C-N 3.27Å; Q141-A143 PolarHBondContact O-N 3.29Å; Q141-A144 PolarHBondContact O-N 2.86Å; Q141-A144 VanDerWaalsContact O-N 3.13Å; Q141-A145 PolarHBondContact O-N 3.04Å
142	A	91.6	Very high	87.8	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59	-42.8	175.8	0	0	0	0	0	110.7	L118 A138 E139 A145 A146	L118-A142 HydrophobicContact CB-CB 3.89Å; A138-A142 WeakPolarHBondContact O-CB 3.38Å; A138-A142 PolarHBondContact O-N 3.44Å; E139-A142 PolarHBondContact O-N 3.03Å; A142-A145 PolarHBondContact O-N 2.89Å; A142-A146 WeakPolarHBondContact O-CB 3.46Å; A142-A146 PolarHBondContact O-N 2.92Å
143	A	92.6	Very high	87.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.7	-39.4	174.7	0	0	0	0	0	112.5	P82 K83 L86 E139 Q141 A146 C147	P82-A143 HydrophobicContact CB-CB 3.81Å; P82-A143 HydrophobicContact CG-CB 4.02Å; K83-A143 HydrophobicContact CG-CB 3.88Å; L86-A143 HydrophobicContact CD1-CB 3.8Å; E139-A143 VanDerWaalsContact O-CB 3.28Å; E139-A143 WeakPolarHBondContact O-CB 3.27Å; E139-A143 PolarHBondContact O-N 2.82Å; Q141-A143 VanDerWaalsContact C-N 3.27Å; Q141-A143 PolarHBondContact O-N 3.29Å; A143-A146 WeakPolarHBondContact O-CB 3.44Å; A143-A146 PolarHBondContact O-N 3.09Å; A143-C147 PolarHBondContact O-N 2.79Å; A143-C147 PolarHBondContact O-SG 2.91Å
144	A	91.2	Very high	88	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.8	-41.9	178.6	0	0	0	0	0	111.9	L75 L76 F79 P82 R140 Q141 A146 C147 Q148	L75-A144 HydrophobicContact CB-CB 4.2Å; L76-A144 HydrophobicContact CD2-CB 3.97Å; L76-A144 HydrophobicContact CG-CB 4.47Å; F79-A144 HydrophobicContact CB-CB 4.47Å; P82-A144 HydrophobicContact CB-CB 3.98Å; P82-A144 HydrophobicContact CG-CB 4.11Å; R140-A144 VanDerWaalsContact O-CB 3.32Å; R140-A144 WeakPolarHBondContact O-CB 3.44Å; R140-A144 PolarHBondContact O-N 3.22Å; Q141-A144 PolarHBondContact O-N 2.86Å; Q141-A144 VanDerWaalsContact O-N 3.13Å; A144-A146 VanDerWaalsContact C-N 3.29Å; A144-A146 PolarHBondContact O-N 2.86Å; A144-C147 WeakPolarHBondContact O-CB 3.37Å; A144-C147 PolarHBondContact O-N 2.88Å; A144-Q148 PolarHBondContact O-N 3.02Å
145	A	90.1	Very high	88.2	Confident	19 Å²	19	36 Å²	36	16%	0.157	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-36.4	173.1	0	0	0	0	0	111.5	L75 V128 Q141 A142 Q148 L149	L75-A145 HydrophobicContact CD1-CB 4.46Å; V128-A145 HydrophobicContact CG1-CB 3.34Å; Q141-A145 PolarHBondContact O-N 3.04Å; A142-A145 PolarHBondContact O-N 2.89Å; A145-Q148 WeakPolarHBondContact O-CB 3.44Å; A145-Q148 PolarHBondContact O-N 3.08Å; A145-L149 PolarHBondContact O-N 3.3Å; A145-L149 VanDerWaalsContact O-N 3.07Å
146	A	91.6	Very high	88.4	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-65.6	-40.2	171.4	0	0	0	0	0	113.1	L86 L118 I120 V128 A142 A143 A144 Q148 L149 F150	L86-A146 HydrophobicContact CD1-CB 3.74Å; L86-A146 HydrophobicContact CD2-CB 4.06Å; L118-A146 HydrophobicContact CD2-CB 3.81Å; I120-A146 HydrophobicContact CD1-CB 3.42Å; I120-A146 VanDerWaalsContact CD1-CB 3.42Å; V128-A146 HydrophobicContact CG2-CB 4.23Å; A142-A146 WeakPolarHBondContact O-CB 3.46Å; A142-A146 PolarHBondContact O-N 2.92Å; A143-A146 WeakPolarHBondContact O-CB 3.44Å; A143-A146 PolarHBondContact O-N 3.09Å; A144-A146 VanDerWaalsContact C-N 3.29Å; A144-A146 PolarHBondContact O-N 2.86Å; A146-Q148 VanDerWaalsContact C-N 3.27Å; A146-Q148 PolarHBondContact O-N 3.5Å; A146-L149 WeakPolarHBondContact O-CB 3.37Å; A146-L149 PolarHBondContact O-N 2.79Å; A146-F150 WeakPolarHBondContact O-CD1 3.41Å; A146-F150 PolarHBondContact O-N 2.74Å
147	C	91.3	Very high	88.1	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61	-38.3	172.3	-67.2	0	0	0	0	111.7	F79 P82 L85 A143 A144 F150 K151 L156	F79-C147 HydrophobicContact CB-CB 4.31Å; F79-C147 HydrophobicContact CD1-CB 3.46Å; F79-C147 VanDerWaalsContact CD1-CB 3.46Å; F79-C147 HydrophobicContact CD2-CB 4.03Å; F79-C147 HydrophobicContact CE1-CB 3.62Å; F79-C147 HydrophobicContact CE2-CB 4.21Å; F79-C147 HydrophobicContact CG-CB 3.66Å; F79-C147 HydrophobicContact CZ-CB 4Å; P82-C147 PolarHBondContact O-SG 2.73Å; L85-C147 HydrophobicContact CD2-CB 4.4Å; A143-C147 PolarHBondContact O-N 2.79Å; A143-C147 PolarHBondContact O-SG 2.91Å; A144-C147 WeakPolarHBondContact O-CB 3.37Å; A144-C147 PolarHBondContact O-N 2.88Å; C147-F150 PolarHBondContact O-N 3.03Å; C147-K151 WeakPolarHBondContact O-CB 3.49Å; C147-K151 PolarHBondContact O-N 3.2Å; C147-L156 HydrophobicContact CB-CD1 4.3Å
148	Q	90.1	Very high	87.7	Confident	98 Å²	98	30.7 Å²	30.7	46%	0.458	18%	0.179	S	C	.	.	H	α-helix	trans	-63.1	-42	175.7	-165.9	-176	17.3	0	0	111.6	L75 F79 A144 A145 A146 K151 G152	L75-Q148 HydrophobicContact CD2-CB 4.13Å; L75-Q148 HydrophobicContact CD2-CG 4.01Å; F79-Q148 HydrophobicContact CE2-CB 4.06Å; A144-Q148 PolarHBondContact O-N 3.02Å; A145-Q148 WeakPolarHBondContact O-CB 3.44Å; A145-Q148 PolarHBondContact O-N 3.08Å; A146-Q148 VanDerWaalsContact C-N 3.27Å; A146-Q148 PolarHBondContact O-N 3.5Å; Q148-K151 PolarHBondContact O-N 3.38Å; Q148-G152 PolarHBondContact O-N 3.04Å
149	L	88.1	Confident	87.3	Confident	60 Å²	60	40.7 Å²	40.7	31%	0.314	22%	0.216	S	C	.	.	H	α-helix	trans	-61	-44.9	172.4	-69.9	174.6	0	0	0	111.7	V126 V128 A145 A146 K151 G152 W153	V126-L149 HydrophobicContact CG1-CD1 3.86Å; V128-L149 HydrophobicContact CG2-CD1 3.51Å; A145-L149 PolarHBondContact O-N 3.3Å; A145-L149 VanDerWaalsContact O-N 3.07Å; A146-L149 WeakPolarHBondContact O-CB 3.37Å; A146-L149 PolarHBondContact O-N 2.79Å; L149-K151 VanDerWaalsContact C-N 3.28Å; L149-K151 PolarHBondContact O-N 2.96Å; L149-G152 PolarHBondContact O-N 2.97Å; L149-W153 HydrophobicContact CB-CH2 4.33Å; L149-W153 HydrophobicContact CB-CZ2 4.1Å; L149-W153 HydrophobicContact CD1-CZ2 4.44Å; L149-W153 HydrophobicContact CD2-CZ2 4.48Å; L149-W153 WeakPolarHBondContact O-CB 3.29Å; L149-W153 PolarHBondContact O-N 3.15Å
150	F	89.6	Confident	87.1	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.5	-38.4	177.9	-85	32.1	0	0	0	111.8	L86 V89 I90 I120 A146 C147 W153 G154 L155 L156	L86-F150 HydrophobicContact CD2-CD1 4.36Å; L86-F150 HydrophobicContact CD2-CD2 3.8Å; L86-F150 HydrophobicContact CD2-CE1 4.34Å; L86-F150 HydrophobicContact CD2-CE2 3.79Å; L86-F150 HydrophobicContact CD2-CG 4.12Å; L86-F150 HydrophobicContact CD2-CZ 4.08Å; V89-F150 HydrophobicContact CB-CD2 4.15Å; V89-F150 HydrophobicContact CB-CE2 4.17Å; V89-F150 HydrophobicContact CG1-CD2 3.72Å; V89-F150 HydrophobicContact CG1-CE2 3.75Å; V89-F150 HydrophobicContact CG2-CD2 4.4Å; I90-F150 HydrophobicContact CD1-CE2 4.49Å; I90-F150 HydrophobicContact CD1-CZ 4.28Å; I90-F150 HydrophobicContact CG1-CE2 4.07Å; I90-F150 HydrophobicContact CG1-CZ 4.26Å; I120-F150 HydrophobicContact CD1-CE1 4.36Å; I120-F150 HydrophobicContact CG2-CE1 4.07Å; I120-F150 HydrophobicContact CG2-CZ 4.07Å; A146-F150 WeakPolarHBondContact O-CD1 3.41Å; A146-F150 PolarHBondContact O-N 2.74Å; C147-F150 PolarHBondContact O-N 3.03Å; F150-W153 AromaticContact CD1-CE3 3.97Å; F150-W153 HydrophobicContact CD1-CE3 3.97Å; F150-W153 AromaticContact CD1-CZ3 3.84Å; F150-W153 HydrophobicContact CD1-CZ3 3.84Å; F150-W153 HydrophobicContact CE1-CE3 4.26Å; F150-W153 AromaticContact CE1-CZ3 3.78Å; F150-W153 HydrophobicContact CE1-CZ3 3.78Å; F150-W153 PolarHBondContact O-N 2.87Å; F150-G154 PolarHBondContact O-N 3.48Å; F150-L155 HydrophobicContact CB-CB 4.22Å; F150-L155 HydrophobicContact CB-CD1 4.49Å; F150-L155 HydrophobicContact CD1-CD1 4.22Å; F150-L155 HydrophobicContact CD2-CB 4.4Å; F150-L155 HydrophobicContact CD2-CD1 4.1Å; F150-L155 HydrophobicContact CE1-CD1 4.46Å; F150-L155 HydrophobicContact CE2-CD1 4.34Å; F150-L155 HydrophobicContact CG-CB 4.44Å; F150-L155 HydrophobicContact CG-CD1 4.02Å; F150-L155 WeakPolarHBondContact O-CA 3.31Å; F150-L155 WeakPolarHBondContact O-CB 3.25Å; F150-L155 PolarHBondContact O-N 3.02Å; F150-L156 HydrophobicContact CB-CD1 3.8Å; F150-L156 HydrophobicContact CB-CG 4.23Å; F150-L156 PolarHBondContact O-N 3.37Å
151	K	86.5	Confident	86.7	Confident	51 Å²	51	41.6 Å²	41.6	22%	0.222	23%	0.226	C	C	.	.	H	α-helix	trans	-66.4	-44.5	174	-165.7	171.6	-174.3	170.1	0	111.8	E78 F79 C147 Q148 L149 W153 G154 L156 P158 N160	E78-K151 IonicContact OE1-NZ 2.92Å; E78-K151 PolarHBondContact OE1-NZ 3.45Å; F79-K151 HydrophobicContact CE1-CD 4.25Å; F79-K151 HydrophobicContact CZ-CB 4.32Å; F79-K151 HydrophobicContact CZ-CD 3.81Å; C147-K151 WeakPolarHBondContact O-CB 3.49Å; C147-K151 PolarHBondContact O-N 3.2Å; Q148-K151 PolarHBondContact O-N 3.38Å; L149-K151 VanDerWaalsContact C-N 3.28Å; L149-K151 PolarHBondContact O-N 2.96Å; K151-W153 VanDerWaalsContact C-N 3.28Å; K151-W153 PolarHBondContact O-N 2.96Å; K151-G154 PolarHBondContact O-N 3.1Å; K151-L156 HydrophobicContact CB-CB 4.2Å; K151-L156 HydrophobicContact CG-CB 4.44Å; K151-P158 VanDerWaalsContact CE-O 3.25Å; K151-P158 WeakPolarHBondContact CE-O 3.2Å; K151-P158 PolarHBondContact NZ-O 3.33Å; K151-N160 PolarHBondContact NZ-OD1 2.87Å
152	G	82.3	Confident	86.5	Confident	70 Å²	70	43.9 Å²	43.9	72%	0.722	24%	0.239	S	C	*	.	H	α-helix	trans	-62.9	-31	174.7	0	0	0	0	0	113.8	Q148 L149 G154	Q148-G152 PolarHBondContact O-N 3.04Å; L149-G152 PolarHBondContact O-N 2.97Å; G152-G154 VanDerWaalsContact C-N 3.26Å; G152-G154 PolarHBondContact O-N 2.84Å
153	W	85	Confident	86.2	Confident	49 Å²	49	45.5 Å²	45.5	19%	0.186	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-3.5	173.6	-64.4	-11.4	0	0	0	113.7	P123 K124 V126 L149 F150 K151 L155 F175	P123-W153 HydrophobicContact CG-CE3 3.89Å; P123-W153 HydrophobicContact CG-CZ3 4.01Å; K124-W153 HydrophobicContact CG-CH2 4.24Å; V126-W153 HydrophobicContact CB-CH2 4.14Å; V126-W153 HydrophobicContact CG2-CH2 3.53Å; V126-W153 HydrophobicContact CG2-CZ2 3.88Å; L149-W153 HydrophobicContact CB-CH2 4.33Å; L149-W153 HydrophobicContact CB-CZ2 4.1Å; L149-W153 HydrophobicContact CD1-CZ2 4.44Å; L149-W153 HydrophobicContact CD2-CZ2 4.48Å; L149-W153 WeakPolarHBondContact O-CB 3.29Å; L149-W153 PolarHBondContact O-N 3.15Å; F150-W153 AromaticContact CD1-CE3 3.97Å; F150-W153 HydrophobicContact CD1-CE3 3.97Å; F150-W153 AromaticContact CD1-CZ3 3.84Å; F150-W153 HydrophobicContact CD1-CZ3 3.84Å; F150-W153 HydrophobicContact CE1-CE3 4.26Å; F150-W153 AromaticContact CE1-CZ3 3.78Å; F150-W153 HydrophobicContact CE1-CZ3 3.78Å; F150-W153 PolarHBondContact O-N 2.87Å; K151-W153 VanDerWaalsContact C-N 3.28Å; K151-W153 PolarHBondContact O-N 2.96Å; W153-L155 VanDerWaalsContact C-N 3.33Å; W153-L155 HydrophobicContact CB-CD1 4.47Å; W153-L155 HydrophobicContact CB-CG 4.23Å; W153-L155 HydrophobicContact CE3-CD1 4Å; W153-F175 HydrophobicContact CB-CE1 4.22Å; W153-F175 HydrophobicContact CB-CE2 4.44Å; W153-F175 HydrophobicContact CB-CZ 3.67Å; W153-F175 HydrophobicContact CG-CE1 4.14Å; W153-F175 HydrophobicContact CG-CZ 4.09Å
154	G	83.3	Confident	85.6	Confident	32 Å²	32	49.7 Å²	49.7	33%	0.33	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	23.3	-177.2	0	0	0	0	0	114.2	F150 K151 G152 F163 L171	F150-G154 PolarHBondContact O-N 3.48Å; K151-G154 PolarHBondContact O-N 3.1Å; G152-G154 VanDerWaalsContact C-N 3.26Å; G152-G154 PolarHBondContact O-N 2.84Å; G154-F163 VanDerWaalsContact O-CE2 3.25Å; G154-F163 WeakPolarHBondContact O-CE2 3.14Å; G154-L171 WeakPolarHBondContact O-CD1 3.44Å
155	L	86.5	Confident	84.9	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.285	C	S	.	.	S	Bend	trans	-87.1	-13.3	172.4	-60.8	176.8	0	0	0	113.1	W122 P123 F150 W153 Y168 L171 F175	W122-L155 HydrophobicContact CH2-CD1 4.48Å; W122-L155 HydrophobicContact CH2-CD2 4.29Å; W122-L155 HydrophobicContact CZ3-CD1 4.13Å; P123-L155 HydrophobicContact CG-CD1 3.87Å; F150-L155 HydrophobicContact CB-CB 4.22Å; F150-L155 HydrophobicContact CB-CD1 4.49Å; F150-L155 HydrophobicContact CD1-CD1 4.22Å; F150-L155 HydrophobicContact CD2-CB 4.4Å; F150-L155 HydrophobicContact CD2-CD1 4.1Å; F150-L155 HydrophobicContact CE1-CD1 4.46Å; F150-L155 HydrophobicContact CE2-CD1 4.34Å; F150-L155 HydrophobicContact CG-CB 4.44Å; F150-L155 HydrophobicContact CG-CD1 4.02Å; F150-L155 WeakPolarHBondContact O-CA 3.31Å; F150-L155 WeakPolarHBondContact O-CB 3.25Å; F150-L155 PolarHBondContact O-N 3.02Å; W153-L155 VanDerWaalsContact C-N 3.33Å; W153-L155 HydrophobicContact CB-CD1 4.47Å; W153-L155 HydrophobicContact CB-CG 4.23Å; W153-L155 HydrophobicContact CE3-CD1 4Å; L155-Y168 HydrophobicContact CB-CE1 4.32Å; L155-Y168 HydrophobicContact CD2-CD1 4.35Å; L155-Y168 HydrophobicContact CD2-CE1 4.46Å; L155-Y168 WeakPolarHBondContact O-CE1 3.47Å; L155-Y168 PolarHBondContact O-OH 2.99Å; L155-L171 HydrophobicContact CD2-CB 4.01Å; L155-L171 HydrophobicContact CD2-CD1 4.29Å; L155-F175 HydrophobicContact CD2-CE2 4.31Å
156	L	86.6	Confident	84.1	Confident	7 Å²	7	53.8 Å²	53.8	4%	0.037	30%	0.302	C	S	.	.	S	Bend	trans	-122.3	140.7	173	-76.8	166.1	0	0	0	109.2	F79 L85 V89 C147 F150 K151 L162	F79-L156 HydrophobicContact CE1-CD1 4.32Å; L85-L156 HydrophobicContact CD1-CD2 3.78Å; L85-L156 HydrophobicContact CD2-CD1 3.83Å; L85-L156 HydrophobicContact CD2-CD2 4Å; L85-L156 HydrophobicContact CG-CD1 4.29Å; L85-L156 HydrophobicContact CG-CD2 3.91Å; V89-L156 HydrophobicContact CG2-CD2 3.49Å; V89-L156 VanDerWaalsContact CG2-CD2 3.49Å; V89-L156 HydrophobicContact CG2-CG 4.04Å; C147-L156 HydrophobicContact CB-CD1 4.3Å; F150-L156 HydrophobicContact CB-CD1 3.8Å; F150-L156 HydrophobicContact CB-CG 4.23Å; F150-L156 PolarHBondContact O-N 3.37Å; K151-L156 HydrophobicContact CB-CB 4.2Å; K151-L156 HydrophobicContact CG-CB 4.44Å; L156-L162 HydrophobicContact CD2-CD2 4.45Å
157	G	78	Confident	83.5	Confident	2 Å²	2	58.5 Å²	58.5	2%	0.021	32%	0.322	C	S	.	.			trans	-65.4	168.2	172.4	0	0	0	0	0	112.9	R159 N160 E161	G157-R159 PolarHBondContact O-N 3.24Å; G157-R159 VanDerWaalsContact O-N 3.14Å; G157-N160 WeakPolarHBondContact O-CA 3.24Å; G157-N160 PolarHBondContact O-N 3.02Å; G157-E161 PolarHBondContact N-O 3.05Å
158	P	75.7	Confident	83.2	Confident	112 Å²	112	58.5 Å²	58.5	73%	0.727	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-28.4	-179.4	21.1	-31.1	0	0	0	113.4	K151	K151-P158 VanDerWaalsContact CE-O 3.25Å; K151-P158 WeakPolarHBondContact CE-O 3.2Å; K151-P158 PolarHBondContact NZ-O 3.33Å
159	R	80.7	Confident	82.3	Confident	210 Å²	210	62.3 Å²	62.3	79%	0.792	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	20.6	173.4	-64.4	-178.1	175.3	-176.4	-0.1	113.9	G157 E161	G157-R159 PolarHBondContact O-N 3.24Å; G157-R159 VanDerWaalsContact O-N 3.14Å; R159-E161 HydrophobicContact CB-CG 4.2Å; R159-E161 PolarHBondContact O-N 3.43Å
160	N	86.1	Confident	81.6	Confident	32 Å²	32	63.9 Å²	63.9	17%	0.171	35%	0.345	C	S	.	.	S	Bend	trans	64.7	27.5	-174	-48.2	-25.7	0	0	0	113.4	E78 F79 L85 K151 G157	E78-N160 PolarHBondContact O-ND2 2.8Å; F79-N160 WeakPolarHBondContact CD1-ND2 3.38Å; F79-N160 HydrophobicContact CE1-CB 4.5Å; F79-N160 VanDerWaalsContact CE1-CG 3.48Å; F79-N160 WeakPolarHBondContact CE1-OD1 3.09Å; L85-N160 HydrophobicContact CD2-CB 3.94Å; K151-N160 PolarHBondContact NZ-OD1 2.87Å; G157-N160 WeakPolarHBondContact O-CA 3.24Å; G157-N160 PolarHBondContact O-N 3.02Å
161	E	84.8	Confident	80.8	Confident	106 Å²	106	64.9 Å²	64.9	50%	0.495	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-69.7	141.1	176.4	-67.6	164.6	-162.3	0	0	110.9	G157 R159	G157-E161 PolarHBondContact N-O 3.05Å; R159-E161 HydrophobicContact CB-CG 4.2Å; R159-E161 PolarHBondContact O-N 3.43Å
162	L	85.4	Confident	79.8	Confident	74 Å²	74	63.6 Å²	63.6	39%	0.387	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-82.4	140.4	174.5	-63	166.9	0	0	0	109.7	L85 V89 L156	L85-L162 HydrophobicContact CD1-CD2 4.23Å; V89-L162 HydrophobicContact CB-CD2 4.26Å; V89-L162 HydrophobicContact CG2-CD2 3.4Å; V89-L162 VanDerWaalsContact CG2-CD2 3.4Å; L156-L162 HydrophobicContact CD2-CD2 4.45Å
163	F	84.4	Confident	79	Confident	33 Å²	33	66.6 Å²	66.6	15%	0.145	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-84.8	166.3	172.1	-58.9	-54	0	0	0	111.7	R92 G154 K167 Y168 L171	R92-F163 VanDerWaalsContact CD-O 3.32Å; R92-F163 WeakPolarHBondContact CD-O 3.49Å; R92-F163 PolarHBondContact NE-O 3.47Å; G154-F163 VanDerWaalsContact O-CE2 3.25Å; G154-F163 WeakPolarHBondContact O-CE2 3.14Å; F163-K167 HydrophobicContact CB-CB 4.08Å; F163-K167 HydrophobicContact CB-CD 3.9Å; F163-K167 HydrophobicContact CB-CG 4.05Å; F163-K167 HydrophobicContact CD1-CD 3.67Å; F163-K167 VanDerWaalsContact CD1-NZ 3.26Å; F163-K167 HydrophobicContact CD2-CD 4.47Å; F163-K167 HydrophobicContact CE1-CD 4.35Å; F163-K167 HydrophobicContact CG-CD 3.74Å; F163-K167 HydrophobicContact CG-CG 4.19Å; F163-Y168 HydrophobicContact CB-CD2 4.12Å; F163-Y168 HydrophobicContact CB-CE1 4.24Å; F163-Y168 HydrophobicContact CB-CE2 3.77Å; F163-Y168 HydrophobicContact CB-CG 4.5Å; F163-Y168 AromaticContact CD2-CE1 3.92Å; F163-Y168 HydrophobicContact CD2-CE1 3.92Å; F163-Y168 PolarHBondContact N-OH 2.83Å; F163-Y168 VanDerWaalsContact N-OH 3.11Å; F163-Y168 WeakPolarHBondContact O-CE2 3.25Å; F163-L171 HydrophobicContact CD2-CD1 3.89Å; F163-L171 HydrophobicContact CE2-CD1 4.25Å
164	D	80.4	Confident	78.1	Confident	89 Å²	89	73.8 Å²	73.8	48%	0.476	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-71.3	162.7	169.7	63.3	18.2	0	0	0	111.1	A166 K167 Y168	D164-A166 PolarHBondContact O-N 2.97Å; D164-K167 PolarHBondContact O-N 2.89Å; D164-K167 WeakPolarHBondContact OD1-CB 3.43Å; D164-K167 PolarHBondContact OD1-N 3.42Å; D164-Y168 VanDerWaalsContact O-CD2 3.3Å; D164-Y168 WeakPolarHBondContact O-CD2 3.1Å; D164-Y168 PolarHBondContact O-N 3.41Å; D164-Y168 VanDerWaalsContact O-N 3.11Å
165	A	76.4	Confident	77.1	Confident	42 Å²	42	75 Å²	75	35%	0.347	37%	0.372	S	S	.	.	H	α-helix	trans	-61.2	-31.5	-178.1	0	0	0	0	0	112.2	Y168 R169	A165-Y168 PolarHBondContact O-N 2.88Å; A165-R169 WeakPolarHBondContact O-CG 3.27Å; A165-R169 PolarHBondContact O-N 3.05Å; A165-R169 VanDerWaalsContact O-N 3.08Å
166	A	73.7	Confident	75.2	Confident	62 Å²	62	77.1 Å²	77.1	51%	0.512	39%	0.393	S	S	.	.	H	α-helix	trans	-66.2	-46.9	178.5	0	0	0	0	0	111.9	D164 Y168 R169 V170	D164-A166 PolarHBondContact O-N 2.97Å; A166-Y168 VanDerWaalsContact C-N 3.33Å; A166-Y168 PolarHBondContact O-N 3.44Å; A166-R169 WeakPolarHBondContact O-CB 3.26Å; A166-R169 PolarHBondContact O-N 2.93Å; A166-V170 PolarHBondContact O-N 3.32Å
167	K	78.7	Confident	72.8	Confident	99 Å²	99	81.3 Å²	81.3	43%	0.43	42%	0.423	S	S	.	.	H	α-helix	trans	-65.7	-35.9	176.8	-175.8	168.3	176.5	-174.7	0	111.8	F163 D164 V170 L171	F163-K167 HydrophobicContact CB-CB 4.08Å; F163-K167 HydrophobicContact CB-CD 3.9Å; F163-K167 HydrophobicContact CB-CG 4.05Å; F163-K167 HydrophobicContact CD1-CD 3.67Å; F163-K167 VanDerWaalsContact CD1-NZ 3.26Å; F163-K167 HydrophobicContact CD2-CD 4.47Å; F163-K167 HydrophobicContact CE1-CD 4.35Å; F163-K167 HydrophobicContact CG-CD 3.74Å; F163-K167 HydrophobicContact CG-CG 4.19Å; D164-K167 PolarHBondContact O-N 2.89Å; D164-K167 WeakPolarHBondContact OD1-CB 3.43Å; D164-K167 PolarHBondContact OD1-N 3.42Å; K167-V170 PolarHBondContact O-N 3.27Å; K167-L171 HydrophobicContact CG-CD1 4.08Å; K167-L171 WeakPolarHBondContact O-CB 3.18Å; K167-L171 VanDerWaalsContact O-CG 3.26Å; K167-L171 WeakPolarHBondContact O-CG 3.42Å; K167-L171 PolarHBondContact O-N 2.9Å
168	Y	84.5	Confident	70.8	Confident	0 Å²	0	85.2 Å²	85.2	0%	0	45%	0.448	C	S	.	.	H	α-helix	trans	-64	-37.6	172.6	-79.9	-56	0	0	0	113.3	V89 R92 A93 W122 L155 F163 D164 A165 A166 L171 A172	V89-Y168 HydrophobicContact CG1-CE1 3.83Å; R92-Y168 HydrophobicContact CB-CE2 4.36Å; R92-Y168 HydrophobicContact CG-CD2 4.4Å; R92-Y168 HydrophobicContact CG-CE2 4.35Å; A93-Y168 HydrophobicContact CB-CD1 4.08Å; A93-Y168 HydrophobicContact CB-CD2 4.18Å; A93-Y168 HydrophobicContact CB-CG 3.74Å; W122-Y168 HydrophobicContact CH2-CD1 4.5Å; L155-Y168 HydrophobicContact CB-CE1 4.32Å; L155-Y168 HydrophobicContact CD2-CD1 4.35Å; L155-Y168 HydrophobicContact CD2-CE1 4.46Å; L155-Y168 WeakPolarHBondContact O-CE1 3.47Å; L155-Y168 PolarHBondContact O-OH 2.99Å; F163-Y168 HydrophobicContact CB-CD2 4.12Å; F163-Y168 HydrophobicContact CB-CE1 4.24Å; F163-Y168 HydrophobicContact CB-CE2 3.77Å; F163-Y168 HydrophobicContact CB-CG 4.5Å; F163-Y168 AromaticContact CD2-CE1 3.92Å; F163-Y168 HydrophobicContact CD2-CE1 3.92Å; F163-Y168 PolarHBondContact N-OH 2.83Å; F163-Y168 VanDerWaalsContact N-OH 3.11Å; F163-Y168 WeakPolarHBondContact O-CE2 3.25Å; D164-Y168 VanDerWaalsContact O-CD2 3.3Å; D164-Y168 WeakPolarHBondContact O-CD2 3.1Å; D164-Y168 PolarHBondContact O-N 3.41Å; D164-Y168 VanDerWaalsContact O-N 3.11Å; A165-Y168 PolarHBondContact O-N 2.88Å; A166-Y168 VanDerWaalsContact C-N 3.33Å; A166-Y168 PolarHBondContact O-N 3.44Å; Y168-L171 HydrophobicContact CD1-CD1 4.4Å; Y168-L171 PolarHBondContact O-N 3.32Å; Y168-A172 WeakPolarHBondContact O-CB 3.27Å; Y168-A172 PolarHBondContact O-N 3.44Å
169	R	71.7	Confident	68.7	Low	179 Å²	179	83.3 Å²	83.3	68%	0.675	44%	0.442	S	S	*	.	H	α-helix	trans	-61	-47	173.7	-72.1	176.6	-168.8	-178.9	2.7	111.4	A165 A166 L171 A172 D173	A165-R169 WeakPolarHBondContact O-CG 3.27Å; A165-R169 PolarHBondContact O-N 3.05Å; A165-R169 VanDerWaalsContact O-N 3.08Å; A166-R169 WeakPolarHBondContact O-CB 3.26Å; A166-R169 PolarHBondContact O-N 2.93Å; R169-L171 VanDerWaalsContact C-N 3.31Å; R169-L171 PolarHBondContact O-N 3.3Å; R169-A172 WeakPolarHBondContact O-CB 3.29Å; R169-A172 PolarHBondContact O-N 2.98Å; R169-D173 PolarHBondContact O-N 3.2Å
170	V	73.1	Confident	66.1	Low	93 Å²	93	80.9 Å²	80.9	56%	0.564	44%	0.444	S	S	*	.	H	α-helix	trans	-63.1	-37.3	176.9	178.1	0	0	0	0	112.1	A166 K167	A166-V170 PolarHBondContact O-N 3.32Å; K167-V170 PolarHBondContact O-N 3.27Å
171	L	72.7	Confident	63.2	Low	21 Å²	21	84.3 Å²	84.3	11%	0.11	47%	0.471	C	S	.	.	H	α-helix	trans	-70.6	-35.7	175.9	-72.9	167.7	0	0	0	112	G154 L155 F163 K167 Y168 R169 D173 R174 F175	G154-L171 WeakPolarHBondContact O-CD1 3.44Å; L155-L171 HydrophobicContact CD2-CB 4.01Å; L155-L171 HydrophobicContact CD2-CD1 4.29Å; F163-L171 HydrophobicContact CD2-CD1 3.89Å; F163-L171 HydrophobicContact CE2-CD1 4.25Å; K167-L171 HydrophobicContact CG-CD1 4.08Å; K167-L171 WeakPolarHBondContact O-CB 3.18Å; K167-L171 VanDerWaalsContact O-CG 3.26Å; K167-L171 WeakPolarHBondContact O-CG 3.42Å; K167-L171 PolarHBondContact O-N 2.9Å; Y168-L171 HydrophobicContact CD1-CD1 4.4Å; Y168-L171 PolarHBondContact O-N 3.32Å; R169-L171 VanDerWaalsContact C-N 3.31Å; R169-L171 PolarHBondContact O-N 3.3Å; L171-D173 VanDerWaalsContact C-N 3.31Å; L171-D173 PolarHBondContact O-N 2.99Å; L171-R174 WeakPolarHBondContact O-CB 3.47Å; L171-R174 PolarHBondContact O-N 2.97Å; L171-F175 WeakPolarHBondContact O-CD2 3.42Å
172	A	66.6	Low	60.2	Low	24 Å²	24	89.6 Å²	89.6	20%	0.198	49%	0.486	C	S	.	.	H	α-helix	trans	-62.9	-37.5	177.6	0	0	0	0	0	111.9	W122 Y168 R169 R174 F175	W122-A172 HydrophobicContact CZ2-CB 4.03Å; Y168-A172 WeakPolarHBondContact O-CB 3.27Å; Y168-A172 PolarHBondContact O-N 3.44Å; R169-A172 WeakPolarHBondContact O-CB 3.29Å; R169-A172 PolarHBondContact O-N 2.98Å; A172-R174 PolarHBondContact O-N 3.43Å; A172-F175 PolarHBondContact O-N 3.49Å
173	D	65.3	Low	57.2	Low	132 Å²	132	97.1 Å²	97.1	71%	0.706	51%	0.51	S	S	*	.	H	α-helix	trans	-60.1	-28.5	177.5	-65.9	-23.7	0	0	0	112.7	R169 L171 F175	R169-D173 PolarHBondContact O-N 3.2Å; L171-D173 VanDerWaalsContact C-N 3.31Å; L171-D173 PolarHBondContact O-N 2.99Å; D173-F175 VanDerWaalsContact C-N 3.28Å; D173-F175 PolarHBondContact O-N 3.27Å
174	R	65.5	Low	54.1	Low	201 Å²	201	107.3 Å²	107.3	76%	0.758	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-21.6	176.7	-67.5	-175.1	174.3	-164.7	-3.3	113.9	L171 A172	L171-R174 WeakPolarHBondContact O-CB 3.47Å; L171-R174 PolarHBondContact O-N 2.97Å; A172-R174 PolarHBondContact O-N 3.43Å
175	F	61.6	Low	51.4	Low	58 Å²	58	108.6 Å²	108.6	25%	0.254	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.1	-3.1	-174	-68.1	-72.9	0	0	0	114	P123 W153 L155 L171 A172 D173	P123-F175 HydrophobicContact CB-CB 3.83Å; P123-F175 HydrophobicContact CB-CD2 3.98Å; P123-F175 HydrophobicContact CB-CG 3.99Å; P123-F175 HydrophobicContact CG-CB 4.3Å; P123-F175 HydrophobicContact CG-CD1 4.49Å; P123-F175 HydrophobicContact CG-CD2 3.97Å; P123-F175 HydrophobicContact CG-CG 3.98Å; W153-F175 HydrophobicContact CB-CE1 4.22Å; W153-F175 HydrophobicContact CB-CE2 4.44Å; W153-F175 HydrophobicContact CB-CZ 3.67Å; W153-F175 HydrophobicContact CG-CE1 4.14Å; W153-F175 HydrophobicContact CG-CZ 4.09Å; L155-F175 HydrophobicContact CD2-CE2 4.31Å; L171-F175 WeakPolarHBondContact O-CD2 3.42Å; A172-F175 PolarHBondContact O-N 3.49Å; D173-F175 VanDerWaalsContact C-N 3.28Å; D173-F175 PolarHBondContact O-N 3.27Å
176	G	47.3	Very low	48.9	Very low	43 Å²	43	115.8 Å²	115.8	44%	0.443	59%	0.587	S	S	.	*			trans	70.8	133.3	-177.8	0	0	0	0	0	112.2
177	S	36.7	Very low	46.6	Very low	95 Å²	95	117.7 Å²	117.7	66%	0.664	59%	0.594	S	S	*	*			trans	-65.9	130.2	179.1	-177.2	0	0	0	0	110.9	A179	S177-A179 PolarHBondContact O-N 3.08Å
178	P	36.6	Very low	43.9	Very low	85 Å²	85	119 Å²	119	55%	0.552	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	22	174.8	-16.5	30.7	0	0	0	114.8
179	A	30.6	Very low	41	Very low	72 Å²	72	127.2 Å²	127.2	60%	0.595	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-5.7	-177	0	0	0	0	0	114.8	S177	S177-A179 PolarHBondContact O-N 3.08Å
180	D	26.1	Very low	38.8	Very low	158 Å²	158	123.8 Å²	123.8	85%	0.845	65%	0.652	S	S	*	*	S	Bend	trans	-110.8	22	-169.1	-86.1	-10.6	0	0	0	116.5
181	S	25.8	Very low	36.9	Very low	104 Å²	104	125 Å²	125	73%	0.727	66%	0.662	S	S	*	*	S	Bend	trans	-102.8	0.8	176.7	-172.2	0	0	0	0	115.6
182	W	21.8	Very low	34.4	Very low	217 Å²	217	130.6 Å²	130.6	82%	0.822	70%	0.697	S	S	*	*	S	Bend	trans	-129.3	120.9	176.2	-73	57.2	0	0	0	108.1
183	W	21.3	Very low	32.3	Very low	233 Å²	233	134.1 Å²	134.1	88%	0.883	72%	0.721	S	S	*	*			trans	86.6	70.5	-174.8	-44.1	108.1	0	0	0	116.1	P185	W183-P185 WeakPolarHBondContact O-CD 3.32Å
184	R	20.8	Very low	30	Very low	246 Å²	246	139.7 Å²	139.7	93%	0.928	73%	0.732	S	S	*	*			trans	-65.2	118.8	133.5	-90.3	-167.3	-174	-148.3	2.6	107
185	P	23.8	Very low	27.9	Very low	117 Å²	117	141 Å²	141	76%	0.76	74%	0.737	S	S	*	*			trans	-88.9	107	171.2	15.5	2.2	0	0	0	108.1	W183	W183-P185 WeakPolarHBondContact O-CD 3.32Å
186	E	22.5	Very low	26	Very low	192 Å²	192	146.7 Å²	146.7	90%	0.897	76%	0.764	S	S	*	*			trans	-74.8	140.3	157.5	-104.7	-177.1	178	0	0	109.3
187	P	25.4	Very low	24.9	Very low	102 Å²	102	152.4 Å²	152.4	66%	0.662	78%	0.783	S	S	*	*			trans	-94.3	155.1	-159.5	37	-34.7	0	0	0	113.4
188	T	22.5	Very low	24.2	Very low	127 Å²	127	154.5 Å²	154.5	78%	0.779	79%	0.787	S	S	*	*			trans	84.5	136.7	149.4	66	0	0	0	0	119.8
189	M	24.2	Very low	23.9	Very low	172 Å²	172	155.7 Å²	155.7	85%	0.847	80%	0.795	S	S	*	*			trans	106	144.6	152.7	-63.1	-51.9	-135.2	0	0	117.6
190	P	25.1	Very low	23.4	Very low	107 Å²	107	160.9 Å²	160.9	70%	0.695	81%	0.807	S	S	*	*				-119.2	-179.8	-107.2	14.8	11.2	0	0	0	112.9
191	P	32.4	Very low	23.3	Very low	120 Å²	120	160.7 Å²	160.7	78%	0.779	81%	0.806	S	S	*	*			trans	-91.1	130.9	-168.8	34.1	-28.5	0	0	0	112.2
192	T	21.8	Very low	23.4	Very low	137 Å²	137	163.9 Å²	163.9	84%	0.84	81%	0.813	S	S	*	*			trans	-161.7	135.5	157.9	15.3	0	0	0	0	113.3
193	S	21	Very low	23.4	Very low	99 Å²	99	164.8 Å²	164.8	69%	0.692	82%	0.816	S	S	*	*			trans	68.4	105.2	147	78.8	0	0	0	0	121.6
194	W	17.9	Very low	23.9	Very low	248 Å²	248	159.8 Å²	159.8	94%	0.939	81%	0.814	S	S	*	*				27.1	112.1	115.3	-64.1	86.3	0	0	0	118.7
195	R	21.7	Very low	24	Very low	230 Å²	230	151.8 Å²	151.8	87%	0.868	81%	0.808	S	S	*	*			trans	172.8	117.4	131.8	-98.1	175.2	-171.8	-151.2	2.8	108.4
196	Q	20.6	Very low	23.8	Very low	176 Å²	176	149.7 Å²	149.7	82%	0.822	81%	0.808	S	S	*	*				50.1	114.4	94.6	-102.1	-177	-1.3	0	0	114.3
197	L	24.1	Very low	24.2	Very low	163 Å²	163	146.6 Å²	146.6	85%	0.853	81%	0.805	S	S	*	*			trans	150.2	138.4	154.6	-85	153.7	0	0	0	106.4
198	N	23.5	Very low	24	Very low	139 Å²	139	146.7 Å²	146.7	74%	0.743	81%	0.814	S	S	*	*			cis	-170	146.5	-26.2	-136.7	0.5	0	0	0	102.8
199	P	28.7	Very low	24	Very low	111 Å²	111	144.1 Å²	144.1	72%	0.721	81%	0.812	S	S	*	*			trans	-84.2	124.9	178	31.9	-26.3	0	0	0	109.7
200	E	20.5	Very low	24	Very low	180 Å²	180	144.7 Å²	144.7	84%	0.841	82%	0.818	S	S	*	*			trans	168.2	148.9	150.1	-96.7	172.5	-172.3	0	0	111.1
201	N	24.1	Very low	23.7	Very low	154 Å²	154	145.1 Å²	145.1	82%	0.824	82%	0.824	S	S	*	*			trans	88	107.8	-174.6	-51.3	-32.2	0	0	0	112.3
202	I	27.2	Very low	23.1	Very low	171 Å²	171	150.9 Å²	150.9	88%	0.877	83%	0.83	S	S	*	*				-149.3	134.2	50.9	-73.8	158.9	0	0	0	110.2
203	R	22.5	Very low	23.1	Very low	236 Å²	236	150 Å²	150	89%	0.891	83%	0.829	S	S	*	*			trans	-73.6	168.6	177.5	-92.8	-173.9	-176.9	-163.4	3	113.4
204	P	31	Very low	23.3	Very low	128 Å²	128	154 Å²	154	83%	0.831	84%	0.842	S	S	*	*			trans	-94	139.6	-154.3	36	-31.8	0	0	0	113.8
205	G	24	Very low	23.6	Very low	78 Å²	78	145 Å²	145	80%	0.804	83%	0.826	S	S	*	*			trans	-111.5	118.9	162.6	0	0	0	0	0	110.3
206	G	18.8	Very low	23.6	Very low	74 Å²	74	144.3 Å²	144.3	76%	0.763	82%	0.824	S	S	*	*			trans	-82.7	-169	151.5	0	0	0	0	0	110.3
207	P	31.7	Very low	23.8	Very low	127 Å²	127	144.3 Å²	144.3	83%	0.825	82%	0.824	S	S	*	*			cis	-131.4	175.7	-4.5	38.6	-21.4	0	0	0	114.3
208	A	21	Very low	23.8	Very low	104 Å²	104	143.4 Å²	143.4	86%	0.86	82%	0.815	S	S	*	*			trans	80.8	118.1	152.8	0	0	0	0	0	119.7
209	G	22.6	Very low	24.1	Very low	72 Å²	72	143.1 Å²	143.1	74%	0.742	81%	0.809	S	S	*	*			trans	110.5	103.9	146	0	0	0	0	0	115.4
210	L	23	Very low	23.8	Very low	184 Å²	184	144.6 Å²	144.6	96%	0.963	81%	0.807	S	S	*	*			trans	118.6	59.1	158.9	-60.6	163.8	0	0	0	113.9
211	S	20	Very low	24.2	Very low	117 Å²	117	140.9 Å²	140.9	82%	0.818	79%	0.792	S	S	*	*			trans	-83.2	126.9	153.4	-92.9	0	0	0	0	110.6
212	R	20	Very low	24.6	Very low	240 Å²	240	141.3 Å²	141.3	91%	0.906	79%	0.79	S	S	*	*			trans	74.9	96.5	145.5	-72.7	178.7	158.2	175.4	-5.9	119.1
213	S	22	Very low	24.7	Very low	119 Å²	119	140 Å²	140	83%	0.832	78%	0.78	S	S	*	*				-154.6	64.6	128.6	166.6	0	0	0	0	108	G215	S213-G215 PolarHBondContact O-N 3.37Å
214	L	24.6	Very low	25.3	Very low	182 Å²	182	134.3 Å²	134.3	95%	0.953	76%	0.763	S	S	*	*			trans	-68.8	116.7	168.8	-94.8	157	0	0	0	107.3	R216	L214-R216 PolarHBondContact O-N 3.14Å
215	G	23.7	Very low	25.5	Very low	60 Å²	60	135.3 Å²	135.3	62%	0.619	76%	0.757	S	S	*	*			trans	-57.3	129.2	-170.5	0	0	0	0	0	111.6	S213 E217	S213-G215 PolarHBondContact O-N 3.37Å; G215-E217 PolarHBondContact O-N 2.98Å; G215-E217 VanDerWaalsContact O-N 3.14Å
216	R	22.8	Very low	26.2	Very low	216 Å²	216	136.8 Å²	136.8	82%	0.815	75%	0.746	S	S	*	*			trans	-54.4	108.5	161.4	-173.5	179.3	-176.7	-176.8	-1.4	108.1	L214 E218	L214-R216 PolarHBondContact O-N 3.14Å; R216-E218 HydrophobicContact CG-CG 4.4Å; R216-E218 PolarHBondContact O-N 3.36Å; R216-E218 VanDerWaalsContact O-N 3.16Å
217	E	24.8	Very low	27.3	Very low	176 Å²	176	136 Å²	136	82%	0.822	72%	0.722	S	S	*	*			trans	-70.2	100.3	169.4	-67.3	177.8	165.8	0	0	106.9	G215 E219	G215-E217 PolarHBondContact O-N 2.98Å; G215-E217 VanDerWaalsContact O-N 3.14Å; E217-E219 PolarHBondContact O-N 3.3Å
218	E	24.1	Very low	27.9	Very low	143 Å²	143	134.2 Å²	134.2	67%	0.668	70%	0.703	S	S	*	*			trans	-79.1	98.8	172	-70.8	174	169.4	0	0	107.2	R216 E220	R216-E218 HydrophobicContact CG-CG 4.4Å; R216-E218 PolarHBondContact O-N 3.36Å; R216-E218 VanDerWaalsContact O-N 3.16Å; E218-E220 PolarHBondContact O-N 3.02Å
219	E	28.9	Very low	29.2	Very low	133 Å²	133	130.3 Å²	130.3	62%	0.621	67%	0.673	S	S	*	*			trans	-69	117.1	172.9	-67.7	-174.7	162	0	0	109.6	E217 D221 R667	E217-E219 PolarHBondContact O-N 3.3Å; E219-D221 PolarHBondContact O-N 3.05Å; E219-D221 VanDerWaalsContact O-N 3.12Å; E219-R667 IonicContact OE2-NE 2.76Å; E219-R667 IonicContact OE2-NH2 3.37Å; E219-R667 PolarHBondContact OE2-NH2 3.29Å
220	E	23.2	Very low	30.9	Very low	143 Å²	143	129 Å²	129	67%	0.668	65%	0.65	S	S	*	*			trans	-72.8	89.7	166.2	-67.3	177.2	165.9	0	0	107.8	E218	E218-E220 PolarHBondContact O-N 3.02Å
221	D	28.9	Very low	32.9	Very low	101 Å²	101	121.9 Å²	121.9	54%	0.54	61%	0.613	S	S	.	*			trans	-64.7	137	161.2	-76.5	-47.7	0	0	0	108.5	E219 E223 R667	E219-D221 PolarHBondContact O-N 3.05Å; E219-D221 VanDerWaalsContact O-N 3.12Å; D221-E223 VanDerWaalsContact C-N 3.28Å; D221-E223 PolarHBondContact O-N 2.83Å; D221-R667 IonicContact OD1-CZ 3.66Å; D221-R667 IonicContact OD1-NH2 3.22Å; D221-R667 PolarHBondContact OD1-NH2 2.86Å; D221-R667 IonicContact OD2-NH2 3.52Å
222	E	31.2	Very low	35.1	Very low	164 Å²	164	116.3 Å²	116.3	77%	0.766	57%	0.574	S	S	*	*			trans	-64.6	88.5	176.5	-69.4	-176.8	167.9	0	0	109.6	H98 E224	H98-E222 IonicContact CE1-OE1 2.67Å; H98-E222 PolarHBondContact CE1-OE1 3.22Å; E222-E224 PolarHBondContact O-N 3.29Å
223	E	29.5	Very low	37.4	Very low	143 Å²	143	104.9 Å²	104.9	67%	0.668	53%	0.531	S	S	*	.			trans	-56.8	111.4	167.2	-67.1	179.8	176	0	0	107.7	D221 E225	D221-E223 VanDerWaalsContact C-N 3.28Å; D221-E223 PolarHBondContact O-N 2.83Å; E223-E225 PolarHBondContact O-N 3.36Å
224	E	36.2	Very low	39.5	Very low	116 Å²	116	99.8 Å²	99.8	54%	0.542	50%	0.495	S	S	.	.			trans	-51.5	94.8	140.6	-79.8	-168.9	154.1	0	0	104.6	E222 L226	E222-E224 PolarHBondContact O-N 3.29Å; E224-L226 VanDerWaalsContact C-N 3.34Å; E224-L226 PolarHBondContact O-N 3.08Å
225	E	35.2	Very low	41.5	Very low	149 Å²	149	95.1 Å²	95.1	70%	0.696	47%	0.468	S	S	*	.			trans	-26.1	99.9	-170.5	-77.7	-176.9	159.5	0	0	108.7	E223 E227	E223-E225 PolarHBondContact O-N 3.36Å; E225-E227 PolarHBondContact O-N 3.37Å
226	L	36.9	Very low	43.6	Very low	110 Å²	110	93.5 Å²	93.5	58%	0.576	44%	0.444	S	S	*	.			trans	-64.3	93.4	176.8	-75.5	168.4	0	0	0	102.5	E224 E228	E224-L226 VanDerWaalsContact C-N 3.34Å; E224-L226 PolarHBondContact O-N 3.08Å; L226-E228 PolarHBondContact O-N 3.28Å
227	E	43.3	Very low	45.7	Very low	56 Å²	56	84 Å²	84	26%	0.262	41%	0.41	S	S	.	.			trans	-59.4	98	173.1	-84.2	-168.3	135.3	0	0	103.8	E225 G229 K1063 L1085 R1093	E225-E227 PolarHBondContact O-N 3.37Å; E227-G229 PolarHBondContact O-N 3.41Å; E227-K1063 IonicContact OE1-NZ 3.63Å; E227-L1085 WeakPolarHBondContact OE2-CD2 3.37Å; E227-R1093 VanDerWaalsContact CD-NH2 3.31Å; E227-R1093 IonicContact OE1-NH2 2.9Å; E227-R1093 PolarHBondContact OE1-NH2 3.37Å; E227-R1093 VanDerWaalsContact OE1-NH2 3.17Å; E227-R1093 IonicContact OE2-CZ 2.68Å; E227-R1093 IonicContact OE2-NH1 3.27Å; E227-R1093 IonicContact OE2-NH2 3.82Å; E227-R1093 PolarHBondContact OE2-NH2 2.91Å
228	E	43.7	Very low	47.5	Very low	91 Å²	91	78.6 Å²	78.6	43%	0.425	39%	0.391	S	S	.	.			trans	-39.9	120.7	176.2	-70.2	-179.6	159.4	0	0	107	L226 T230 Q1067	L226-E228 PolarHBondContact O-N 3.28Å; E228-T230 VanDerWaalsContact O-CG2 3.23Å; E228-T230 WeakPolarHBondContact O-CG2 3.09Å; E228-T230 PolarHBondContact O-N 3.29Å; E228-Q1067 PolarHBondContact OE1-NE2 2.91Å; E228-Q1067 PolarHBondContact OE2-NE2 2.93Å
229	G	49.5	Very low	49.3	Very low	22 Å²	22	76.6 Å²	76.6	23%	0.227	38%	0.383	C	S	.	.			trans	-37	115.9	-169.6	0	0	0	0	0	111.6	E227 R1066	E227-G229 PolarHBondContact O-N 3.41Å; G229-R1066 WeakPolarHBondContact O-CB 3.31Å; G229-R1066 WeakPolarHBondContact O-CG 3.28Å; G229-R1066 PolarHBondContact O-N 2.92Å; G229-R1066 VanDerWaalsContact O-N 3.14Å
230	T	57.7	Low	50.5	Low	43 Å²	43	71.7 Å²	71.7	26%	0.264	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	142.3	-175.2	51.6	0	0	0	0	109.2	E228 K1063	E228-T230 VanDerWaalsContact O-CG2 3.23Å; E228-T230 WeakPolarHBondContact O-CG2 3.09Å; E228-T230 PolarHBondContact O-N 3.29Å; T230-K1063 HydrophobicContact CG2-CD 4.13Å; T230-K1063 HydrophobicContact CG2-CG 4.34Å
231	I	64.4	Low	51.9	Low	36 Å²	36	72.1 Å²	72.1	19%	0.185	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	137.1	-179	-53.6	175.2	0	0	0	107.3	E235 F236 M239 V1064	I231-E235 HydrophobicContact CG2-CB 3.78Å; I231-E235 HydrophobicContact CG2-CG 3.77Å; I231-F236 HydrophobicContact CG2-CB 4.14Å; I231-M239 HydrophobicContact CD1-SD 4.36Å; I231-V1064 PolarHBondContact N-O 3.32Å; I231-V1064 PolarHBondContact O-N 3.07Å
232	D	67.6	Low	52.4	Low	0 Å²	0	75.4 Å²	75.4	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	148.2	172.6	-177.6	22.8	0	0	0	110	T234 E235 F236 R1060	D232-T234 PolarHBondContact O-N 3.28Å; D232-T234 PolarHBondContact OD2-OG1 2.91Å; D232-E235 HydrophobicContact CB-CB 4.29Å; D232-E235 PolarHBondContact O-N 3.32Å; D232-E235 VanDerWaalsContact O-N 3.12Å; D232-F236 PolarHBondContact O-N 2.74Å; D232-R1060 IonicContact OD2-CZ 3.69Å; D232-R1060 IonicContact OD2-NH1 3.46Å; D232-R1060 PolarHBondContact OD2-NH1 3.26Å
233	V	67.6	Low	52.7	Low	0 Å²	0	74.9 Å²	74.9	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-54	-43.5	176.1	172.6	0	0	0	0	110.8	E235 F236 L237 L364 L367 F1070	V233-E235 VanDerWaalsContact C-N 3.33Å; V233-E235 PolarHBondContact O-N 3.2Å; V233-F236 PolarHBondContact O-N 2.94Å; V233-L237 HydrophobicContact CG1-CD1 4.09Å; V233-L237 WeakPolarHBondContact O-CB 3.39Å; V233-L237 VanDerWaalsContact O-CG 3.23Å; V233-L237 WeakPolarHBondContact O-CG 3.38Å; V233-L237 PolarHBondContact O-N 2.85Å; V233-L364 HydrophobicContact CB-CD2 4.1Å; V233-L364 HydrophobicContact CG1-CB 4.1Å; V233-L364 HydrophobicContact CG1-CD2 3.6Å; V233-L364 HydrophobicContact CG1-CG 4.49Å; V233-L364 WeakPolarHBondContact CG1-O 3.36Å; V233-L364 HydrophobicContact CG2-CD2 3.66Å; V233-L367 HydrophobicContact CG2-CD2 4.2Å; V233-F1070 HydrophobicContact CG2-CE2 4.06Å
234	T	65.7	Low	52.9	Low	12 Å²	12	72.3 Å²	72.3	7%	0.074	38%	0.376	C	S	.	.	H	α-helix	trans	-66.6	-33.6	-179.7	64.9	0	0	0	0	113.4	D232 S238 R1060	D232-T234 PolarHBondContact O-N 3.28Å; D232-T234 PolarHBondContact OD2-OG1 2.91Å; T234-S238 PolarHBondContact O-N 2.81Å; T234-R1060 PolarHBondContact OG1-NH1 3.34Å
235	E	67.4	Low	52.6	Low	84 Å²	84	75.4 Å²	75.4	39%	0.393	39%	0.391	S	S	.	.	H	α-helix	trans	-74.5	-44.5	177.5	-175.1	177.3	-167.4	0	0	110.8	I231 D232 V233 L237 S238 M239 N1083	I231-E235 HydrophobicContact CG2-CB 3.78Å; I231-E235 HydrophobicContact CG2-CG 3.77Å; D232-E235 HydrophobicContact CB-CB 4.29Å; D232-E235 PolarHBondContact O-N 3.32Å; D232-E235 VanDerWaalsContact O-N 3.12Å; V233-E235 VanDerWaalsContact C-N 3.33Å; V233-E235 PolarHBondContact O-N 3.2Å; E235-L237 VanDerWaalsContact C-N 3.3Å; E235-L237 PolarHBondContact O-N 3.28Å; E235-S238 WeakPolarHBondContact O-CB 3.45Å; E235-S238 PolarHBondContact O-N 3.02Å; E235-S238 PolarHBondContact O-OG 2.92Å; E235-M239 WeakPolarHBondContact O-CG 3.19Å; E235-M239 PolarHBondContact O-N 2.78Å; E235-N1083 PolarHBondContact OE2-ND2 3.27Å
236	F	66.5	Low	52.3	Low	25 Å²	25	75.4 Å²	75.4	11%	0.11	40%	0.395	C	S	.	.	H	α-helix	trans	-59.1	-40.3	173.8	-177.8	-95	0	0	0	112.3	I231 D232 V233 S238 M239 T240 A357 L364 V1064	I231-F236 HydrophobicContact CG2-CB 4.14Å; D232-F236 PolarHBondContact O-N 2.74Å; V233-F236 PolarHBondContact O-N 2.94Å; F236-S238 VanDerWaalsContact C-N 3.32Å; F236-S238 PolarHBondContact O-N 3.32Å; F236-M239 PolarHBondContact O-N 2.78Å; F236-T240 HydrophobicContact CD1-CG2 4.12Å; F236-T240 HydrophobicContact CE1-CG2 3.62Å; F236-T240 HydrophobicContact CE2-CG2 4.24Å; F236-T240 HydrophobicContact CZ-CG2 3.69Å; F236-T240 WeakPolarHBondContact O-CG2 3.02Å; F236-T240 PolarHBondContact O-N 3.35Å; F236-T240 PolarHBondContact O-OG1 3.36Å; F236-A357 HydrophobicContact CE1-CB 3.74Å; F236-A357 HydrophobicContact CE2-CB 4.27Å; F236-A357 HydrophobicContact CZ-CB 3.59Å; F236-L364 HydrophobicContact CD1-CD1 3.89Å; F236-L364 HydrophobicContact CE1-CD1 3.85Å; F236-V1064 HydrophobicContact CB-CG2 4.29Å; F236-V1064 HydrophobicContact CD1-CG2 4.42Å; F236-V1064 HydrophobicContact CD2-CB 4.45Å; F236-V1064 HydrophobicContact CD2-CG1 3.86Å; F236-V1064 HydrophobicContact CE2-CG1 4.08Å; F236-V1064 HydrophobicContact CG-CB 4.41Å; F236-V1064 HydrophobicContact CG-CG1 4.21Å; F236-V1064 HydrophobicContact CG-CG2 4.2Å
237	L	66.5	Low	52	Low	18 Å²	18	76 Å²	76	9%	0.094	41%	0.406	C	S	.	.	H	α-helix	trans	-62.6	-37.5	173.8	-72.2	170.9	0	0	0	112.2	V233 E235 T240 Q241 L364 R365	V233-L237 HydrophobicContact CG1-CD1 4.09Å; V233-L237 WeakPolarHBondContact O-CB 3.39Å; V233-L237 VanDerWaalsContact O-CG 3.23Å; V233-L237 WeakPolarHBondContact O-CG 3.38Å; V233-L237 PolarHBondContact O-N 2.85Å; E235-L237 VanDerWaalsContact C-N 3.3Å; E235-L237 PolarHBondContact O-N 3.28Å; L237-T240 WeakPolarHBondContact CA-OG1 3.41Å; L237-T240 PolarHBondContact O-OG1 2.77Å; L237-T240 VanDerWaalsContact O-OG1 3.13Å; L237-Q241 WeakPolarHBondContact O-CG 3.32Å; L237-Q241 PolarHBondContact O-N 3.02Å; L237-L364 HydrophobicContact CD2-CB 4.21Å; L237-R365 HydrophobicContact CD2-CB 4.37Å
238	S	63	Low	51.5	Low	61 Å²	61	80.4 Å²	80.4	43%	0.427	43%	0.43	S	S	.	.	H	α-helix	trans	-68	-36.6	176	71.7	0	0	0	0	112.8	T234 E235 F236	T234-S238 PolarHBondContact O-N 2.81Å; E235-S238 WeakPolarHBondContact O-CB 3.45Å; E235-S238 PolarHBondContact O-N 3.02Å; E235-S238 PolarHBondContact O-OG 2.92Å; F236-S238 VanDerWaalsContact C-N 3.32Å; F236-S238 PolarHBondContact O-N 3.32Å
239	M	61.8	Low	50.8	Low	102 Å²	102	86.8 Å²	86.8	50%	0.502	45%	0.45	S	S	.	.	H	α-helix	trans	-68.6	-40.9	176	-65.6	178.6	74.1	0	0	112.1	I231 E235 F236 Q241 Q242	I231-M239 HydrophobicContact CD1-SD 4.36Å; E235-M239 WeakPolarHBondContact O-CG 3.19Å; E235-M239 PolarHBondContact O-N 2.78Å; F236-M239 PolarHBondContact O-N 2.78Å; M239-Q241 VanDerWaalsContact C-N 3.34Å; M239-Q241 PolarHBondContact O-N 3.34Å; M239-Q242 PolarHBondContact O-N 3.48Å
240	T	55.1	Low	49.8	Very low	30 Å²	30	91.9 Å²	91.9	18%	0.184	47%	0.473	C	S	.	.	H	α-helix	trans	-74	-21.2	-178.3	49	0	0	0	0	114.2	F236 L237 Q242 D243 S244	F236-T240 HydrophobicContact CD1-CG2 4.12Å; F236-T240 HydrophobicContact CE1-CG2 3.62Å; F236-T240 HydrophobicContact CE2-CG2 4.24Å; F236-T240 HydrophobicContact CZ-CG2 3.69Å; F236-T240 WeakPolarHBondContact O-CG2 3.02Å; F236-T240 PolarHBondContact O-N 3.35Å; F236-T240 PolarHBondContact O-OG1 3.36Å; L237-T240 WeakPolarHBondContact CA-OG1 3.41Å; L237-T240 PolarHBondContact O-OG1 2.77Å; L237-T240 VanDerWaalsContact O-OG1 3.13Å; T240-Q242 PolarHBondContact O-N 3.05Å; T240-D243 PolarHBondContact O-N 3.24Å; T240-S244 PolarHBondContact O-OG 2.78Å
241	Q	51.6	Low	48.4	Very low	152 Å²	152	94 Å²	94	71%	0.71	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-19.5	172.4	-78.8	177.3	12.2	0	0	113.1	L237 M239	L237-Q241 WeakPolarHBondContact O-CG 3.32Å; L237-Q241 PolarHBondContact O-N 3.02Å; M239-Q241 VanDerWaalsContact C-N 3.34Å; M239-Q241 PolarHBondContact O-N 3.34Å
242	Q	39.9	Very low	46.7	Very low	170 Å²	170	103 Å²	103	79%	0.794	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-20	176.9	-70	-177.6	-22.5	0	0	113.6	M239 T240	M239-Q242 PolarHBondContact O-N 3.48Å; T240-Q242 PolarHBondContact O-N 3.05Å
243	D	37.8	Very low	44.7	Very low	153 Å²	153	106.8 Å²	106.8	82%	0.818	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.3	7	-170	-83.8	-28.3	0	0	0	116.3	T240	T240-D243 PolarHBondContact O-N 3.24Å
244	S	34.6	Very low	42.8	Very low	89 Å²	89	110.5 Å²	110.5	62%	0.622	60%	0.598	S	S	*	*			trans	-115.4	98.1	-174.2	50.4	0	0	0	0	114.9	T240	T240-S244 PolarHBondContact O-OG 2.78Å
245	H	28.5	Very low	41.2	Very low	181 Å²	181	114.6 Å²	114.6	84%	0.838	63%	0.627	S	S	*	*			trans	-97.2	140.2	159.2	-99.4	-75.9	0	0	0	110.8
246	N	30.1	Very low	39.5	Very low	149 Å²	149	120 Å²	120	80%	0.797	65%	0.65	S	S	*	*			trans	96.4	103.6	171.4	-67.3	-8.2	0	0	0	118.2
247	P	30.7	Very low	38.3	Very low	122 Å²	122	126.4 Å²	126.4	79%	0.792	68%	0.68	S	S	*	*			trans	-68.7	153.4	171.3	-11.9	25.8	0	0	0	113.8	R249	P247-R249 PolarHBondContact O-N 2.81Å; P247-R249 VanDerWaalsContact O-N 3.08Å
248	L	32.4	Very low	37.1	Very low	149 Å²	149	132.7 Å²	132.7	78%	0.78	71%	0.711	S	S	*	*			trans	-52.8	105.7	167.5	-70.6	151	0	0	0	110.3	D250	L248-D250 PolarHBondContact O-N 3.19Å
249	R	28	Very low	36.7	Very low	224 Å²	224	133 Å²	133	85%	0.845	71%	0.71	S	S	*	*			trans	-83.3	109.2	169.6	-170.4	174.3	167.7	-173.9	-4.4	108.2	P247 S251	P247-R249 PolarHBondContact O-N 2.81Å; P247-R249 VanDerWaalsContact O-N 3.08Å; R249-S251 PolarHBondContact O-N 3.13Å
250	D	28.3	Very low	37	Very low	130 Å²	130	133.4 Å²	133.4	70%	0.695	71%	0.714	S	S	*	*			trans	-58.1	96.6	171.7	-94.8	-28.2	0	0	0	110	L248	L248-D250 PolarHBondContact O-N 3.19Å
251	S	28.9	Very low	38.1	Very low	88 Å²	88	134.2 Å²	134.2	62%	0.615	72%	0.718	S	S	*	*			trans	-107.2	79.6	162.7	-63.2	0	0	0	0	108	R249 G253	R249-S251 PolarHBondContact O-N 3.13Å; S251-G253 PolarHBondContact O-N 3.38Å
252	R	28.6	Very low	39.6	Very low	224 Å²	224	130.4 Å²	130.4	85%	0.845	70%	0.702	S	S	*	*			trans	-74.4	104	165.4	-66.9	-178.5	-174.2	-171.6	1.3	107.6
253	G	25.3	Very low	41.8	Very low	80 Å²	80	123.6 Å²	123.6	83%	0.825	67%	0.673	S	S	*	*			trans	159.8	101	175.7	0	0	0	0	0	110.8	S251	S251-G253 PolarHBondContact O-N 3.38Å
254	G	27.9	Very low	44	Very low	77 Å²	77	116.4 Å²	116.4	79%	0.794	64%	0.635	S	S	*	*			trans	-161.1	80.1	177.6	0	0	0	0	0	109.5
255	S	31.6	Very low	46.4	Very low	99 Å²	99	115.8 Å²	115.8	69%	0.692	62%	0.624	S	S	*	*			trans	-52.3	153.5	166.6	37.2	0	0	0	0	112.1	E257	S255-E257 PolarHBondContact O-N 2.95Å
256	F	33.4	Very low	49.2	Very low	197 Å²	197	113.6 Å²	113.6	86%	0.864	61%	0.608	S	S	*	*			trans	-61.5	90	172.2	-81.8	-98.3	0	0	0	110.8
257	E	39.5	Very low	51.9	Low	159 Å²	159	106.5 Å²	106.5	74%	0.743	57%	0.57	S	S	*	*			trans	-115.4	129.5	164.6	-77.3	-174.9	168.6	0	0	109.8	S255 T259	S255-E257 PolarHBondContact O-N 2.95Å; E257-T259 PolarHBondContact O-N 3.42Å
258	M	42.8	Very low	54.6	Low	151 Å²	151	103 Å²	103	74%	0.744	55%	0.545	S	S	*	.			trans	-56.1	109	168.8	-80.1	-102.9	-122.6	0	0	108.3	D260 L306	M258-D260 PolarHBondContact O-N 2.83Å; M258-L306 HydrophobicContact SD-CD1 4.31Å
259	T	54.2	Low	57.2	Low	67 Å²	67	101 Å²	101	41%	0.411	54%	0.539	S	S	.	.			trans	-63.6	129.1	176.7	45.5	0	0	0	0	109.8	E257 D261 V320 L336	E257-T259 PolarHBondContact O-N 3.42Å; T259-D261 PolarHBondContact O-N 2.83Å; T259-V320 PolarHBondContact OG1-O 3.1Å; T259-L336 HydrophobicContact CG2-CD1 4.4Å; T259-L336 VanDerWaalsContact OG1-CD1 3.23Å; T259-L336 WeakPolarHBondContact OG1-CD1 3.29Å
260	D	67.5	Low	60.1	Low	111 Å²	111	94.1 Å²	94.1	59%	0.594	52%	0.517	S	S	*	.			trans	-46.8	136	174.2	-170.4	7	0	0	0	111.1	M258 D262 S263 A264	M258-D260 PolarHBondContact O-N 2.83Å; D260-D262 PolarHBondContact O-N 3.24Å; D260-D262 VanDerWaalsContact O-N 3.13Å; D260-S263 WeakPolarHBondContact O-CB 3.47Å; D260-S263 PolarHBondContact O-N 3.32Å; D260-A264 PolarHBondContact O-N 3.22Å
261	D	78.9	Confident	63	Low	47 Å²	47	88.1 Å²	88.1	25%	0.251	48%	0.484	S	S	.	.	H	α-helix	trans	-59.5	-29.3	-176.2	-157.9	16.5	0	0	0	110.4	T259 A264 I265 K332	T259-D261 PolarHBondContact O-N 2.83Å; D261-A264 WeakPolarHBondContact O-CB 3.36Å; D261-A264 PolarHBondContact O-N 3.4Å; D261-I265 WeakPolarHBondContact O-CD1 3.06Å; D261-I265 VanDerWaalsContact O-CG1 3.25Å; D261-I265 WeakPolarHBondContact O-CG1 3.35Å; D261-I265 PolarHBondContact O-N 3.17Å; D261-K332 IonicContact OD1-NZ 2.66Å; D261-K332 PolarHBondContact OD1-NZ 3.35Å; D261-K332 IonicContact OD2-NZ 3.01Å
262	D	83.1	Confident	65.7	Low	71 Å²	71	88.8 Å²	88.8	38%	0.38	49%	0.486	S	S	.	.	H	α-helix	trans	-64	-38.9	174.4	-170.1	50.1	0	0	0	112.9	D260 A264 I265 R266	D260-D262 PolarHBondContact O-N 3.24Å; D260-D262 VanDerWaalsContact O-N 3.13Å; D262-A264 VanDerWaalsContact C-N 3.35Å; D262-A264 PolarHBondContact O-N 2.79Å; D262-I265 PolarHBondContact O-N 3.48Å; D262-R266 WeakPolarHBondContact O-CG 3.37Å; D262-R266 PolarHBondContact O-N 2.95Å; D262-R266 IonicContact OD2-CZ 3.4Å; D262-R266 IonicContact OD2-NE 3.57Å; D262-R266 IonicContact OD2-NH1 2.63Å; D262-R266 PolarHBondContact OD2-NH1 3.4Å; D262-R266 IonicContact OD2-NH2 4Å; D262-R266 PolarHBondContact OD2-NH2 3.07Å
263	S	85.2	Confident	68.6	Low	27 Å²	27	83.7 Å²	83.7	19%	0.189	48%	0.475	C	S	.	.	H	α-helix	trans	-64.1	-41.5	174.7	-174.7	0	0	0	0	111.6	D260 R266 A267	D260-S263 WeakPolarHBondContact O-CB 3.47Å; D260-S263 PolarHBondContact O-N 3.32Å; S263-R266 PolarHBondContact O-N 3.29Å; S263-A267 WeakPolarHBondContact O-CB 3.36Å; S263-A267 PolarHBondContact O-N 3.13Å
264	A	83.6	Confident	71.7	Confident	2 Å²	2	79.9 Å²	79.9	2%	0.017	44%	0.436	C	S	.	.	H	α-helix	trans	-65.5	-39.6	177	0	0	0	0	0	112.3	D260 D261 D262 A267 L268 K332 L336	D260-A264 PolarHBondContact O-N 3.22Å; D261-A264 WeakPolarHBondContact O-CB 3.36Å; D261-A264 PolarHBondContact O-N 3.4Å; D262-A264 VanDerWaalsContact C-N 3.35Å; D262-A264 PolarHBondContact O-N 2.79Å; A264-A267 PolarHBondContact O-N 2.82Å; A264-L268 WeakPolarHBondContact O-CB 3.27Å; A264-L268 PolarHBondContact O-N 3.11Å; A264-K332 HydrophobicContact CB-CB 4.06Å; A264-K332 HydrophobicContact CB-CD 4.22Å; A264-K332 HydrophobicContact CB-CG 4.2Å; A264-L336 HydrophobicContact CB-CD1 4.15Å; A264-L336 HydrophobicContact CB-CD2 4.41Å; A264-L336 HydrophobicContact CB-CG 4.28Å
265	I	85.5	Confident	74.6	Confident	77 Å²	77	78.5 Å²	78.5	40%	0.395	41%	0.408	S	S	.	.	H	α-helix	trans	-66.6	-44.2	176.4	-67.2	162.9	0	0	0	110.9	D261 D262 A267 L268 T269	D261-I265 WeakPolarHBondContact O-CD1 3.06Å; D261-I265 VanDerWaalsContact O-CG1 3.25Å; D261-I265 WeakPolarHBondContact O-CG1 3.35Å; D261-I265 PolarHBondContact O-N 3.17Å; D262-I265 PolarHBondContact O-N 3.48Å; I265-A267 VanDerWaalsContact C-N 3.33Å; I265-A267 PolarHBondContact O-N 3.39Å; I265-L268 PolarHBondContact O-N 3.17Å; I265-T269 PolarHBondContact O-N 3.06Å; I265-T269 PolarHBondContact O-OG1 3.21Å
266	R	88.3	Confident	77.3	Confident	134 Å²	134	78.3 Å²	78.3	51%	0.506	40%	0.399	S	S	.	.	H	α-helix	trans	-62	-38.8	173.7	-73.9	-171.5	-67.8	-127.2	-6.7	112.8	D262 S263 T269 Q270	D262-R266 WeakPolarHBondContact O-CG 3.37Å; D262-R266 PolarHBondContact O-N 2.95Å; D262-R266 IonicContact OD2-CZ 3.4Å; D262-R266 IonicContact OD2-NE 3.57Å; D262-R266 IonicContact OD2-NH1 2.63Å; D262-R266 PolarHBondContact OD2-NH1 3.4Å; D262-R266 IonicContact OD2-NH2 4Å; D262-R266 PolarHBondContact OD2-NH2 3.07Å; S263-R266 PolarHBondContact O-N 3.29Å; R266-T269 WeakPolarHBondContact CA-OG1 3.48Å; R266-T269 PolarHBondContact O-OG1 2.9Å; R266-Q270 PolarHBondContact O-N 2.91Å; R266-Q270 VanDerWaalsContact O-N 3.15Å
267	A	86.3	Confident	80	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-65.8	-41.7	174.5	0	0	0	0	0	111.3	S263 A264 I265 T269 Q270 F271 A335 L336 K339	S263-A267 WeakPolarHBondContact O-CB 3.36Å; S263-A267 PolarHBondContact O-N 3.13Å; A264-A267 PolarHBondContact O-N 2.82Å; I265-A267 VanDerWaalsContact C-N 3.33Å; I265-A267 PolarHBondContact O-N 3.39Å; A267-T269 VanDerWaalsContact C-N 3.35Å; A267-T269 PolarHBondContact O-N 2.96Å; A267-Q270 WeakPolarHBondContact O-CB 3.26Å; A267-Q270 PolarHBondContact O-N 2.6Å; A267-F271 WeakPolarHBondContact O-CD2 3.38Å; A267-F271 PolarHBondContact O-N 2.56Å; A267-A335 HydrophobicContact CB-CB 3.86Å; A267-L336 HydrophobicContact CB-CD2 4.07Å; A267-K339 HydrophobicContact CB-CB 4.33Å; A267-K339 HydrophobicContact CB-CD 4.11Å
268	L	87.4	Confident	82.3	Confident	48 Å²	48	62.2 Å²	62.2	25%	0.251	33%	0.328	S	S	.	.	H	α-helix	trans	-67.7	-33.5	-179.6	-172.8	63.9	0	0	0	112.8	A264 I265 F271 P274 N331 K332 A335	A264-L268 WeakPolarHBondContact O-CB 3.27Å; A264-L268 PolarHBondContact O-N 3.11Å; I265-L268 PolarHBondContact O-N 3.17Å; L268-F271 CarbonylContact O-C 3.58Å; L268-F271 VanDerWaalsContact O-C 3.24Å; L268-F271 PolarHBondContact O-N 3.18Å; L268-F271 VanDerWaalsContact O-O 3.12Å; L268-P274 HydrophobicContact CD1-CG 4Å; L268-N331 HydrophobicContact CD1-CB 3.99Å; L268-K332 HydrophobicContact CD2-CG 4.14Å; L268-A335 HydrophobicContact CB-CB 4.08Å; L268-A335 HydrophobicContact CD1-CB 4.14Å
269	T	87.3	Confident	84.5	Confident	109 Å²	109	56.3 Å²	56.3	67%	0.669	30%	0.303	S	S	*	.	H	α-helix	trans	-68.1	-35.9	171.3	48.4	0	0	0	0	111.9	I265 R266 A267	I265-T269 PolarHBondContact O-N 3.06Å; I265-T269 PolarHBondContact O-OG1 3.21Å; R266-T269 WeakPolarHBondContact CA-OG1 3.48Å; R266-T269 PolarHBondContact O-OG1 2.9Å; A267-T269 VanDerWaalsContact C-N 3.35Å; A267-T269 PolarHBondContact O-N 2.96Å
270	Q	88	Confident	86	Confident	79 Å²	79	58.3 Å²	58.3	37%	0.369	31%	0.306	S	S	.	.	H	α-helix	trans	-71.2	-33.4	175.1	-171.9	175.3	23.6	0	0	113	R266 A267 N351	R266-Q270 PolarHBondContact O-N 2.91Å; R266-Q270 VanDerWaalsContact O-N 3.15Å; A267-Q270 WeakPolarHBondContact O-CB 3.26Å; A267-Q270 PolarHBondContact O-N 2.6Å; Q270-N351 PolarHBondContact O-ND2 3.46Å
271	F	89.6	Confident	86.9	Confident	3 Å²	3	53 Å²	53	1%	0.013	28%	0.277	C	S	.	.			trans	-126.2	86.6	-177.7	-59.4	-80.6	0	0	0	110.1	A267 L268 L273 P274 L277 C338 K339 K342 N351	A267-F271 WeakPolarHBondContact O-CD2 3.38Å; A267-F271 PolarHBondContact O-N 2.56Å; L268-F271 CarbonylContact O-C 3.58Å; L268-F271 VanDerWaalsContact O-C 3.24Å; L268-F271 PolarHBondContact O-N 3.18Å; L268-F271 VanDerWaalsContact O-O 3.12Å; F271-L273 VanDerWaalsContact C-N 3.32Å; F271-L273 PolarHBondContact O-N 3.26Å; F271-P274 HydrophobicContact CB-CB 4.16Å; F271-P274 VanDerWaalsContact O-CD 3.25Å; F271-P274 WeakPolarHBondContact O-CD 2.96Å; F271-L277 HydrophobicContact CD1-CD2 3.57Å; F271-L277 HydrophobicContact CE1-CD2 3.95Å; F271-C338 HydrophobicContact CB-CB 4.08Å; F271-C338 HydrophobicContact CD1-CB 3.62Å; F271-C338 HydrophobicContact CD2-CB 3.67Å; F271-C338 HydrophobicContact CE1-CB 3.86Å; F271-C338 HydrophobicContact CE2-CB 3.96Å; F271-C338 HydrophobicContact CG-CB 3.5Å; F271-C338 HydrophobicContact CZ-CB 4.03Å; F271-K339 HydrophobicContact CE2-CB 3.84Å; F271-K342 HydrophobicContact CE1-CD 4.31Å; F271-K342 HydrophobicContact CZ-CB 3.95Å; F271-K342 HydrophobicContact CZ-CD 3.78Å; F271-K342 HydrophobicContact CZ-CG 4.49Å; F271-N351 HydrophobicContact CD1-CB 4.02Å; F271-N351 HydrophobicContact CE1-CB 3.84Å; F271-N351 VanDerWaalsContact CE1-CG 3.47Å; F271-N351 WeakPolarHBondContact CE1-OD1 3.42Å
272	P	86	Confident	87.2	Confident	102 Å²	102	50.8 Å²	50.8	66%	0.662	27%	0.266	S	S	*	.	S	Bend	trans	-67.6	-28.7	-172.9	24.3	-33.9	0	0	0	113.8	P274	P272-P274 VanDerWaalsContact C-CD 3.45Å; P272-P274 WeakPolarHBondContact O-CD 3.4Å
273	L	89.5	Confident	87.3	Confident	117 Å²	117	51.1 Å²	51.1	61%	0.613	27%	0.265	S	S	*	.	S	Bend	trans	-121.1	62.1	177.5	-65.1	175.2	0	0	0	111.4	F271 K275 N276 L277	F271-L273 VanDerWaalsContact C-N 3.32Å; F271-L273 PolarHBondContact O-N 3.26Å; L273-K275 PolarHBondContact O-N 3.34Å; L273-N276 HydrophobicContact CB-CB 4.28Å; L273-N276 PolarHBondContact O-N 3.06Å; L273-L277 PolarHBondContact O-N 3.05Å
274	P	89.7	Confident	87.2	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-69.3	-37.6	-164.7	28.6	-32.7	0	0	0	112.3	L268 F271 P272 N276 L277 L278 N331 A334 A335 C338	L268-P274 HydrophobicContact CD1-CG 4Å; F271-P274 HydrophobicContact CB-CB 4.16Å; F271-P274 VanDerWaalsContact O-CD 3.25Å; F271-P274 WeakPolarHBondContact O-CD 2.96Å; P272-P274 VanDerWaalsContact C-CD 3.45Å; P272-P274 WeakPolarHBondContact O-CD 3.4Å; P274-N276 VanDerWaalsContact C-N 3.33Å; P274-N276 PolarHBondContact O-N 2.69Å; P274-L277 PolarHBondContact O-N 3.34Å; P274-L278 WeakPolarHBondContact O-CB 3.35Å; P274-L278 WeakPolarHBondContact O-CG 3.4Å; P274-L278 PolarHBondContact O-N 3.36Å; P274-N331 HydrophobicContact CG-CB 4.3Å; P274-N331 VanDerWaalsContact CG-O 3.25Å; P274-N331 WeakPolarHBondContact CG-O 3.47Å; P274-A334 HydrophobicContact CB-CB 3.79Å; P274-A334 HydrophobicContact CG-CB 3.91Å; P274-A335 HydrophobicContact CB-CB 3.95Å; P274-A335 HydrophobicContact CG-CB 4.09Å; P274-C338 PolarHBondContact O-SG 3.39Å; P274-C338 VanDerWaalsContact O-SG 3.39Å
275	K	89.6	Confident	87.1	Confident	48 Å²	48	53 Å²	53	21%	0.209	27%	0.273	C	S	.	.	H	α-helix	trans	-60.5	-42.1	175.8	-68.9	-177.7	175.3	175.3	0	112.6	L273 A279 F297 E330 N331 A334	L273-K275 PolarHBondContact O-N 3.34Å; K275-A279 VanDerWaalsContact O-CB 3.32Å; K275-A279 WeakPolarHBondContact O-CB 3.44Å; K275-A279 PolarHBondContact O-N 3.18Å; K275-F297 HydrophobicContact CD-CE2 4.37Å; K275-F297 HydrophobicContact CD-CZ 4.24Å; K275-F297 HydrophobicContact CG-CE2 4.34Å; K275-F297 HydrophobicContact CG-CZ 3.95Å; K275-E330 IonicContact NZ-OE2 3.84Å; K275-E330 PolarHBondContact NZ-OE2 3.17Å; K275-N331 WeakPolarHBondContact CD-OD1 3.38Å; K275-N331 WeakPolarHBondContact CE-OD1 3.25Å; K275-A334 HydrophobicContact CG-CB 3.83Å
276	N	88.3	Confident	86.9	Confident	94 Å²	94	51.7 Å²	51.7	50%	0.503	27%	0.268	S	S	.	.	H	α-helix	trans	-68.9	-42.5	179.4	-69.6	-10.8	0	0	0	110.6	L273 P274 A279 K280	L273-N276 HydrophobicContact CB-CB 4.28Å; L273-N276 PolarHBondContact O-N 3.06Å; P274-N276 VanDerWaalsContact C-N 3.33Å; P274-N276 PolarHBondContact O-N 2.69Å; N276-A279 PolarHBondContact O-N 2.74Å; N276-K280 WeakPolarHBondContact O-CB 3.35Å; N276-K280 WeakPolarHBondContact O-CG 3.2Å; N276-K280 PolarHBondContact O-N 2.76Å
277	L	89.1	Confident	86.3	Confident	19 Å²	19	48.7 Å²	48.7	10%	0.099	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-49.1	176	-179.8	59.7	0	0	0	111.2	F271 L273 P274 A279 K280 V281 C338 V347 N351 P353	F271-L277 HydrophobicContact CD1-CD2 3.57Å; F271-L277 HydrophobicContact CE1-CD2 3.95Å; L273-L277 PolarHBondContact O-N 3.05Å; P274-L277 PolarHBondContact O-N 3.34Å; L277-A279 PolarHBondContact O-N 2.81Å; L277-K280 PolarHBondContact O-N 2.83Å; L277-V281 HydrophobicContact CD1-CG2 4.03Å; L277-V281 HydrophobicContact CG-CG2 4.31Å; L277-V281 WeakPolarHBondContact O-CB 3.47Å; L277-V281 VanDerWaalsContact O-CG2 3.24Å; L277-V281 WeakPolarHBondContact O-CG2 3.47Å; L277-V281 PolarHBondContact O-N 2.74Å; L277-C338 HydrophobicContact CD2-CB 4.35Å; L277-V347 HydrophobicContact CD2-CG1 4.27Å; L277-N351 WeakPolarHBondContact CD1-O 3.26Å; L277-N351 WeakPolarHBondContact CD2-O 3.38Å; L277-P353 HydrophobicContact CD1-CG 3.92Å
278	L	89.1	Confident	85.9	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-58.6	-46.4	176.3	-70.9	174.9	0	0	0	112.2	P274 K280 V281 I282 M295 L309 L311 A334 A337 C338 L341	P274-L278 WeakPolarHBondContact O-CB 3.35Å; P274-L278 WeakPolarHBondContact O-CG 3.4Å; P274-L278 PolarHBondContact O-N 3.36Å; L278-K280 VanDerWaalsContact C-N 3.34Å; L278-K280 PolarHBondContact O-N 2.87Å; L278-V281 PolarHBondContact O-N 3.29Å; L278-I282 WeakPolarHBondContact O-CB 3.31Å; L278-I282 WeakPolarHBondContact O-CD1 3.39Å; L278-I282 VanDerWaalsContact O-CG1 3.22Å; L278-I282 WeakPolarHBondContact O-CG1 3.44Å; L278-I282 PolarHBondContact O-N 3.45Å; L278-M295 HydrophobicContact CB-CE 4Å; L278-M295 HydrophobicContact CB-SD 4.01Å; L278-M295 HydrophobicContact CD1-CE 3.46Å; L278-M295 VanDerWaalsContact CD1-CE 3.46Å; L278-M295 HydrophobicContact CD1-SD 4.46Å; L278-M295 HydrophobicContact CG-CE 4.38Å; L278-L309 HydrophobicContact CD1-CD2 3.9Å; L278-L311 HydrophobicContact CD2-CD1 4.35Å; L278-A334 HydrophobicContact CD1-CB 3.76Å; L278-A334 WeakPolarHBondContact CD1-O 3.4Å; L278-A337 HydrophobicContact CD1-CB 3.79Å; L278-A337 HydrophobicContact CD2-CB 4.11Å; L278-C338 VanDerWaalsContact CG-SG 3.57Å; L278-L341 HydrophobicContact CD2-CD1 3.38Å; L278-L341 HydrophobicContact CD2-CG 4.36Å
279	A	87.7	Confident	85.3	Confident	27 Å²	27	53 Å²	53	22%	0.223	30%	0.302	C	S	.	.	H	α-helix	trans	-60.2	-44.7	178.2	0	0	0	0	0	111.5	K275 N276 L277 Q283 A291	K275-A279 VanDerWaalsContact O-CB 3.32Å; K275-A279 WeakPolarHBondContact O-CB 3.44Å; K275-A279 PolarHBondContact O-N 3.18Å; N276-A279 PolarHBondContact O-N 2.74Å; L277-A279 PolarHBondContact O-N 2.81Å; A279-Q283 VanDerWaalsContact O-CB 3.32Å; A279-Q283 WeakPolarHBondContact O-CB 3.31Å; A279-Q283 WeakPolarHBondContact O-CG 3.31Å; A279-Q283 PolarHBondContact O-N 2.87Å; A279-A291 HydrophobicContact CB-CB 3.93Å
280	K	86.5	Confident	84.9	Confident	108 Å²	108	50.5 Å²	50.5	47%	0.47	29%	0.287	S	S	.	.	H	α-helix	trans	-62.3	-48.6	175.6	-76.2	179.9	177.5	-174.6	0	112	N276 L277 L278 I282 Q283 I284 P353	N276-K280 WeakPolarHBondContact O-CB 3.35Å; N276-K280 WeakPolarHBondContact O-CG 3.2Å; N276-K280 PolarHBondContact O-N 2.76Å; L277-K280 PolarHBondContact O-N 2.83Å; L278-K280 VanDerWaalsContact C-N 3.34Å; L278-K280 PolarHBondContact O-N 2.87Å; K280-I282 VanDerWaalsContact C-N 3.35Å; K280-I282 PolarHBondContact O-N 3.09Å; K280-Q283 PolarHBondContact O-N 3.25Å; K280-I284 WeakPolarHBondContact O-CB 3.48Å; K280-I284 WeakPolarHBondContact O-CD1 3.37Å; K280-I284 WeakPolarHBondContact O-CG1 3.26Å; K280-I284 PolarHBondContact O-N 2.77Å; K280-P353 HydrophobicContact CB-CG 3.83Å; K280-P353 HydrophobicContact CD-CG 4.43Å
281	V	87	Confident	84.7	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-56.5	-49.2	178.5	166.8	0	0	0	0	110.5	L277 L278 I284 A285 W313 L341 V347 P353 Y359	L277-V281 HydrophobicContact CD1-CG2 4.03Å; L277-V281 HydrophobicContact CG-CG2 4.31Å; L277-V281 WeakPolarHBondContact O-CB 3.47Å; L277-V281 VanDerWaalsContact O-CG2 3.24Å; L277-V281 WeakPolarHBondContact O-CG2 3.47Å; L277-V281 PolarHBondContact O-N 2.74Å; L278-V281 PolarHBondContact O-N 3.29Å; V281-I284 PolarHBondContact O-N 3.1Å; V281-A285 WeakPolarHBondContact O-CB 3.31Å; V281-A285 PolarHBondContact O-N 2.99Å; V281-W313 HydrophobicContact CG1-CH2 4.09Å; V281-W313 HydrophobicContact CG1-CZ3 3.64Å; V281-L341 HydrophobicContact CG1-CD1 4.05Å; V281-V347 HydrophobicContact CG2-CG2 4.15Å; V281-P353 HydrophobicContact CG2-CB 3.87Å; V281-P353 HydrophobicContact CG2-CG 4.06Å; V281-Y359 HydrophobicContact CG1-CE1 4.2Å; V281-Y359 WeakPolarHBondContact CG1-OH 3.22Å
282	I	85.4	Confident	84.3	Confident	1 Å²	1	55 Å²	55	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-64.3	-46.5	-179.8	-68.1	166.4	0	0	0	110.9	L278 K280 I284 A285 T286 A291 L294 M295 L311 W313	L278-I282 WeakPolarHBondContact O-CB 3.31Å; L278-I282 WeakPolarHBondContact O-CD1 3.39Å; L278-I282 VanDerWaalsContact O-CG1 3.22Å; L278-I282 WeakPolarHBondContact O-CG1 3.44Å; L278-I282 PolarHBondContact O-N 3.45Å; K280-I282 VanDerWaalsContact C-N 3.35Å; K280-I282 PolarHBondContact O-N 3.09Å; I282-I284 VanDerWaalsContact C-N 3.33Å; I282-I284 PolarHBondContact O-N 2.95Å; I282-A285 PolarHBondContact O-N 2.89Å; I282-T286 WeakPolarHBondContact O-CB 3.35Å; I282-T286 PolarHBondContact O-N 3.44Å; I282-T286 PolarHBondContact O-OG1 3.18Å; I282-A291 HydrophobicContact CB-CB 4.25Å; I282-A291 HydrophobicContact CD1-CB 4.42Å; I282-A291 HydrophobicContact CG2-CB 4.14Å; I282-L294 HydrophobicContact CG2-CB 3.86Å; I282-L294 HydrophobicContact CG2-CD1 3.45Å; I282-L294 VanDerWaalsContact CG2-CD1 3.45Å; I282-L294 HydrophobicContact CG2-CG 4.29Å; I282-M295 HydrophobicContact CD1-CB 3.9Å; I282-M295 HydrophobicContact CD1-CG 4.43Å; I282-M295 HydrophobicContact CD1-SD 4.48Å; I282-L311 HydrophobicContact CD1-CD2 3.62Å; I282-W313 HydrophobicContact CG1-CE3 4.41Å
283	Q	84.7	Confident	84	Confident	78 Å²	78	55.5 Å²	55.5	36%	0.364	30%	0.304	S	S	.	.	H	α-helix	trans	-61	-41.9	178.8	-76.2	176.1	-28.8	0	0	111.8	A279 K280 S287 S289	A279-Q283 VanDerWaalsContact O-CB 3.32Å; A279-Q283 WeakPolarHBondContact O-CB 3.31Å; A279-Q283 WeakPolarHBondContact O-CG 3.31Å; A279-Q283 PolarHBondContact O-N 2.87Å; K280-Q283 PolarHBondContact O-N 3.25Å; Q283-S287 VanDerWaalsContact O-CA 3.28Å; Q283-S287 WeakPolarHBondContact O-CA 3.47Å; Q283-S287 PolarHBondContact O-N 2.92Å; Q283-S287 VanDerWaalsContact O-N 3.08Å; Q283-S289 PolarHBondContact NE2-O 3.29Å
284	I	83.2	Confident	83.8	Confident	62 Å²	62	51.9 Å²	51.9	32%	0.318	29%	0.285	S	S	.	.	H	α-helix	trans	-72.7	-43	179.1	-65.3	164.8	0	0	0	111.2	K280 V281 I282 P353 L354 H356 Y359	K280-I284 WeakPolarHBondContact O-CB 3.48Å; K280-I284 WeakPolarHBondContact O-CD1 3.37Å; K280-I284 WeakPolarHBondContact O-CG1 3.26Å; K280-I284 PolarHBondContact O-N 2.77Å; V281-I284 PolarHBondContact O-N 3.1Å; I282-I284 VanDerWaalsContact C-N 3.33Å; I282-I284 PolarHBondContact O-N 2.95Å; I284-P353 HydrophobicContact CD1-CB 3.63Å; I284-P353 HydrophobicContact CD1-CG 3.97Å; I284-L354 WeakPolarHBondContact CG2-O 3.39Å; I284-H356 HydrophobicContact CG2-CB 4.06Å; I284-H356 PolarHBondContact O-CD2 2.68Å; I284-Y359 HydrophobicContact CB-CE2 4.25Å; I284-Y359 HydrophobicContact CG2-CD2 4.04Å; I284-Y359 HydrophobicContact CG2-CE2 3.85Å
285	A	81.8	Confident	83.8	Confident	6 Å²	6	52.8 Å²	52.8	5%	0.05	29%	0.289	C	S	.	.	H	α-helix	trans	-70.1	-37.6	-176.8	0	0	0	0	0	113.1	V281 I282 W313 Y359	V281-A285 WeakPolarHBondContact O-CB 3.31Å; V281-A285 PolarHBondContact O-N 2.99Å; I282-A285 PolarHBondContact O-N 2.89Å; A285-W313 HydrophobicContact CB-CH2 3.68Å; A285-W313 HydrophobicContact CB-CZ2 3.36Å; A285-W313 HydrophobicContact CB-CZ3 4.39Å; A285-Y359 HydrophobicContact CB-CD1 3.89Å; A285-Y359 HydrophobicContact CB-CD2 3.58Å; A285-Y359 HydrophobicContact CB-CE1 4.31Å; A285-Y359 HydrophobicContact CB-CE2 4.01Å; A285-Y359 HydrophobicContact CB-CG 3.5Å
286	T	80.4	Confident	83.7	Confident	50 Å²	50	55.9 Å²	55.9	31%	0.307	30%	0.304	S	S	.	.	H	α-helix	trans	-103.4	-2.6	-173.3	65.8	0	0	0	0	113.9	I282 S288 L294 W313	I282-T286 WeakPolarHBondContact O-CB 3.35Å; I282-T286 PolarHBondContact O-N 3.44Å; I282-T286 PolarHBondContact O-OG1 3.18Å; T286-S288 PolarHBondContact O-N 3.27Å; T286-S288 VanDerWaalsContact OG1-CB 3.28Å; T286-S288 WeakPolarHBondContact OG1-CB 3.39Å; T286-S288 PolarHBondContact OG1-N 3.42Å; T286-L294 HydrophobicContact CG2-CD1 3.85Å; T286-W313 HydrophobicContact CG2-CG 4.07Å
287	S	75.9	Confident	83.8	Confident	70 Å²	70	54.4 Å²	54.4	49%	0.49	29%	0.294	S	S	.	.			trans	52.9	18.6	-169.5	-80.4	0	0	0	0	114.2	Q283 H356	Q283-S287 VanDerWaalsContact O-CA 3.28Å; Q283-S287 WeakPolarHBondContact O-CA 3.47Å; Q283-S287 PolarHBondContact O-N 2.92Å; Q283-S287 VanDerWaalsContact O-N 3.08Å; S287-H356 PolarHBondContact OG-CD2 2.98Å; S287-H356 PolarHBondContact OG-NE2 3.46Å
288	S	77.9	Confident	83.9	Confident	36 Å²	36	59.5 Å²	59.5	25%	0.252	32%	0.317	S	S	.	.			trans	-72.8	140.9	178.6	179.8	0	0	0	0	111	T286 T290	T286-S288 PolarHBondContact O-N 3.27Å; T286-S288 VanDerWaalsContact OG1-CB 3.28Å; T286-S288 WeakPolarHBondContact OG1-CB 3.39Å; T286-S288 PolarHBondContact OG1-N 3.42Å; S288-T290 PolarHBondContact O-N 2.63Å; S288-T290 PolarHBondContact OG-N 2.95Å; S288-T290 PolarHBondContact OG-O 3.31Å
289	S	75.7	Confident	83.9	Confident	103 Å²	103	61.1 Å²	61.1	72%	0.72	33%	0.327	S	S	*	.	S	Bend	trans	-66.4	-26.7	173.8	60.2	0	0	0	0	112.6	Q283	Q283-S289 PolarHBondContact NE2-O 3.29Å
290	T	78.4	Confident	83.9	Confident	57 Å²	57	63.7 Å²	63.7	35%	0.35	34%	0.339	S	S	.	.			trans	-139.2	136.3	-177.2	59.4	0	0	0	0	111.8	S288 K292	S288-T290 PolarHBondContact O-N 2.63Å; S288-T290 PolarHBondContact OG-N 2.95Å; S288-T290 PolarHBondContact OG-O 3.31Å; T290-K292 VanDerWaalsContact C-N 3.29Å
291	A	82.4	Confident	83.8	Confident	9 Å²	9	60.3 Å²	60.3	7%	0.074	34%	0.336	C	S	.	.	S	Bend	trans	-77	-15.9	173.9	0	0	0	0	0	113	A279 I282 N293 L294 M295	A279-A291 HydrophobicContact CB-CB 3.93Å; I282-A291 HydrophobicContact CB-CB 4.25Å; I282-A291 HydrophobicContact CD1-CB 4.42Å; I282-A291 HydrophobicContact CG2-CB 4.14Å; A291-N293 VanDerWaalsContact C-N 3.26Å; A291-N293 PolarHBondContact O-N 3.31Å; A291-L294 CarbonylContact O-C 3.55Å; A291-L294 PolarHBondContact O-N 3.07Å; A291-M295 VanDerWaalsContact O-CB 3.28Å; A291-M295 WeakPolarHBondContact O-CB 3.3Å; A291-M295 PolarHBondContact O-N 3.13Å
292	K	81.6	Confident	83.4	Confident	168 Å²	168	66.3 Å²	66.3	73%	0.73	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-33.6	-172	-69.7	-173.4	177.5	-178.1	0	114	T290 L294 M295	T290-K292 VanDerWaalsContact C-N 3.29Å; K292-L294 VanDerWaalsContact C-N 3.3Å; K292-L294 PolarHBondContact O-N 3.25Å; K292-M295 VanDerWaalsContact O-O 3.12Å
293	N	81.2	Confident	83.3	Confident	111 Å²	111	75.1 Å²	75.1	59%	0.594	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-28.7	-179.9	-64.6	-10	0	0	0	112.2	A291	A291-N293 VanDerWaalsContact C-N 3.26Å; A291-N293 PolarHBondContact O-N 3.31Å
294	L	84.5	Confident	83.3	Confident	42 Å²	42	75.5 Å²	75.5	22%	0.22	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-8	-176.4	-65.7	169.8	0	0	0	112.8	I282 T286 A291 K292 L311 L312	I282-L294 HydrophobicContact CG2-CB 3.86Å; I282-L294 HydrophobicContact CG2-CD1 3.45Å; I282-L294 VanDerWaalsContact CG2-CD1 3.45Å; I282-L294 HydrophobicContact CG2-CG 4.29Å; T286-L294 HydrophobicContact CG2-CD1 3.85Å; A291-L294 CarbonylContact O-C 3.55Å; A291-L294 PolarHBondContact O-N 3.07Å; K292-L294 VanDerWaalsContact C-N 3.3Å; K292-L294 PolarHBondContact O-N 3.25Å; L294-L311 WeakPolarHBondContact O-CA 3.31Å; L294-L312 HydrophobicContact CD2-CB 4.05Å; L294-L312 PolarHBondContact O-N 3.42Å
295	M	89.2	Confident	83.5	Confident	19 Å²	19	75.4 Å²	75.4	9%	0.094	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	106.4	-173.8	-172.8	-169.6	-176.8	0	0	109.8	L278 I282 A291 K292 F297 L309 L311	L278-M295 HydrophobicContact CB-CE 4Å; L278-M295 HydrophobicContact CB-SD 4.01Å; L278-M295 HydrophobicContact CD1-CE 3.46Å; L278-M295 VanDerWaalsContact CD1-CE 3.46Å; L278-M295 HydrophobicContact CD1-SD 4.46Å; L278-M295 HydrophobicContact CG-CE 4.38Å; I282-M295 HydrophobicContact CD1-CB 3.9Å; I282-M295 HydrophobicContact CD1-CG 4.43Å; I282-M295 HydrophobicContact CD1-SD 4.48Å; A291-M295 VanDerWaalsContact O-CB 3.28Å; A291-M295 WeakPolarHBondContact O-CB 3.3Å; A291-M295 PolarHBondContact O-N 3.13Å; K292-M295 VanDerWaalsContact O-O 3.12Å; M295-F297 HydrophobicContact CE-CD2 4.37Å; M295-F297 HydrophobicContact CE-CE1 4.26Å; M295-F297 HydrophobicContact CE-CE2 3.26Å; M295-F297 HydrophobicContact CE-CZ 3.19Å; M295-F297 HydrophobicContact CG-CE2 4.49Å; M295-F297 HydrophobicContact SD-CE2 4.21Å; M295-L309 HydrophobicContact CE-CD1 3.59Å; M295-L309 HydrophobicContact CE-CD2 3.9Å; M295-L309 HydrophobicContact CE-CG 4.43Å; M295-L309 HydrophobicContact CG-CD1 3.55Å; M295-L311 HydrophobicContact CB-CD2 3.89Å; M295-L311 HydrophobicContact CG-CD2 3.7Å
296	Q	88.1	Confident	84	Confident	113 Å²	113	78.1 Å²	78.1	53%	0.528	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	131.2	-176.6	-61.7	-179.2	9.4	0	0	110.8	L309 T310	Q296-L309 WeakPolarHBondContact O-CA 3.34Å; Q296-T310 PolarHBondContact N-O 2.89Å; Q296-T310 PolarHBondContact O-N 3.11Å
297	F	90.4	Very high	84.5	Confident	63 Å²	63	75.7 Å²	75.7	28%	0.276	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	129.6	173.1	-70.5	-82.2	0	0	0	110.3	K275 M295 T308 L309 E330 A334	K275-F297 HydrophobicContact CD-CE2 4.37Å; K275-F297 HydrophobicContact CD-CZ 4.24Å; K275-F297 HydrophobicContact CG-CE2 4.34Å; K275-F297 HydrophobicContact CG-CZ 3.95Å; M295-F297 HydrophobicContact CE-CD2 4.37Å; M295-F297 HydrophobicContact CE-CE1 4.26Å; M295-F297 HydrophobicContact CE-CE2 3.26Å; M295-F297 HydrophobicContact CE-CZ 3.19Å; M295-F297 HydrophobicContact CG-CE2 4.49Å; M295-F297 HydrophobicContact SD-CE2 4.21Å; F297-T308 WeakPolarHBondContact CA-O 3.49Å; F297-L309 HydrophobicContact CD1-CB 3.91Å; F297-L309 HydrophobicContact CD1-CD1 4Å; F297-L309 HydrophobicContact CD1-CG 4.46Å; F297-L309 HydrophobicContact CD2-CD1 4.39Å; F297-L309 HydrophobicContact CE1-CB 3.78Å; F297-L309 HydrophobicContact CE1-CD1 3.76Å; F297-L309 HydrophobicContact CE1-CD2 4.02Å; F297-L309 HydrophobicContact CE1-CG 4.06Å; F297-L309 HydrophobicContact CE2-CD1 4.17Å; F297-L309 HydrophobicContact CG-CD1 4.33Å; F297-L309 HydrophobicContact CZ-CD1 3.86Å; F297-L309 HydrophobicContact CZ-CD2 4.21Å; F297-L309 HydrophobicContact CZ-CG 4.46Å; F297-E330 HydrophobicContact CB-CG 4.32Å; F297-E330 HydrophobicContact CD1-CB 3.85Å; F297-E330 HydrophobicContact CD1-CG 3.74Å; F297-E330 HydrophobicContact CE1-CB 3.81Å; F297-E330 HydrophobicContact CE1-CG 4.24Å; F297-E330 WeakPolarHBondContact CE1-O 3.47Å; F297-E330 HydrophobicContact CG-CG 4.15Å; F297-E330 HydrophobicContact CZ-CB 4.43Å; F297-A334 HydrophobicContact CE1-CB 4.42Å; F297-A334 HydrophobicContact CZ-CB 4.1Å
298	H	90.1	Very high	85.2	Confident	126 Å²	126	74 Å²	74	58%	0.583	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	117.4	168.3	-175.2	74	0	0	0	109	V300 T308	H298-V300 VanDerWaalsContact CD2-CG2 3.48Å; H298-V300 WeakPolarHBondContact CD2-CG2 3.37Å; H298-V300 WeakPolarHBondContact NE2-CG2 3.41Å; H298-T308 PolarHBondContact N-O 3.19Å; H298-T308 PolarHBondContact O-N 3.33Å
299	T	89.5	Confident	85.9	Confident	35 Å²	35	72.3 Å²	72.3	22%	0.215	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.5	-176.4	-57.7	0	0	0	0	110.8	K305 L306 A307 K326 E330	T299-K305 HydrophobicContact CG2-CB 3.84Å; T299-L306 CarbonylContact C-O 3.51Å; T299-L306 VanDerWaalsContact CA-O 3.28Å; T299-L306 WeakPolarHBondContact CA-O 3.35Å; T299-A307 HydrophobicContact CG2-CB 4.26Å; T299-A307 WeakPolarHBondContact OG1-CB 3.48Å; T299-K326 HydrophobicContact CG2-CB 4.3Å; T299-K326 HydrophobicContact CG2-CG 3.97Å; T299-E330 WeakPolarHBondContact OG1-CG 3.36Å; T299-E330 PolarHBondContact OG1-OE1 2.87Å
300	V	88.3	Confident	86.6	Confident	80 Å²	80	69.6 Å²	69.6	49%	0.485	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	152.7	-177.1	-170.7	0	0	0	0	110.4	H298 L306	H298-V300 VanDerWaalsContact CD2-CG2 3.48Å; H298-V300 WeakPolarHBondContact CD2-CG2 3.37Å; H298-V300 WeakPolarHBondContact NE2-CG2 3.41Å; V300-L306 PolarHBondContact N-O 2.95Å; V300-L306 PolarHBondContact O-N 3.25Å
301	G	83.3	Confident	87.1	Confident	38 Å²	38	67 Å²	67	39%	0.392	35%	0.352	S	S	.	.			trans	115.2	158.9	173.4	0	0	0	0	0	114	K305	G301-K305 WeakPolarHBondContact O-CD 3.14Å; G301-K305 WeakPolarHBondContact O-CE 3.13Å; G301-K305 PolarHBondContact O-NZ 2.73Å
302	T	79.3	Confident	87.3	Confident	125 Å²	125	70.5 Å²	70.5	77%	0.767	37%	0.369	S	S	*	.	S	Bend	trans	-102.8	-66.1	-176.9	51.8	0	0	0	0	112	K305	T302-K305 VanDerWaalsContact O-CE 3.22Å; T302-K305 WeakPolarHBondContact O-CE 3.11Å; T302-K305 PolarHBondContact O-NZ 2.75Å
303	K	82.8	Confident	87.5	Confident	187 Å²	187	64.6 Å²	64.6	81%	0.813	34%	0.342	S	S	*	.	S	Bend	trans	-80.4	-41.2	-179.9	-67.5	-176.1	177.6	-180	0	113.4
304	T	86	Confident	87.3	Confident	86 Å²	86	62 Å²	62	53%	0.528	33%	0.331	S	S	.	.	S	Bend	trans	-117.3	124	172.8	-52.5	0	0	0	0	107.1	K322	T304-K322 HydrophobicContact CG2-CB 4.05Å
305	K	87.5	Confident	87.2	Confident	60 Å²	60	63 Å²	63	26%	0.261	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	123.4	179.3	-56.5	-61	-178.8	174	0	108.4	T299 G301 T302 K322 G323 K326 A329	T299-K305 HydrophobicContact CG2-CB 3.84Å; G301-K305 WeakPolarHBondContact O-CD 3.14Å; G301-K305 WeakPolarHBondContact O-CE 3.13Å; G301-K305 PolarHBondContact O-NZ 2.73Å; T302-K305 VanDerWaalsContact O-CE 3.22Å; T302-K305 WeakPolarHBondContact O-CE 3.11Å; T302-K305 PolarHBondContact O-NZ 2.75Å; K305-K322 CarbonylContact O-C 3.58Å; K305-K322 WeakPolarHBondContact O-CA 3.45Å; K305-G323 PolarHBondContact N-O 2.93Å; K305-G323 PolarHBondContact O-N 2.92Å; K305-K326 HydrophobicContact CG-CB 4.5Å; K305-A329 HydrophobicContact CB-CB 4.17Å; K305-A329 VanDerWaalsContact O-CB 3.26Å; K305-A329 WeakPolarHBondContact O-CB 3.29Å
306	L	90.7	Very high	87	Confident	62 Å²	62	67.1 Å²	67.1	33%	0.325	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	112.8	172.4	-171.2	74.4	0	0	0	107.8	M258 T299 V300 V320 K322	M258-L306 HydrophobicContact SD-CD1 4.31Å; T299-L306 CarbonylContact C-O 3.51Å; T299-L306 VanDerWaalsContact CA-O 3.28Å; T299-L306 WeakPolarHBondContact CA-O 3.35Å; V300-L306 PolarHBondContact N-O 2.95Å; V300-L306 PolarHBondContact O-N 3.25Å; L306-V320 HydrophobicContact CD1-CG1 3.6Å; L306-V320 HydrophobicContact CD2-CG1 4.21Å; L306-V320 HydrophobicContact CG-CG1 3.82Å; L306-K322 HydrophobicContact CD1-CB 4.21Å
307	A	90.6	Very high	87.1	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.1	178.1	0	0	0	0	0	110.2	T299 V320 A321 A329 E330	T299-A307 HydrophobicContact CG2-CB 4.26Å; T299-A307 WeakPolarHBondContact OG1-CB 3.48Å; A307-V320 WeakPolarHBondContact O-CA 3.47Å; A307-A321 PolarHBondContact N-O 2.96Å; A307-A321 PolarHBondContact O-N 2.84Å; A307-A329 VanDerWaalsContact CB-C 3.47Å; A307-A329 HydrophobicContact CB-CB 3.6Å; A307-E330 HydrophobicContact CB-CB 4.29Å; A307-E330 HydrophobicContact CB-CG 3.69Å
308	T	92	Very high	87.1	Confident	35 Å²	35	63.1 Å²	63.1	22%	0.215	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	115.9	173.2	-59.1	0	0	0	0	108.3	F297 H298 T318 F319 V320	F297-T308 WeakPolarHBondContact CA-O 3.49Å; H298-T308 PolarHBondContact N-O 3.19Å; H298-T308 PolarHBondContact O-N 3.33Å; T308-T318 HydrophobicContact CG2-CG2 3.33Å; T308-F319 CarbonylContact C-O 3.52Å; T308-F319 WeakPolarHBondContact CA-O 3.33Å; T308-V320 HydrophobicContact CG2-CG2 4Å
309	L	91.5	Very high	87.2	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	116.9	173.6	168.7	58.6	0	0	0	109.2	L278 M295 Q296 F297 L311 T318 F319 A333 A334 A337	L278-L309 HydrophobicContact CD1-CD2 3.9Å; M295-L309 HydrophobicContact CE-CD1 3.59Å; M295-L309 HydrophobicContact CE-CD2 3.9Å; M295-L309 HydrophobicContact CE-CG 4.43Å; M295-L309 HydrophobicContact CG-CD1 3.55Å; Q296-L309 WeakPolarHBondContact O-CA 3.34Å; F297-L309 HydrophobicContact CD1-CB 3.91Å; F297-L309 HydrophobicContact CD1-CD1 4Å; F297-L309 HydrophobicContact CD1-CG 4.46Å; F297-L309 HydrophobicContact CD2-CD1 4.39Å; F297-L309 HydrophobicContact CE1-CB 3.78Å; F297-L309 HydrophobicContact CE1-CD1 3.76Å; F297-L309 HydrophobicContact CE1-CD2 4.02Å; F297-L309 HydrophobicContact CE1-CG 4.06Å; F297-L309 HydrophobicContact CE2-CD1 4.17Å; F297-L309 HydrophobicContact CG-CD1 4.33Å; F297-L309 HydrophobicContact CZ-CD1 3.86Å; F297-L309 HydrophobicContact CZ-CD2 4.21Å; F297-L309 HydrophobicContact CZ-CG 4.46Å; L309-L311 HydrophobicContact CD1-CG 4.3Å; L309-L311 HydrophobicContact CD2-CD1 4.32Å; L309-L311 HydrophobicContact CD2-CG 4.38Å; L309-L311 HydrophobicContact CG-CG 4.21Å; L309-T318 CarbonylContact O-C 3.54Å; L309-T318 VanDerWaalsContact O-CA 3.27Å; L309-T318 WeakPolarHBondContact O-CA 3.25Å; L309-F319 HydrophobicContact CB-CB 4.35Å; L309-F319 PolarHBondContact N-O 2.82Å; L309-F319 PolarHBondContact O-N 2.99Å; L309-A333 HydrophobicContact CB-CB 4Å; L309-A334 HydrophobicContact CD2-CB 4.3Å; L309-A337 HydrophobicContact CD2-CB 3.72Å
310	T	90.8	Very high	87.2	Confident	46 Å²	46	58.6 Å²	58.6	28%	0.282	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	118.6	171.2	-51.3	0	0	0	0	109.2	Q296 L312	Q296-T310 PolarHBondContact N-O 2.89Å; Q296-T310 PolarHBondContact O-N 3.11Å; T310-L312 HydrophobicContact CG2-CD2 4.37Å
311	L	89.1	Confident	87.3	Confident	2 Å²	2	55 Å²	55	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	128.6	173.1	-77.8	171.3	0	0	0	109.1	L278 I282 L294 M295 L309 P316 M317 F319 A337	L278-L311 HydrophobicContact CD2-CD1 4.35Å; I282-L311 HydrophobicContact CD1-CD2 3.62Å; L294-L311 WeakPolarHBondContact O-CA 3.31Å; M295-L311 HydrophobicContact CB-CD2 3.89Å; M295-L311 HydrophobicContact CG-CD2 3.7Å; L309-L311 HydrophobicContact CD1-CG 4.3Å; L309-L311 HydrophobicContact CD2-CD1 4.32Å; L309-L311 HydrophobicContact CD2-CG 4.38Å; L309-L311 HydrophobicContact CG-CG 4.21Å; L311-P316 CarbonylContact O-C 3.58Å; L311-P316 VanDerWaalsContact O-CA 3.25Å; L311-P316 WeakPolarHBondContact O-CA 3.35Å; L311-M317 PolarHBondContact N-O 3.22Å; L311-M317 PolarHBondContact O-N 3.06Å; L311-F319 HydrophobicContact CD1-CD2 4.24Å; L311-F319 HydrophobicContact CD1-CE2 3.85Å; L311-A337 HydrophobicContact CD1-CB 3.52Å
312	L	86	Confident	87.7	Confident	82 Å²	82	58.1 Å²	58.1	43%	0.429	32%	0.317	S	S	.	.			trans	-93.4	-5.3	177.2	-61	178.8	0	0	0	113.1	L294 T310 C315	L294-L312 HydrophobicContact CD2-CB 4.05Å; L294-L312 PolarHBondContact O-N 3.42Å; T310-L312 HydrophobicContact CG2-CD2 4.37Å; L312-C315 CarbonylContact O-C 3.51Å
313	W	85.7	Confident	88.1	Confident	45 Å²	45	52.4 Å²	52.4	17%	0.17	28%	0.282	C	S	.	.	S	Bend	trans	-131	145.8	-178.6	-179.3	92.9	0	0	0	111	V281 I282 A285 T286 L341 L346 Y359	V281-W313 HydrophobicContact CG1-CH2 4.09Å; V281-W313 HydrophobicContact CG1-CZ3 3.64Å; I282-W313 HydrophobicContact CG1-CE3 4.41Å; A285-W313 HydrophobicContact CB-CH2 3.68Å; A285-W313 HydrophobicContact CB-CZ2 3.36Å; A285-W313 HydrophobicContact CB-CZ3 4.39Å; T286-W313 HydrophobicContact CG2-CG 4.07Å; W313-L341 HydrophobicContact CZ3-CD2 4.16Å; W313-L346 HydrophobicContact CH2-CB 4.34Å; W313-L346 HydrophobicContact CH2-CD1 3.8Å; W313-L346 HydrophobicContact CH2-CD2 4.02Å; W313-L346 HydrophobicContact CH2-CG 4.28Å; W313-L346 HydrophobicContact CZ2-CD1 4.49Å; W313-L346 HydrophobicContact CZ2-CD2 4.44Å; W313-L346 HydrophobicContact CZ3-CD1 4.07Å; W313-Y359 AromaticContact CH2-CD1 3.82Å; W313-Y359 HydrophobicContact CH2-CD1 3.82Å; W313-Y359 AromaticContact CH2-CE1 3.85Å; W313-Y359 HydrophobicContact CH2-CE1 3.85Å; W313-Y359 HydrophobicContact CZ2-CD1 4.07Å
314	P	77.2	Confident	88.3	Confident	56 Å²	56	53.6 Å²	53.6	36%	0.364	28%	0.282	S	S	.	.	S	Bend	cis	-65.7	-21.7	-6.3	30.3	-41.5	0	0	0	113.8	M317 L344 L346	P314-M317 HydrophobicContact CG-CE 4.02Å; P314-L344 HydrophobicContact CG-CD1 4.25Å; P314-L346 HydrophobicContact CB-CD1 4.08Å; P314-L346 HydrophobicContact CG-CD1 3.57Å
315	C	82.6	Confident	88.5	Confident	63 Å²	63	58.8 Å²	58.8	43%	0.426	29%	0.292	S	S	.	.	S	Bend	trans	-140.9	162.3	170.2	58	0	0	0	0	108.6	L312 M317	L312-C315 CarbonylContact O-C 3.51Å; C315-M317 PolarHBondContact O-N 3.02Å; C315-M317 VanDerWaalsContact O-N 3.11Å
316	P	84.6	Confident	88.6	Confident	105 Å²	105	61.8 Å²	61.8	68%	0.682	31%	0.305	S	S	*	.			trans	-55.3	116.9	174.4	-26.1	35.7	0	0	0	111.6	L311	L311-P316 CarbonylContact O-C 3.58Å; L311-P316 VanDerWaalsContact O-CA 3.25Å; L311-P316 WeakPolarHBondContact O-CA 3.35Å
317	M	90.6	Very high	88.5	Confident	27 Å²	27	61.5 Å²	61.5	13%	0.133	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	144.4	177.5	-69.1	-178.1	-79.2	0	0	109.7	L311 P314 C315 F319 K340 L341 L344	L311-M317 PolarHBondContact N-O 3.22Å; L311-M317 PolarHBondContact O-N 3.06Å; P314-M317 HydrophobicContact CG-CE 4.02Å; C315-M317 PolarHBondContact O-N 3.02Å; C315-M317 VanDerWaalsContact O-N 3.11Å; M317-F319 HydrophobicContact CB-CE2 3.65Å; M317-F319 HydrophobicContact CB-CZ 4.07Å; M317-F319 HydrophobicContact SD-CE2 4.46Å; M317-F319 HydrophobicContact SD-CZ 4.09Å; M317-K340 HydrophobicContact SD-CG 4.04Å; M317-L341 HydrophobicContact CE-CD2 4.41Å; M317-L344 HydrophobicContact CE-CD1 4.45Å
318	T	90	Very high	88.4	Confident	66 Å²	66	64.5 Å²	64.5	41%	0.405	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	132.9	179.2	-54.9	0	0	0	0	109.9	T308 L309 V320	T308-T318 HydrophobicContact CG2-CG2 3.33Å; L309-T318 CarbonylContact O-C 3.54Å; L309-T318 VanDerWaalsContact O-CA 3.27Å; L309-T318 WeakPolarHBondContact O-CA 3.25Å; T318-V320 HydrophobicContact CG2-CG2 4.42Å
319	F	92.3	Very high	88.4	Confident	29 Å²	29	62.9 Å²	62.9	13%	0.127	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	128.7	179.6	-58.6	-91.3	0	0	0	109	T308 L309 L311 M317 L336 A337 K340	T308-F319 CarbonylContact C-O 3.52Å; T308-F319 WeakPolarHBondContact CA-O 3.33Å; L309-F319 HydrophobicContact CB-CB 4.35Å; L309-F319 PolarHBondContact N-O 2.82Å; L309-F319 PolarHBondContact O-N 2.99Å; L311-F319 HydrophobicContact CD1-CD2 4.24Å; L311-F319 HydrophobicContact CD1-CE2 3.85Å; M317-F319 HydrophobicContact CB-CE2 3.65Å; M317-F319 HydrophobicContact CB-CZ 4.07Å; M317-F319 HydrophobicContact SD-CE2 4.46Å; M317-F319 HydrophobicContact SD-CZ 4.09Å; F319-L336 HydrophobicContact CD1-CB 3.98Å; F319-A337 HydrophobicContact CD1-CB 4.32Å; F319-A337 HydrophobicContact CD2-CB 3.63Å; F319-A337 HydrophobicContact CE1-CB 4.37Å; F319-A337 HydrophobicContact CE2-CB 3.68Å; F319-A337 HydrophobicContact CG-CB 3.96Å; F319-A337 HydrophobicContact CZ-CB 4.06Å; F319-K340 HydrophobicContact CE1-CB 3.68Å; F319-K340 HydrophobicContact CE1-CG 4.1Å; F319-K340 HydrophobicContact CZ-CB 3.7Å; F319-K340 HydrophobicContact CZ-CG 3.88Å
320	V	90.1	Very high	88.4	Confident	36 Å²	36	63.8 Å²	63.8	22%	0.218	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	131.4	-177.8	-175.5	0	0	0	0	109.2	T259 L306 A307 T308 T318	T259-V320 PolarHBondContact OG1-O 3.1Å; L306-V320 HydrophobicContact CD1-CG1 3.6Å; L306-V320 HydrophobicContact CD2-CG1 4.21Å; L306-V320 HydrophobicContact CG-CG1 3.82Å; A307-V320 WeakPolarHBondContact O-CA 3.47Å; T308-V320 HydrophobicContact CG2-CG2 4Å; T318-V320 HydrophobicContact CG2-CG2 4.42Å
321	A	91.3	Very high	88.5	Confident	6 Å²	6	64 Å²	64	5%	0.05	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	151.4	174.2	0	0	0	0	0	112	A307 K332 A333 L336	A307-A321 PolarHBondContact N-O 2.96Å; A307-A321 PolarHBondContact O-N 2.84Å; A321-K332 HydrophobicContact CB-CB 3.58Å; A321-A333 HydrophobicContact CB-CB 3.94Å; A321-L336 HydrophobicContact CB-CD1 4.44Å
322	K	90.2	Very high	88.7	Confident	102 Å²	102	64.4 Å²	64.4	44%	0.443	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	147	176.7	65.9	-177	179.7	-175.5	0	111.5	T304 K305 L306 K332	T304-K322 HydrophobicContact CG2-CB 4.05Å; K305-K322 CarbonylContact O-C 3.58Å; K305-K322 WeakPolarHBondContact O-CA 3.45Å; L306-K322 HydrophobicContact CD1-CB 4.21Å; K322-K332 VanDerWaalsContact O-CD 3.3Å; K322-K332 WeakPolarHBondContact O-CD 3.34Å; K322-K332 PolarHBondContact O-NZ 2.98Å
323	G	88.4	Confident	88.9	Confident	5 Å²	5	60.5 Å²	60.5	5%	0.052	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	163.4	175.9	0	0	0	0	0	111.6	K305 R325	K305-G323 PolarHBondContact N-O 2.93Å; K305-G323 PolarHBondContact O-N 2.92Å; G323-R325 PolarHBondContact O-N 3.35Å
324	R	88.2	Confident	89.2	Confident	213 Å²	213	58.3 Å²	58.3	80%	0.804	29%	0.292	S	S	*	.	S	Bend	trans	-71.2	-27.5	176.6	-61.2	-178.9	-178.6	-174.3	0.8	111.2	E328	R324-E328 WeakPolarHBondContact CB-OE2 3.36Å; R324-E328 PolarHBondContact N-OE2 2.9Å
325	R	89.2	Confident	89.9	Confident	194 Å²	194	55.7 Å²	55.7	73%	0.732	28%	0.275	S	S	*	.	S	Bend	trans	-124.7	154.1	179.3	-58.4	179.3	-172.4	159	1.5	110.5	G323 A327 E328 A329	G323-R325 PolarHBondContact O-N 3.35Å; R325-A327 VanDerWaalsContact C-N 3.31Å; R325-A327 PolarHBondContact O-N 3.06Å; R325-E328 HydrophobicContact CB-CB 4.36Å; R325-E328 WeakPolarHBondContact O-CB 3.33Å; R325-E328 PolarHBondContact O-N 2.82Å; R325-E328 VanDerWaalsContact O-N 3.15Å; R325-A329 PolarHBondContact O-N 2.92Å
326	K	89.4	Confident	90.3	Very high	124 Å²	124	53.3 Å²	53.3	54%	0.539	26%	0.258	S	S	.	.	H	α-helix	trans	-54.6	-47.8	178	172.7	174.7	179.5	-178.5	0	111.2	T299 K305 E328 A329 E330	T299-K326 HydrophobicContact CG2-CB 4.3Å; T299-K326 HydrophobicContact CG2-CG 3.97Å; K305-K326 HydrophobicContact CG-CB 4.5Å; K326-E328 VanDerWaalsContact C-N 3.34Å; K326-E328 PolarHBondContact O-N 2.79Å; K326-A329 PolarHBondContact O-N 3.42Å; K326-E330 WeakPolarHBondContact CE-OE1 3.15Å; K326-E330 HydrophobicContact CG-CG 4.45Å; K326-E330 VanDerWaalsContact CG-OE1 3.3Å; K326-E330 WeakPolarHBondContact CG-OE1 3.29Å; K326-E330 WeakPolarHBondContact O-CB 3.49Å; K326-E330 VanDerWaalsContact O-CG 3.29Å; K326-E330 WeakPolarHBondContact O-CG 3.33Å; K326-E330 PolarHBondContact O-N 3.42Å
327	A	88.6	Confident	90.6	Very high	56 Å²	56	48.3 Å²	48.3	46%	0.463	23%	0.225	S	C	.	.	H	α-helix	trans	-62	-38.7	179.6	0	0	0	0	0	113.2	R325 N331	R325-A327 VanDerWaalsContact C-N 3.31Å; R325-A327 PolarHBondContact O-N 3.06Å; A327-N331 VanDerWaalsContact O-CB 3.28Å; A327-N331 WeakPolarHBondContact O-CB 3.26Å; A327-N331 PolarHBondContact O-N 3.12Å; A327-N331 PolarHBondContact O-ND2 3.29Å
328	E	89.8	Confident	90.6	Very high	63 Å²	63	47 Å²	47	29%	0.294	22%	0.219	S	C	.	.	H	α-helix	trans	-66.8	-48.8	178.3	-172.8	-162.8	158.1	0	0	111.1	R324 R325 K326 E330 N331 K332	R324-E328 WeakPolarHBondContact CB-OE2 3.36Å; R324-E328 PolarHBondContact N-OE2 2.9Å; R325-E328 HydrophobicContact CB-CB 4.36Å; R325-E328 WeakPolarHBondContact O-CB 3.33Å; R325-E328 PolarHBondContact O-N 2.82Å; R325-E328 VanDerWaalsContact O-N 3.15Å; K326-E328 VanDerWaalsContact C-N 3.34Å; K326-E328 PolarHBondContact O-N 2.79Å; E328-E330 VanDerWaalsContact C-N 3.35Å; E328-E330 PolarHBondContact O-N 3.28Å; E328-N331 PolarHBondContact O-N 2.83Å; E328-K332 WeakPolarHBondContact O-CB 3.46Å; E328-K332 WeakPolarHBondContact O-CG 3.44Å; E328-K332 PolarHBondContact O-N 3.31Å; E328-K332 WeakPolarHBondContact OE1-CE 3.27Å; E328-K332 IonicContact OE1-NZ 3.28Å; E328-K332 PolarHBondContact OE1-NZ 2.78Å
329	A	90.6	Very high	90.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.9	-46.2	177.7	0	0	0	0	0	111.4	K305 A307 R325 K326 K332 A333	K305-A329 HydrophobicContact CB-CB 4.17Å; K305-A329 VanDerWaalsContact O-CB 3.26Å; K305-A329 WeakPolarHBondContact O-CB 3.29Å; A307-A329 VanDerWaalsContact CB-C 3.47Å; A307-A329 HydrophobicContact CB-CB 3.6Å; R325-A329 PolarHBondContact O-N 2.92Å; K326-A329 PolarHBondContact O-N 3.42Å; A329-K332 PolarHBondContact O-N 3.16Å; A329-A333 PolarHBondContact O-N 3.19Å
330	E	92.6	Very high	90.4	Very high	20 Å²	20	50.3 Å²	50.3	9%	0.093	23%	0.228	C	C	.	.	H	α-helix	trans	-68.2	-37.3	178.9	-69.2	173	178.3	0	0	112.8	K275 F297 T299 A307 K326 E328 A333 A334	K275-E330 IonicContact NZ-OE2 3.84Å; K275-E330 PolarHBondContact NZ-OE2 3.17Å; F297-E330 HydrophobicContact CB-CG 4.32Å; F297-E330 HydrophobicContact CD1-CB 3.85Å; F297-E330 HydrophobicContact CD1-CG 3.74Å; F297-E330 HydrophobicContact CE1-CB 3.81Å; F297-E330 HydrophobicContact CE1-CG 4.24Å; F297-E330 WeakPolarHBondContact CE1-O 3.47Å; F297-E330 HydrophobicContact CG-CG 4.15Å; F297-E330 HydrophobicContact CZ-CB 4.43Å; T299-E330 WeakPolarHBondContact OG1-CG 3.36Å; T299-E330 PolarHBondContact OG1-OE1 2.87Å; A307-E330 HydrophobicContact CB-CB 4.29Å; A307-E330 HydrophobicContact CB-CG 3.69Å; K326-E330 WeakPolarHBondContact CE-OE1 3.15Å; K326-E330 HydrophobicContact CG-CG 4.45Å; K326-E330 VanDerWaalsContact CG-OE1 3.3Å; K326-E330 WeakPolarHBondContact CG-OE1 3.29Å; K326-E330 WeakPolarHBondContact O-CB 3.49Å; K326-E330 VanDerWaalsContact O-CG 3.29Å; K326-E330 WeakPolarHBondContact O-CG 3.33Å; K326-E330 PolarHBondContact O-N 3.42Å; E328-E330 VanDerWaalsContact C-N 3.35Å; E328-E330 PolarHBondContact O-N 3.28Å; E330-A333 PolarHBondContact O-N 3.26Å; E330-A334 VanDerWaalsContact O-CB 3.26Å; E330-A334 WeakPolarHBondContact O-CB 3.36Å; E330-A334 PolarHBondContact O-N 3.38Å
331	N	92.4	Very high	90.3	Very high	51 Å²	51	48.7 Å²	48.7	27%	0.273	22%	0.218	S	C	.	.	H	α-helix	trans	-67.2	-39.2	175.8	-76.5	-13.3	0	0	0	111.4	L268 P274 K275 A327 E328 A334 A335	L268-N331 HydrophobicContact CD1-CB 3.99Å; P274-N331 HydrophobicContact CG-CB 4.3Å; P274-N331 VanDerWaalsContact CG-O 3.25Å; P274-N331 WeakPolarHBondContact CG-O 3.47Å; K275-N331 WeakPolarHBondContact CD-OD1 3.38Å; K275-N331 WeakPolarHBondContact CE-OD1 3.25Å; A327-N331 VanDerWaalsContact O-CB 3.28Å; A327-N331 WeakPolarHBondContact O-CB 3.26Å; A327-N331 PolarHBondContact O-N 3.12Å; A327-N331 PolarHBondContact O-ND2 3.29Å; E328-N331 PolarHBondContact O-N 2.83Å; N331-A334 PolarHBondContact O-N 3.47Å; N331-A335 WeakPolarHBondContact O-CB 3.39Å; N331-A335 PolarHBondContact O-N 3.29Å
332	K	92	Very high	90.1	Very high	9 Å²	9	51.1 Å²	51.1	4%	0.039	23%	0.227	C	C	.	.	H	α-helix	trans	-61.7	-47.2	173.1	-79.6	-180	178.3	-174.3	0	111.8	D261 A264 L268 A321 K322 E328 A329 A334 A335 L336	D261-K332 IonicContact OD1-NZ 2.66Å; D261-K332 PolarHBondContact OD1-NZ 3.35Å; D261-K332 IonicContact OD2-NZ 3.01Å; A264-K332 HydrophobicContact CB-CB 4.06Å; A264-K332 HydrophobicContact CB-CD 4.22Å; A264-K332 HydrophobicContact CB-CG 4.2Å; L268-K332 HydrophobicContact CD2-CG 4.14Å; A321-K332 HydrophobicContact CB-CB 3.58Å; K322-K332 VanDerWaalsContact O-CD 3.3Å; K322-K332 WeakPolarHBondContact O-CD 3.34Å; K322-K332 PolarHBondContact O-NZ 2.98Å; E328-K332 WeakPolarHBondContact O-CB 3.46Å; E328-K332 WeakPolarHBondContact O-CG 3.44Å; E328-K332 PolarHBondContact O-N 3.31Å; E328-K332 WeakPolarHBondContact OE1-CE 3.27Å; E328-K332 IonicContact OE1-NZ 3.28Å; E328-K332 PolarHBondContact OE1-NZ 2.78Å; A329-K332 PolarHBondContact O-N 3.16Å; K332-A334 VanDerWaalsContact C-N 3.34Å; K332-A334 PolarHBondContact O-N 2.72Å; K332-A335 PolarHBondContact O-N 3.25Å; K332-L336 WeakPolarHBondContact O-CG 3.23Å; K332-L336 PolarHBondContact O-N 2.95Å
333	A	91.6	Very high	89.8	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.6	-42.4	176.4	0	0	0	0	0	111.6	L309 A321 A329 E330 L336 A337	L309-A333 HydrophobicContact CB-CB 4Å; A321-A333 HydrophobicContact CB-CB 3.94Å; A329-A333 PolarHBondContact O-N 3.19Å; E330-A333 PolarHBondContact O-N 3.26Å; A333-L336 PolarHBondContact O-N 2.84Å; A333-A337 PolarHBondContact O-N 3.15Å; A333-A337 VanDerWaalsContact O-N 3.12Å
334	A	92.4	Very high	89.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.9	-39.7	174	0	0	0	0	0	112.6	P274 K275 L278 F297 L309 E330 N331 K332 A337 C338	P274-A334 HydrophobicContact CB-CB 3.79Å; P274-A334 HydrophobicContact CG-CB 3.91Å; K275-A334 HydrophobicContact CG-CB 3.83Å; L278-A334 HydrophobicContact CD1-CB 3.76Å; L278-A334 WeakPolarHBondContact CD1-O 3.4Å; F297-A334 HydrophobicContact CE1-CB 4.42Å; F297-A334 HydrophobicContact CZ-CB 4.1Å; L309-A334 HydrophobicContact CD2-CB 4.3Å; E330-A334 VanDerWaalsContact O-CB 3.26Å; E330-A334 WeakPolarHBondContact O-CB 3.36Å; E330-A334 PolarHBondContact O-N 3.38Å; N331-A334 PolarHBondContact O-N 3.47Å; K332-A334 VanDerWaalsContact C-N 3.34Å; K332-A334 PolarHBondContact O-N 2.72Å; A334-A337 WeakPolarHBondContact O-CB 3.4Å; A334-A337 PolarHBondContact O-N 3.36Å; A334-C338 PolarHBondContact O-N 3.25Å; A334-C338 PolarHBondContact O-SG 2.52Å; A334-C338 VanDerWaalsContact O-SG 3.37Å
335	A	91.2	Very high	89.4	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66.7	-39.1	179.7	0	0	0	0	0	111.9	A267 L268 P274 N331 K332 A337 C338 K339	A267-A335 HydrophobicContact CB-CB 3.86Å; L268-A335 HydrophobicContact CB-CB 4.08Å; L268-A335 HydrophobicContact CD1-CB 4.14Å; P274-A335 HydrophobicContact CB-CB 3.95Å; P274-A335 HydrophobicContact CG-CB 4.09Å; N331-A335 WeakPolarHBondContact O-CB 3.39Å; N331-A335 PolarHBondContact O-N 3.29Å; K332-A335 PolarHBondContact O-N 3.25Å; A335-A337 VanDerWaalsContact C-N 3.29Å; A335-A337 PolarHBondContact O-N 3.29Å; A335-C338 WeakPolarHBondContact O-CB 3.24Å; A335-C338 PolarHBondContact O-N 2.74Å; A335-K339 WeakPolarHBondContact O-CB 3.49Å; A335-K339 PolarHBondContact O-N 3.14Å
336	L	91.8	Very high	89.2	Confident	13 Å²	13	37.1 Å²	37.1	7%	0.068	20%	0.204	C	C	.	.	H	α-helix	trans	-59.9	-41.7	171.5	-69.6	172.8	0	0	0	111.5	T259 A264 A267 F319 A321 K332 A333 K339 K340	T259-L336 HydrophobicContact CG2-CD1 4.4Å; T259-L336 VanDerWaalsContact OG1-CD1 3.23Å; T259-L336 WeakPolarHBondContact OG1-CD1 3.29Å; A264-L336 HydrophobicContact CB-CD1 4.15Å; A264-L336 HydrophobicContact CB-CD2 4.41Å; A264-L336 HydrophobicContact CB-CG 4.28Å; A267-L336 HydrophobicContact CB-CD2 4.07Å; F319-L336 HydrophobicContact CD1-CB 3.98Å; A321-L336 HydrophobicContact CB-CD1 4.44Å; K332-L336 WeakPolarHBondContact O-CG 3.23Å; K332-L336 PolarHBondContact O-N 2.95Å; A333-L336 PolarHBondContact O-N 2.84Å; L336-K339 PolarHBondContact O-N 3.45Å; L336-K340 PolarHBondContact O-N 2.85Å
337	A	90.7	Very high	89	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.9	-45.1	173.3	0	0	0	0	0	112.6	L278 L309 L311 F319 A333 A334 A335 K339 K340 L341	L278-A337 HydrophobicContact CD1-CB 3.79Å; L278-A337 HydrophobicContact CD2-CB 4.11Å; L309-A337 HydrophobicContact CD2-CB 3.72Å; L311-A337 HydrophobicContact CD1-CB 3.52Å; F319-A337 HydrophobicContact CD1-CB 4.32Å; F319-A337 HydrophobicContact CD2-CB 3.63Å; F319-A337 HydrophobicContact CE1-CB 4.37Å; F319-A337 HydrophobicContact CE2-CB 3.68Å; F319-A337 HydrophobicContact CG-CB 3.96Å; F319-A337 HydrophobicContact CZ-CB 4.06Å; A333-A337 PolarHBondContact O-N 3.15Å; A333-A337 VanDerWaalsContact O-N 3.12Å; A334-A337 WeakPolarHBondContact O-CB 3.4Å; A334-A337 PolarHBondContact O-N 3.36Å; A335-A337 VanDerWaalsContact C-N 3.29Å; A335-A337 PolarHBondContact O-N 3.29Å; A337-K339 VanDerWaalsContact C-N 3.31Å; A337-K339 PolarHBondContact O-N 2.9Å; A337-K340 PolarHBondContact O-N 3.36Å; A337-K340 VanDerWaalsContact O-N 3.17Å; A337-L341 WeakPolarHBondContact O-CG 3.48Å; A337-L341 PolarHBondContact O-N 3.38Å
338	C	90	Very high	88.7	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.007	17%	0.17	C	C	.	.	H	α-helix	trans	-57.7	-44.2	174.1	-68.6	0	0	0	0	111.8	F271 P274 L277 L278 A334 A335 K340 L341 K342	F271-C338 HydrophobicContact CB-CB 4.08Å; F271-C338 HydrophobicContact CD1-CB 3.62Å; F271-C338 HydrophobicContact CD2-CB 3.67Å; F271-C338 HydrophobicContact CE1-CB 3.86Å; F271-C338 HydrophobicContact CE2-CB 3.96Å; F271-C338 HydrophobicContact CG-CB 3.5Å; F271-C338 HydrophobicContact CZ-CB 4.03Å; P274-C338 PolarHBondContact O-SG 3.39Å; P274-C338 VanDerWaalsContact O-SG 3.39Å; L277-C338 HydrophobicContact CD2-CB 4.35Å; L278-C338 VanDerWaalsContact CG-SG 3.57Å; A334-C338 PolarHBondContact O-N 3.25Å; A334-C338 PolarHBondContact O-SG 2.52Å; A334-C338 VanDerWaalsContact O-SG 3.37Å; A335-C338 WeakPolarHBondContact O-CB 3.24Å; A335-C338 PolarHBondContact O-N 2.74Å; C338-K340 VanDerWaalsContact C-N 3.32Å; C338-K340 PolarHBondContact O-N 2.64Å; C338-L341 PolarHBondContact O-N 3.09Å; C338-K342 PolarHBondContact O-N 3.12Å
339	K	90.2	Very high	88.2	Confident	81 Å²	81	39 Å²	39	35%	0.352	20%	0.197	S	C	.	.	H	α-helix	trans	-60.7	-42.1	176.7	-174.1	178.2	177.4	-178.7	0	111.3	A267 F271 A335 L336 A337 K342 S343	A267-K339 HydrophobicContact CB-CB 4.33Å; A267-K339 HydrophobicContact CB-CD 4.11Å; F271-K339 HydrophobicContact CE2-CB 3.84Å; A335-K339 WeakPolarHBondContact O-CB 3.49Å; A335-K339 PolarHBondContact O-N 3.14Å; L336-K339 PolarHBondContact O-N 3.45Å; A337-K339 VanDerWaalsContact C-N 3.31Å; A337-K339 PolarHBondContact O-N 2.9Å; K339-K342 PolarHBondContact O-N 3.05Å; K339-S343 PolarHBondContact O-N 2.98Å
340	K	88.2	Confident	87.9	Confident	83 Å²	83	45.2 Å²	45.2	36%	0.361	23%	0.23	S	C	.	.	H	α-helix	trans	-64.5	-45.8	175.1	-173.3	64.4	177	178.7	0	111.3	M317 F319 L336 A337 C338 K342 S343 L344	M317-K340 HydrophobicContact SD-CG 4.04Å; F319-K340 HydrophobicContact CE1-CB 3.68Å; F319-K340 HydrophobicContact CE1-CG 4.1Å; F319-K340 HydrophobicContact CZ-CB 3.7Å; F319-K340 HydrophobicContact CZ-CG 3.88Å; L336-K340 PolarHBondContact O-N 2.85Å; A337-K340 PolarHBondContact O-N 3.36Å; A337-K340 VanDerWaalsContact O-N 3.17Å; C338-K340 VanDerWaalsContact C-N 3.32Å; C338-K340 PolarHBondContact O-N 2.64Å; K340-K342 VanDerWaalsContact C-N 3.34Å; K340-K342 PolarHBondContact O-N 3.12Å; K340-S343 PolarHBondContact O-N 3.44Å; K340-S343 VanDerWaalsContact O-N 3.13Å; K340-S343 PolarHBondContact O-OG 2.88Å; K340-L344 HydrophobicContact CG-CD1 4.41Å; K340-L344 WeakPolarHBondContact O-CG 3.22Å; K340-L344 PolarHBondContact O-N 3.33Å
341	L	87.8	Confident	87.5	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-60.8	-40.7	175.8	-67.1	-177.3	0	0	0	112.3	L278 V281 W313 M317 A337 C338 S343 L344 G345 L346 V347	L278-L341 HydrophobicContact CD2-CD1 3.38Å; L278-L341 HydrophobicContact CD2-CG 4.36Å; V281-L341 HydrophobicContact CG1-CD1 4.05Å; W313-L341 HydrophobicContact CZ3-CD2 4.16Å; M317-L341 HydrophobicContact CE-CD2 4.41Å; A337-L341 WeakPolarHBondContact O-CG 3.48Å; A337-L341 PolarHBondContact O-N 3.38Å; C338-L341 PolarHBondContact O-N 3.09Å; L341-S343 VanDerWaalsContact C-N 3.35Å; L341-S343 PolarHBondContact O-N 2.97Å; L341-L344 CarbonylContact O-C 3.59Å; L341-L344 PolarHBondContact O-N 2.87Å; L341-L344 VanDerWaalsContact O-N 3.16Å; L341-G345 PolarHBondContact O-N 3.48Å; L341-L346 HydrophobicContact CB-CB 4.26Å; L341-L346 HydrophobicContact CD2-CB 4.45Å; L341-L346 HydrophobicContact CD2-CD1 3.81Å; L341-L346 PolarHBondContact O-N 3.21Å; L341-V347 HydrophobicContact CB-CG2 3.89Å
342	K	86.6	Confident	87.1	Confident	56 Å²	56	48.5 Å²	48.5	24%	0.243	25%	0.245	C	C	.	.	H	α-helix	trans	-62.7	-40.2	173.6	-170.7	169.2	-170	169.9	0	112.1	F271 C338 K339 K340 L344 G345 V347 D348 R349 N351	F271-K342 HydrophobicContact CE1-CD 4.31Å; F271-K342 HydrophobicContact CZ-CB 3.95Å; F271-K342 HydrophobicContact CZ-CD 3.78Å; F271-K342 HydrophobicContact CZ-CG 4.49Å; C338-K342 PolarHBondContact O-N 3.12Å; K339-K342 PolarHBondContact O-N 3.05Å; K340-K342 VanDerWaalsContact C-N 3.34Å; K340-K342 PolarHBondContact O-N 3.12Å; K342-L344 PolarHBondContact O-N 3.3Å; K342-G345 PolarHBondContact O-N 3.34Å; K342-V347 HydrophobicContact CB-CB 4.16Å; K342-D348 WeakPolarHBondContact CE-O 3.11Å; K342-R349 PolarHBondContact NZ-O 2.91Å; K342-N351 WeakPolarHBondContact CD-OD1 3.16Å; K342-N351 WeakPolarHBondContact CE-OD1 3.36Å; K342-N351 PolarHBondContact NZ-OD1 2.95Å
343	S	83.9	Confident	86.7	Confident	84 Å²	84	49.1 Å²	49.1	59%	0.587	25%	0.25	S	S	*	.	H	α-helix	trans	-65.8	-27.1	174.8	75.8	0	0	0	0	113.5	K339 K340 L341	K339-S343 PolarHBondContact O-N 2.98Å; K340-S343 PolarHBondContact O-N 3.44Å; K340-S343 VanDerWaalsContact O-N 3.13Å; K340-S343 PolarHBondContact O-OG 2.88Å; L341-S343 VanDerWaalsContact C-N 3.35Å; L341-S343 PolarHBondContact O-N 2.97Å
344	L	84.7	Confident	86.3	Confident	58 Å²	58	50.3 Å²	50.3	30%	0.304	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-0.4	172.6	-65.3	173.6	0	0	0	112.5	P314 M317 K340 L341 K342 L346	P314-L344 HydrophobicContact CG-CD1 4.25Å; M317-L344 HydrophobicContact CE-CD1 4.45Å; K340-L344 HydrophobicContact CG-CD1 4.41Å; K340-L344 WeakPolarHBondContact O-CG 3.22Å; K340-L344 PolarHBondContact O-N 3.33Å; L341-L344 CarbonylContact O-C 3.59Å; L341-L344 PolarHBondContact O-N 2.87Å; L341-L344 VanDerWaalsContact O-N 3.16Å; K342-L344 PolarHBondContact O-N 3.3Å; L344-L346 VanDerWaalsContact C-N 3.28Å; L344-L346 HydrophobicContact CB-CD1 4.08Å; L344-L346 HydrophobicContact CB-CG 4.16Å; L344-L346 HydrophobicContact CD1-CD1 4.3Å; L344-L346 PolarHBondContact O-N 3.34Å
345	G	82.9	Confident	85.8	Confident	46 Å²	46	52.8 Å²	52.8	47%	0.474	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	16.6	-176.9	0	0	0	0	0	114.4	L341 K342 V347 L354	L341-G345 PolarHBondContact O-N 3.48Å; K342-G345 PolarHBondContact O-N 3.34Å; G345-V347 VanDerWaalsContact C-N 3.34Å; G345-L354 WeakPolarHBondContact O-CD1 3.26Å
346	L	85.5	Confident	85.2	Confident	32 Å²	32	53.9 Å²	53.9	17%	0.168	28%	0.277	C	S	.	.			trans	-90.5	2.8	-179.9	-64	172	0	0	0	113.4	W313 P314 L341 L344 Y359	W313-L346 HydrophobicContact CH2-CB 4.34Å; W313-L346 HydrophobicContact CH2-CD1 3.8Å; W313-L346 HydrophobicContact CH2-CD2 4.02Å; W313-L346 HydrophobicContact CH2-CG 4.28Å; W313-L346 HydrophobicContact CZ2-CD1 4.49Å; W313-L346 HydrophobicContact CZ2-CD2 4.44Å; W313-L346 HydrophobicContact CZ3-CD1 4.07Å; P314-L346 HydrophobicContact CB-CD1 4.08Å; P314-L346 HydrophobicContact CG-CD1 3.57Å; L341-L346 HydrophobicContact CB-CB 4.26Å; L341-L346 HydrophobicContact CD2-CB 4.45Å; L341-L346 HydrophobicContact CD2-CD1 3.81Å; L341-L346 PolarHBondContact O-N 3.21Å; L344-L346 VanDerWaalsContact C-N 3.28Å; L344-L346 HydrophobicContact CB-CD1 4.08Å; L344-L346 HydrophobicContact CB-CG 4.16Å; L344-L346 HydrophobicContact CD1-CD1 4.3Å; L344-L346 PolarHBondContact O-N 3.34Å; L346-Y359 HydrophobicContact CB-CE1 4.11Å; L346-Y359 HydrophobicContact CD2-CD1 3.92Å; L346-Y359 HydrophobicContact CD2-CE1 4.11Å; L346-Y359 VanDerWaalsContact O-CE1 3.23Å; L346-Y359 WeakPolarHBondContact O-CE1 3.45Å; L346-Y359 PolarHBondContact O-OH 2.93Å
347	V	84.6	Confident	84.4	Confident	6 Å²	6	53.2 Å²	53.2	4%	0.036	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-134.7	138.3	172.5	178.8	0	0	0	0	105.4	L277 V281 L341 K342 G345 E352	L277-V347 HydrophobicContact CD2-CG1 4.27Å; V281-V347 HydrophobicContact CG2-CG2 4.15Å; L341-V347 HydrophobicContact CB-CG2 3.89Å; K342-V347 HydrophobicContact CB-CB 4.16Å; G345-V347 VanDerWaalsContact C-N 3.34Å; V347-E352 WeakPolarHBondContact CG1-O 3.48Å
348	D	82.5	Confident	83.8	Confident	49 Å²	49	57.2 Å²	57.2	26%	0.262	29%	0.293	S	S	.	.			trans	-69.1	-178.9	-176.4	79.5	3.2	0	0	0	112.9	K342 N350 N351 E352 L354	K342-D348 WeakPolarHBondContact CE-O 3.11Å; D348-N350 PolarHBondContact O-N 3.05Å; D348-N350 VanDerWaalsContact OD1-C 3.25Å; D348-N350 VanDerWaalsContact OD1-CA 3.27Å; D348-N350 WeakPolarHBondContact OD1-CA 3.49Å; D348-N350 WeakPolarHBondContact OD1-CB 3.41Å; D348-N350 PolarHBondContact OD1-N 3.03Å; D348-N351 PolarHBondContact O-N 2.56Å; D348-N351 PolarHBondContact OD1-N 3.44Å; D348-E352 PolarHBondContact N-O 2.87Å; D348-E352 PolarHBondContact OD1-N 3.4Å; D348-L354 HydrophobicContact CB-CD2 3.91Å
349	R	80.9	Confident	83.4	Confident	227 Å²	227	58.7 Å²	58.7	86%	0.857	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-31	178.7	-64.1	-176.8	-177.5	-178.6	2.9	112.4	K342 N351	K342-R349 PolarHBondContact NZ-O 2.91Å; R349-N351 VanDerWaalsContact C-N 3.34Å
350	N	83.3	Confident	82.8	Confident	131 Å²	131	56.7 Å²	56.7	70%	0.701	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	4.5	-177.3	-64.1	-20.5	0	0	0	113.8	D348 E352	D348-N350 PolarHBondContact O-N 3.05Å; D348-N350 VanDerWaalsContact OD1-C 3.25Å; D348-N350 VanDerWaalsContact OD1-CA 3.27Å; D348-N350 WeakPolarHBondContact OD1-CA 3.49Å; D348-N350 WeakPolarHBondContact OD1-CB 3.41Å; D348-N350 PolarHBondContact OD1-N 3.03Å; N350-E352 VanDerWaalsContact C-N 3.32Å
351	N	84.8	Confident	82.2	Confident	39 Å²	39	54.8 Å²	54.8	21%	0.209	29%	0.286	C	S	.	.	S	Bend	trans	68.3	24.4	-174.3	-56.1	-37.2	0	0	0	114.4	Q270 F271 L277 K342 D348 R349	Q270-N351 PolarHBondContact O-ND2 3.46Å; F271-N351 HydrophobicContact CD1-CB 4.02Å; F271-N351 HydrophobicContact CE1-CB 3.84Å; F271-N351 VanDerWaalsContact CE1-CG 3.47Å; F271-N351 WeakPolarHBondContact CE1-OD1 3.42Å; L277-N351 WeakPolarHBondContact CD1-O 3.26Å; L277-N351 WeakPolarHBondContact CD2-O 3.38Å; K342-N351 WeakPolarHBondContact CD-OD1 3.16Å; K342-N351 WeakPolarHBondContact CE-OD1 3.36Å; K342-N351 PolarHBondContact NZ-OD1 2.95Å; D348-N351 PolarHBondContact O-N 2.56Å; D348-N351 PolarHBondContact OD1-N 3.44Å; R349-N351 VanDerWaalsContact C-N 3.34Å
352	E	84.3	Confident	81.6	Confident	102 Å²	102	58.3 Å²	58.3	48%	0.477	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-98.5	155	172.9	-69.6	-64	150.9	0	0	111.7	V347 D348 N350	V347-E352 WeakPolarHBondContact CG1-O 3.48Å; D348-E352 PolarHBondContact N-O 2.87Å; D348-E352 PolarHBondContact OD1-N 3.4Å; N350-E352 VanDerWaalsContact C-N 3.32Å
353	P	83	Confident	81	Confident	22 Å²	22	58.1 Å²	58.1	14%	0.143	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-61.4	140.5	171.9	-16.3	28.6	0	0	0	111.5	L277 K280 V281 I284 Y359	L277-P353 HydrophobicContact CD1-CG 3.92Å; K280-P353 HydrophobicContact CB-CG 3.83Å; K280-P353 HydrophobicContact CD-CG 4.43Å; V281-P353 HydrophobicContact CG2-CB 3.87Å; V281-P353 HydrophobicContact CG2-CG 4.06Å; I284-P353 HydrophobicContact CD1-CB 3.63Å; I284-P353 HydrophobicContact CD1-CG 3.97Å; P353-Y359 WeakPolarHBondContact CA-OH 3.31Å
354	L	84	Confident	80.6	Confident	24 Å²	24	54.1 Å²	54.1	13%	0.126	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-63.7	165	166.2	-55.2	178.3	0	0	0	111.5	I284 G345 D348 M358 Y359	I284-L354 WeakPolarHBondContact CG2-O 3.39Å; G345-L354 WeakPolarHBondContact O-CD1 3.26Å; D348-L354 HydrophobicContact CB-CD2 3.91Å; L354-M358 HydrophobicContact CB-CB 3.94Å; L354-M358 HydrophobicContact CB-SD 4.32Å; L354-M358 HydrophobicContact CD1-CB 4.21Å; L354-M358 HydrophobicContact CD1-CE 4.33Å; L354-M358 HydrophobicContact CD2-CE 3.85Å; L354-M358 HydrophobicContact CD2-SD 4.13Å; L354-Y359 HydrophobicContact CB-CD1 4.42Å; L354-Y359 HydrophobicContact CB-CD2 4.26Å; L354-Y359 HydrophobicContact CB-CE1 3.97Å; L354-Y359 HydrophobicContact CB-CE2 3.82Å; L354-Y359 HydrophobicContact CD1-CD1 4.29Å; L354-Y359 HydrophobicContact CD1-CE1 4.01Å; L354-Y359 HydrophobicContact CG-CE1 4.17Å; L354-Y359 PolarHBondContact N-OH 2.94Å; L354-Y359 WeakPolarHBondContact O-CE2 3.45Å
355	T	80.1	Confident	80.2	Confident	53 Å²	53	57.9 Å²	57.9	33%	0.325	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-68.8	154.7	170.8	63.7	0	0	0	0	111.1	A357 M358 Y359	T355-A357 PolarHBondContact O-N 3.06Å; T355-M358 PolarHBondContact O-N 3.27Å; T355-M358 WeakPolarHBondContact OG1-CG 3.29Å; T355-M358 PolarHBondContact OG1-N 3.42Å; T355-Y359 VanDerWaalsContact O-CD2 3.31Å; T355-Y359 WeakPolarHBondContact O-CD2 2.99Å; T355-Y359 PolarHBondContact O-N 3.09Å
356	H	78.6	Confident	79.8	Confident	22 Å²	22	61.8 Å²	61.8	10%	0.102	31%	0.309	C	S	.	.	H	α-helix	trans	-56.6	-34.4	177.6	177.7	-65.7	0	0	0	112.2	I284 S287 Y359 N360 G1068 F1070	I284-H356 HydrophobicContact CG2-CB 4.06Å; I284-H356 PolarHBondContact O-CD2 2.68Å; S287-H356 PolarHBondContact OG-CD2 2.98Å; S287-H356 PolarHBondContact OG-NE2 3.46Å; H356-Y359 PolarHBondContact O-N 2.62Å; H356-N360 PolarHBondContact CE1-ND2 2.87Å; H356-N360 PolarHBondContact ND1-ND2 3.03Å; H356-N360 PolarHBondContact O-N 3.3Å; H356-N360 PolarHBondContact O-ND2 2.93Å; H356-G1068 CarbonylContact C-O 3.52Å; H356-G1068 PolarHBondContact N-O 3.39Å; H356-F1070 PolarHBondContact CE1-O 2.87Å; H356-F1070 PolarHBondContact ND1-N 3.45Å
357	A	75.6	Confident	79.3	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-62.7	-44.2	175	0	0	0	0	0	111.8	F236 T355 Y359 N360 L361 L364 V1064 G1068 F1070	F236-A357 HydrophobicContact CE1-CB 3.74Å; F236-A357 HydrophobicContact CE2-CB 4.27Å; F236-A357 HydrophobicContact CZ-CB 3.59Å; T355-A357 PolarHBondContact O-N 3.06Å; A357-Y359 PolarHBondContact O-N 3.35Å; A357-N360 CarbonylContact O-C 3.48Å; A357-N360 VanDerWaalsContact O-C 3.27Å; A357-N360 PolarHBondContact O-N 2.85Å; A357-N360 VanDerWaalsContact O-N 3.14Å; A357-L361 PolarHBondContact O-N 3.36Å; A357-L361 VanDerWaalsContact O-N 3.07Å; A357-L364 HydrophobicContact CB-CD1 3.87Å; A357-L364 VanDerWaalsContact O-CD1 3.23Å; A357-L364 WeakPolarHBondContact O-CD1 3.32Å; A357-V1064 HydrophobicContact CB-CG1 3.81Å; A357-V1064 HydrophobicContact CB-CG2 4.42Å; A357-G1068 VanDerWaalsContact CB-O 3.23Å; A357-G1068 WeakPolarHBondContact CB-O 3.38Å; A357-G1068 PolarHBondContact N-O 3.39Å; A357-F1070 HydrophobicContact CB-CB 4.41Å
358	M	79.3	Confident	78.8	Confident	84 Å²	84	61.5 Å²	61.5	41%	0.414	31%	0.308	S	S	.	.	H	α-helix	trans	-65.6	-37.3	177.8	-71.2	-178.3	76	0	0	112.9	L354 T355 N360 L361	L354-M358 HydrophobicContact CB-CB 3.94Å; L354-M358 HydrophobicContact CB-SD 4.32Å; L354-M358 HydrophobicContact CD1-CB 4.21Å; L354-M358 HydrophobicContact CD1-CE 4.33Å; L354-M358 HydrophobicContact CD2-CE 3.85Å; L354-M358 HydrophobicContact CD2-SD 4.13Å; T355-M358 PolarHBondContact O-N 3.27Å; T355-M358 WeakPolarHBondContact OG1-CG 3.29Å; T355-M358 PolarHBondContact OG1-N 3.42Å; M358-N360 PolarHBondContact O-N 3.36Å; M358-L361 VanDerWaalsContact O-CB 3.32Å; M358-L361 WeakPolarHBondContact O-CB 3.44Å; M358-L361 PolarHBondContact O-N 3.01Å
359	Y	80	Confident	78.4	Confident	32 Å²	32	63.9 Å²	63.9	13%	0.125	32%	0.317	C	S	.	.	H	α-helix	trans	-65.3	-29.6	173.1	-68.4	-60.6	0	0	0	113.1	V281 I284 A285 W313 L346 P353 L354 T355 H356 A357	V281-Y359 HydrophobicContact CG1-CE1 4.2Å; V281-Y359 WeakPolarHBondContact CG1-OH 3.22Å; I284-Y359 HydrophobicContact CB-CE2 4.25Å; I284-Y359 HydrophobicContact CG2-CD2 4.04Å; I284-Y359 HydrophobicContact CG2-CE2 3.85Å; A285-Y359 HydrophobicContact CB-CD1 3.89Å; A285-Y359 HydrophobicContact CB-CD2 3.58Å; A285-Y359 HydrophobicContact CB-CE1 4.31Å; A285-Y359 HydrophobicContact CB-CE2 4.01Å; A285-Y359 HydrophobicContact CB-CG 3.5Å; W313-Y359 AromaticContact CH2-CD1 3.82Å; W313-Y359 HydrophobicContact CH2-CD1 3.82Å; W313-Y359 AromaticContact CH2-CE1 3.85Å; W313-Y359 HydrophobicContact CH2-CE1 3.85Å; W313-Y359 HydrophobicContact CZ2-CD1 4.07Å; L346-Y359 HydrophobicContact CB-CE1 4.11Å; L346-Y359 HydrophobicContact CD2-CD1 3.92Å; L346-Y359 HydrophobicContact CD2-CE1 4.11Å; L346-Y359 VanDerWaalsContact O-CE1 3.23Å; L346-Y359 WeakPolarHBondContact O-CE1 3.45Å; L346-Y359 PolarHBondContact O-OH 2.93Å; P353-Y359 WeakPolarHBondContact CA-OH 3.31Å; L354-Y359 HydrophobicContact CB-CD1 4.42Å; L354-Y359 HydrophobicContact CB-CD2 4.26Å; L354-Y359 HydrophobicContact CB-CE1 3.97Å; L354-Y359 HydrophobicContact CB-CE2 3.82Å; L354-Y359 HydrophobicContact CD1-CD1 4.29Å; L354-Y359 HydrophobicContact CD1-CE1 4.01Å; L354-Y359 HydrophobicContact CG-CE1 4.17Å; L354-Y359 PolarHBondContact N-OH 2.94Å; L354-Y359 WeakPolarHBondContact O-CE2 3.45Å; T355-Y359 VanDerWaalsContact O-CD2 3.31Å; T355-Y359 WeakPolarHBondContact O-CD2 2.99Å; T355-Y359 PolarHBondContact O-N 3.09Å; H356-Y359 PolarHBondContact O-N 2.62Å; A357-Y359 PolarHBondContact O-N 3.35Å
360	N	78.5	Confident	78	Confident	39 Å²	39	55.2 Å²	55.2	21%	0.209	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	24.7	179.4	-67.6	-82.9	0	0	0	112.4	H356 A357 M358 A362 S363 L364 F1070	H356-N360 PolarHBondContact CE1-ND2 2.87Å; H356-N360 PolarHBondContact ND1-ND2 3.03Å; H356-N360 PolarHBondContact O-N 3.3Å; H356-N360 PolarHBondContact O-ND2 2.93Å; A357-N360 CarbonylContact O-C 3.48Å; A357-N360 VanDerWaalsContact O-C 3.27Å; A357-N360 PolarHBondContact O-N 2.85Å; A357-N360 VanDerWaalsContact O-N 3.14Å; M358-N360 PolarHBondContact O-N 3.36Å; N360-A362 PolarHBondContact O-N 3.12Å; N360-S363 PolarHBondContact O-N 2.9Å; N360-S363 VanDerWaalsContact O-N 3.12Å; N360-L364 PolarHBondContact O-N 2.98Å; N360-F1070 HydrophobicContact CB-CD1 3.79Å; N360-F1070 HydrophobicContact CB-CE1 4.41Å
361	L	76	Confident	77.5	Confident	43 Å²	43	49.8 Å²	49.8	23%	0.225	26%	0.26	C	S	.	.	H	α-helix	trans	-62.6	-30.3	-174.1	-167.3	139.8	0	0	0	113	A357 M358 L364 R365	A357-L361 PolarHBondContact O-N 3.36Å; A357-L361 VanDerWaalsContact O-N 3.07Å; M358-L361 VanDerWaalsContact O-CB 3.32Å; M358-L361 WeakPolarHBondContact O-CB 3.44Å; M358-L361 PolarHBondContact O-N 3.01Å; L361-L364 PolarHBondContact O-N 2.91Å; L361-R365 WeakPolarHBondContact O-CB 3.3Å; L361-R365 PolarHBondContact O-N 2.93Å
362	A	73.8	Confident	76.9	Confident	76 Å²	76	54.9 Å²	54.9	63%	0.628	28%	0.276	S	S	*	.	H	α-helix	trans	-62.8	-51	172.5	0	0	0	0	0	111.5	N360 L364 R365 E366	N360-A362 PolarHBondContact O-N 3.12Å; A362-L364 VanDerWaalsContact C-N 3.32Å; A362-L364 PolarHBondContact O-N 2.8Å; A362-R365 PolarHBondContact O-N 2.8Å; A362-R365 VanDerWaalsContact O-N 3.15Å; A362-E366 PolarHBondContact O-N 3.23Å
363	S	74.1	Confident	76.6	Confident	52 Å²	52	57.7 Å²	57.7	36%	0.364	28%	0.282	S	S	.	.	H	α-helix	trans	-63.8	-35.9	176.5	-51.1	0	0	0	0	112.4	N360 L367	N360-S363 PolarHBondContact O-N 2.9Å; N360-S363 VanDerWaalsContact O-N 3.12Å; S363-L367 WeakPolarHBondContact O-CB 3.2Å; S363-L367 PolarHBondContact O-N 3.48Å
364	L	75.5	Confident	76.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.5	-44.5	172.2	-77.1	169.1	0	0	0	111.4	V233 F236 L237 A357 N360 L361 A362 L367 G368 V1064 F1070	V233-L364 HydrophobicContact CB-CD2 4.1Å; V233-L364 HydrophobicContact CG1-CB 4.1Å; V233-L364 HydrophobicContact CG1-CD2 3.6Å; V233-L364 HydrophobicContact CG1-CG 4.49Å; V233-L364 WeakPolarHBondContact CG1-O 3.36Å; V233-L364 HydrophobicContact CG2-CD2 3.66Å; F236-L364 HydrophobicContact CD1-CD1 3.89Å; F236-L364 HydrophobicContact CE1-CD1 3.85Å; L237-L364 HydrophobicContact CD2-CB 4.21Å; A357-L364 HydrophobicContact CB-CD1 3.87Å; A357-L364 VanDerWaalsContact O-CD1 3.23Å; A357-L364 WeakPolarHBondContact O-CD1 3.32Å; N360-L364 PolarHBondContact O-N 2.98Å; L361-L364 PolarHBondContact O-N 2.91Å; A362-L364 VanDerWaalsContact C-N 3.32Å; A362-L364 PolarHBondContact O-N 2.8Å; L364-L367 PolarHBondContact O-N 2.73Å; L364-G368 PolarHBondContact O-N 3.16Å; L364-V1064 HydrophobicContact CD1-CG2 4.4Å; L364-V1064 HydrophobicContact CD2-CG2 3.68Å; L364-F1070 HydrophobicContact CD2-CD1 4.43Å; L364-F1070 HydrophobicContact CD2-CD2 3.28Å; L364-F1070 HydrophobicContact CD2-CE1 4.48Å; L364-F1070 HydrophobicContact CD2-CE2 3.35Å; L364-F1070 HydrophobicContact CD2-CG 3.85Å; L364-F1070 HydrophobicContact CD2-CZ 3.97Å; L364-F1070 HydrophobicContact CG-CD1 4.42Å; L364-F1070 HydrophobicContact CG-CD2 4.1Å; L364-F1070 HydrophobicContact CG-CE2 4.2Å; L364-F1070 HydrophobicContact CG-CG 4.19Å; L364-F1070 HydrophobicContact CG-CZ 4.39Å
365	R	76.2	Confident	76.5	Confident	136 Å²	136	58 Å²	58	51%	0.513	29%	0.286	S	S	.	.	H	α-helix	trans	-64.6	-47.2	179.6	-169	-178.8	-65.6	168.1	-2	111.3	L237 L361 A362 L367 G368 E369	L237-R365 HydrophobicContact CD2-CB 4.37Å; L361-R365 WeakPolarHBondContact O-CB 3.3Å; L361-R365 PolarHBondContact O-N 2.93Å; A362-R365 PolarHBondContact O-N 2.8Å; A362-R365 VanDerWaalsContact O-N 3.15Å; R365-L367 PolarHBondContact O-N 3.41Å; R365-G368 PolarHBondContact O-N 2.94Å; R365-E369 WeakPolarHBondContact O-CG 3.49Å; R365-E369 PolarHBondContact O-N 3.39Å
366	E	75.5	Confident	76.6	Confident	129 Å²	129	58.9 Å²	58.9	60%	0.603	29%	0.291	S	S	*	.	H	α-helix	trans	-57.9	-47.7	174.9	-178.7	174.6	-153	0	0	111.6	A362 G368 E369 T370	A362-E366 PolarHBondContact O-N 3.23Å; E366-G368 PolarHBondContact O-N 3.14Å; E366-E369 PolarHBondContact O-N 2.88Å; E366-T370 PolarHBondContact O-N 3.25Å; E366-T370 PolarHBondContact O-OG1 3.08Å; E366-T370 VanDerWaalsContact O-OG1 3.1Å
367	L	74.4	Confident	77	Confident	28 Å²	28	58 Å²	58	15%	0.147	29%	0.288	C	S	.	.	H	α-helix	trans	-63.6	-41.9	177.5	-173	57.9	0	0	0	112.1	V233 S363 L364 R365 E369 T370 Q371 Q1061 F1070	V233-L367 HydrophobicContact CG2-CD2 4.2Å; S363-L367 WeakPolarHBondContact O-CB 3.2Å; S363-L367 PolarHBondContact O-N 3.48Å; L364-L367 PolarHBondContact O-N 2.73Å; R365-L367 PolarHBondContact O-N 3.41Å; L367-E369 VanDerWaalsContact C-N 3.32Å; L367-E369 PolarHBondContact O-N 2.73Å; L367-T370 PolarHBondContact O-N 2.71Å; L367-Q371 VanDerWaalsContact O-CG 3.24Å; L367-Q371 WeakPolarHBondContact O-CG 3.37Å; L367-Q371 PolarHBondContact O-N 3.21Å; L367-Q1061 HydrophobicContact CD1-CB 4.31Å; L367-Q1061 VanDerWaalsContact CD2-O 3.27Å; L367-Q1061 WeakPolarHBondContact CD2-O 3.41Å; L367-Q1061 WeakPolarHBondContact CG-O 3.15Å; L367-F1070 HydrophobicContact CD2-CE2 3.84Å; L367-F1070 HydrophobicContact CD2-CZ 3.69Å
368	G	73.9	Confident	77.3	Confident	3 Å²	3	65 Å²	65	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-64	-34.6	175	0	0	0	0	0	113.2	L364 R365 E366 R372	L364-G368 PolarHBondContact O-N 3.16Å; R365-G368 PolarHBondContact O-N 2.94Å; E366-G368 PolarHBondContact O-N 3.14Å; G368-R372 VanDerWaalsContact O-CG 3.31Å; G368-R372 WeakPolarHBondContact O-CG 3.32Å; G368-R372 PolarHBondContact O-N 3.48Å
369	E	74.6	Confident	77.6	Confident	99 Å²	99	61.8 Å²	61.8	46%	0.463	31%	0.305	S	S	.	.	H	α-helix	trans	-69	-47.9	172.5	-75	172.9	-164.2	0	0	111.2	R365 E366 L367 Q371 R372 R373	R365-E369 WeakPolarHBondContact O-CG 3.49Å; R365-E369 PolarHBondContact O-N 3.39Å; E366-E369 PolarHBondContact O-N 2.88Å; L367-E369 VanDerWaalsContact C-N 3.32Å; L367-E369 PolarHBondContact O-N 2.73Å; E369-Q371 VanDerWaalsContact C-N 3.28Å; E369-Q371 PolarHBondContact O-N 3.46Å; E369-R372 PolarHBondContact O-N 2.77Å; E369-R373 WeakPolarHBondContact O-CG 3.4Å; E369-R373 PolarHBondContact O-N 3.43Å
370	T	72.2	Confident	78	Confident	45 Å²	45	63 Å²	63	28%	0.276	32%	0.317	S	S	.	.	H	α-helix	trans	-59.5	-36.5	177.5	-61.6	0	0	0	0	112.5	E366 L367 R372 R373	E366-T370 PolarHBondContact O-N 3.25Å; E366-T370 PolarHBondContact O-OG1 3.08Å; E366-T370 VanDerWaalsContact O-OG1 3.1Å; L367-T370 PolarHBondContact O-N 2.71Å; T370-R372 VanDerWaalsContact C-N 3.32Å; T370-R372 PolarHBondContact O-N 2.99Å; T370-R373 PolarHBondContact O-N 3.32Å
371	Q	73.6	Confident	78.6	Confident	17 Å²	17	64.3 Å²	64.3	8%	0.079	32%	0.322	C	S	.	.	H	α-helix	trans	-68.5	-28.3	173.9	-72.4	176.2	9	0	0	113.8	L367 E369 R1060 Q1061	L367-Q371 VanDerWaalsContact O-CG 3.24Å; L367-Q371 WeakPolarHBondContact O-CG 3.37Å; L367-Q371 PolarHBondContact O-N 3.21Å; E369-Q371 VanDerWaalsContact C-N 3.28Å; E369-Q371 PolarHBondContact O-N 3.46Å; Q371-R1060 HydrophobicContact CG-CB 4.47Å; Q371-R1060 HydrophobicContact CG-CG 4.46Å; Q371-Q1061 PolarHBondContact NE2-O 2.71Å
372	R	72.7	Confident	79.4	Confident	147 Å²	147	66.3 Å²	66.3	56%	0.555	34%	0.338	S	S	*	.	H	α-helix	trans	-85	-18.3	178.3	-73.2	174.5	178.3	-170.5	0.9	112.8	G368 E369 T370	G368-R372 VanDerWaalsContact O-CG 3.31Å; G368-R372 WeakPolarHBondContact O-CG 3.32Å; G368-R372 PolarHBondContact O-N 3.48Å; E369-R372 PolarHBondContact O-N 2.77Å; T370-R372 VanDerWaalsContact C-N 3.32Å; T370-R372 PolarHBondContact O-N 2.99Å
373	R	77.5	Confident	80.2	Confident	160 Å²	160	63.3 Å²	63.3	60%	0.604	31%	0.311	S	S	*	.	S	Bend	trans	-63.3	136.3	177.7	-74.9	178.7	-171.8	-175.7	3.6	110.2	E369 T370	E369-R373 WeakPolarHBondContact O-CG 3.4Å; E369-R373 PolarHBondContact O-N 3.43Å; T370-R373 PolarHBondContact O-N 3.32Å
374	P	81.3	Confident	81.1	Confident	37 Å²	37	61 Å²	61	24%	0.24	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-56.3	149.6	170.1	-23.9	34.8	0	0	0	111.6	T1146 R1156 E1158	P374-T1146 HydrophobicContact CB-CG2 4.06Å; P374-T1146 HydrophobicContact CG-CG2 3.76Å; P374-R1156 WeakPolarHBondContact CA-O 3.5Å; P374-R1156 HydrophobicContact CB-CB 4.2Å; P374-R1156 HydrophobicContact CG-CB 4.43Å; P374-E1158 HydrophobicContact CB-CB 3.66Å; P374-E1158 HydrophobicContact CG-CB 4.49Å
375	C	82.5	Confident	82	Confident	15 Å²	15	68.6 Å²	68.6	10%	0.101	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	126.6	175.1	-166.3	0	0	0	0	110.6	I377 W1102 R1156 L1157 E1158 F1215	C375-I377 PolarHBondContact O-N 2.79Å; C375-W1102 HydrophobicContact CB-CH2 4.16Å; C375-R1156 PolarHBondContact N-O 2.94Å; C375-L1157 HydrophobicContact CB-CD2 3.96Å; C375-L1157 CarbonylContact O-C 3.54Å; C375-L1157 VanDerWaalsContact O-CA 3.25Å; C375-L1157 WeakPolarHBondContact O-CA 3.32Å; C375-E1158 PolarHBondContact O-N 3.36Å; C375-F1215 WeakPolarHBondContact SG-CD1 3.25Å
376	T	83.6	Confident	83	Confident	72 Å²	72	66.6 Å²	66.6	44%	0.442	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	123.3	-178.6	-50.7	0	0	0	0	111.4	E1158 F1215	T376-E1158 CarbonylContact C-O 3.58Å; T376-E1158 VanDerWaalsContact CA-O 3.23Å; T376-E1158 WeakPolarHBondContact CA-O 3.34Å; T376-F1215 WeakPolarHBondContact O-CE1 3.47Å
377	I	85.3	Confident	83.9	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.021	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-95.5	131.7	172.6	52	161.3	0	0	0	110	C375 L1126 L1157 E1158 T1163 V1164 L1167 F1215	C375-I377 PolarHBondContact O-N 2.79Å; I377-L1126 HydrophobicContact CG2-CD2 4.3Å; I377-L1157 HydrophobicContact CG2-CB 3.73Å; I377-L1157 HydrophobicContact CG2-CD1 3.86Å; I377-L1157 HydrophobicContact CG2-CD2 3.9Å; I377-L1157 HydrophobicContact CG2-CG 4.02Å; I377-E1158 WeakPolarHBondContact CG1-O 3.22Å; I377-E1158 PolarHBondContact N-O 3.11Å; I377-T1163 HydrophobicContact CD1-CG2 4.03Å; I377-V1164 HydrophobicContact CD1-CG2 4.12Å; I377-L1167 HydrophobicContact CD1-CD1 3.5Å; I377-F1215 HydrophobicContact CB-CZ 4.33Å; I377-F1215 HydrophobicContact CG2-CE1 3.79Å; I377-F1215 HydrophobicContact CG2-CZ 3.77Å
378	Q	82	Confident	84.9	Confident	146 Å²	146	63.1 Å²	63.1	68%	0.682	30%	0.301	S	S	*	.			trans	-125.2	115.1	170.8	-68.5	-175.6	-5.5	0	0	108.6
379	V	87	Confident	85.9	Confident	17 Å²	17	65.7 Å²	65.7	10%	0.103	32%	0.322	C	S	.	.			trans	-104.2	129.4	174.9	-177.1	0	0	0	0	108.1	E381 I383 L384 L1126 T1163 L1167 L1207	V379-E381 PolarHBondContact O-N 2.9Å; V379-I383 HydrophobicContact CG1-CB 4.3Å; V379-I383 HydrophobicContact CG1-CG2 4.33Å; V379-L384 HydrophobicContact CB-CD1 4.21Å; V379-L384 HydrophobicContact CB-CD2 3.82Å; V379-L384 HydrophobicContact CB-CG 3.9Å; V379-L384 HydrophobicContact CG1-CD2 3.69Å; V379-L384 HydrophobicContact CG1-CG 3.71Å; V379-L384 HydrophobicContact CG2-CD2 4.44Å; V379-L1126 HydrophobicContact CG2-CD1 4.41Å; V379-T1163 HydrophobicContact CB-CG2 4.28Å; V379-T1163 HydrophobicContact CG2-CG2 3.88Å; V379-L1167 HydrophobicContact CG2-CD1 4.4Å; V379-L1207 HydrophobicContact CB-CD1 4.44Å; V379-L1207 HydrophobicContact CG1-CD1 3.49Å; V379-L1207 VanDerWaalsContact CG1-CD1 3.49Å; V379-L1207 HydrophobicContact CG2-CD1 4.08Å
380	P	89	Confident	87	Confident	58 Å²	58	61.5 Å²	61.5	38%	0.377	30%	0.302	S	S	.	.			trans	-54.7	130.6	175.7	-27	34.8	0	0	0	112.3	P382 I383 L384	P380-P382 VanDerWaalsContact C-N 3.32Å; P380-I383 HydrophobicContact CB-CD1 4.18Å; P380-I383 HydrophobicContact CB-CG1 4.36Å; P380-I383 HydrophobicContact CG-CD1 4.08Å; P380-I383 WeakPolarHBondContact O-CB 3.43Å; P380-I383 PolarHBondContact O-N 3.09Å; P380-L384 PolarHBondContact O-N 2.72Å; P380-L384 VanDerWaalsContact O-N 3.17Å
381	E	90.8	Very high	88	Confident	67 Å²	67	60.3 Å²	60.3	31%	0.313	29%	0.294	S	S	.	.	H	α-helix	trans	-52.9	-37.9	-178.8	-179.1	58.8	-155.7	0	0	114.4	V379 I383 L384 R385 R1162	V379-E381 PolarHBondContact O-N 2.9Å; E381-I383 VanDerWaalsContact C-N 3.26Å; E381-I383 PolarHBondContact O-N 3.14Å; E381-L384 PolarHBondContact O-N 2.8Å; E381-R385 WeakPolarHBondContact O-CG 3.17Å; E381-R385 PolarHBondContact O-N 3.1Å; E381-R385 WeakPolarHBondContact OE1-CG 3.33Å; E381-R385 IonicContact OE1-CZ 3.01Å; E381-R385 IonicContact OE1-NE 2.64Å; E381-R385 PolarHBondContact OE1-NE 3.49Å; E381-R385 IonicContact OE1-NH2 3Å; E381-R1162 VanDerWaalsContact CD-NH1 3.33Å; E381-R1162 IonicContact OE1-CZ 3.95Å; E381-R1162 IonicContact OE1-NH1 3.4Å; E381-R1162 PolarHBondContact OE1-NH1 3.48Å; E381-R1162 VanDerWaalsContact OE1-NH1 3.08Å; E381-R1162 IonicContact OE1-NH2 3.97Å; E381-R1162 PolarHBondContact OE1-NH2 3.47Å; E381-R1162 VanDerWaalsContact OE1-NH2 3.13Å; E381-R1162 IonicContact OE2-CZ 3.36Å; E381-R1162 IonicContact OE2-NH1 3.52Å; E381-R1162 PolarHBondContact OE2-NH1 3.11Å
382	P	91.4	Very high	89	Confident	85 Å²	85	64 Å²	64	55%	0.552	32%	0.322	S	S	*	.	H	α-helix	trans	-58.9	-36.4	175	-25.3	35.4	0	0	0	113.5	P380 K386	P380-P382 VanDerWaalsContact C-N 3.32Å; P382-K386 WeakPolarHBondContact O-CG 3.36Å; P382-K386 PolarHBondContact O-N 2.87Å
383	I	91.9	Very high	89.9	Confident	12 Å²	12	63.2 Å²	63.2	6%	0.062	32%	0.324	C	S	.	.	H	α-helix	trans	-74	-42.8	178.9	-59.2	174.8	0	0	0	109.7	V379 P380 E381 R385 K386 I387 E1206 L1207	V379-I383 HydrophobicContact CG1-CB 4.3Å; V379-I383 HydrophobicContact CG1-CG2 4.33Å; P380-I383 HydrophobicContact CB-CD1 4.18Å; P380-I383 HydrophobicContact CB-CG1 4.36Å; P380-I383 HydrophobicContact CG-CD1 4.08Å; P380-I383 WeakPolarHBondContact O-CB 3.43Å; P380-I383 PolarHBondContact O-N 3.09Å; E381-I383 VanDerWaalsContact C-N 3.26Å; E381-I383 PolarHBondContact O-N 3.14Å; I383-R385 VanDerWaalsContact C-N 3.3Å; I383-R385 PolarHBondContact O-N 2.93Å; I383-K386 WeakPolarHBondContact O-CB 3.31Å; I383-K386 PolarHBondContact O-N 3.22Å; I383-K386 VanDerWaalsContact O-N 3.13Å; I383-I387 HydrophobicContact CG2-CD1 3.99Å; I383-I387 HydrophobicContact CG2-CG1 4.43Å; I383-I387 WeakPolarHBondContact O-CG1 3.13Å; I383-I387 PolarHBondContact O-N 3.25Å; I383-E1206 HydrophobicContact CD1-CG 4Å; I383-E1206 HydrophobicContact CG1-CG 4.16Å; I383-L1207 HydrophobicContact CG2-CB 4.41Å; I383-L1207 HydrophobicContact CG2-CD1 4.11Å
384	L	92.4	Very high	90.5	Very high	3 Å²	3	58 Å²	58	2%	0.016	31%	0.305	C	S	.	.	H	α-helix	trans	-57.2	-42.9	175.7	-71.3	175.8	0	0	0	112.2	V379 P380 E381 I387 E388 T1163 L1166	V379-L384 HydrophobicContact CB-CD1 4.21Å; V379-L384 HydrophobicContact CB-CD2 3.82Å; V379-L384 HydrophobicContact CB-CG 3.9Å; V379-L384 HydrophobicContact CG1-CD2 3.69Å; V379-L384 HydrophobicContact CG1-CG 3.71Å; V379-L384 HydrophobicContact CG2-CD2 4.44Å; P380-L384 PolarHBondContact O-N 2.72Å; P380-L384 VanDerWaalsContact O-N 3.17Å; E381-L384 PolarHBondContact O-N 2.8Å; L384-I387 PolarHBondContact O-N 3.31Å; L384-E388 WeakPolarHBondContact O-CB 3.48Å; L384-E388 PolarHBondContact O-N 3.17Å; L384-T1163 VanDerWaalsContact CD1-OG1 3.32Å; L384-T1163 WeakPolarHBondContact CD1-OG1 3.45Å; L384-T1163 HydrophobicContact CD2-CG2 4.19Å; L384-L1166 HydrophobicContact CB-CD1 4.33Å; L384-L1166 HydrophobicContact CD2-CD1 4.15Å
385	R	95.2	Very high	90.8	Very high	160 Å²	160	60.2 Å²	60.2	60%	0.604	32%	0.319	S	S	*	.	H	α-helix	trans	-64.2	-38.9	176	-69.6	-179.2	-168.4	173.6	1.4	112.8	E381 I383 E388 A389	E381-R385 WeakPolarHBondContact O-CG 3.17Å; E381-R385 PolarHBondContact O-N 3.1Å; E381-R385 WeakPolarHBondContact OE1-CG 3.33Å; E381-R385 IonicContact OE1-CZ 3.01Å; E381-R385 IonicContact OE1-NE 2.64Å; E381-R385 PolarHBondContact OE1-NE 3.49Å; E381-R385 IonicContact OE1-NH2 3Å; I383-R385 VanDerWaalsContact C-N 3.3Å; I383-R385 PolarHBondContact O-N 2.93Å; R385-E388 PolarHBondContact O-N 2.9Å; R385-A389 VanDerWaalsContact O-CB 3.31Å; R385-A389 WeakPolarHBondContact O-CB 3.46Å; R385-A389 PolarHBondContact O-N 3.05Å
386	K	95.5	Very high	90.8	Very high	95 Å²	95	60.8 Å²	60.8	41%	0.413	32%	0.322	S	S	.	.	H	α-helix	trans	-65	-42	175.1	-70.9	172.4	175	179.2	0	111.6	P382 I383 A389 F390 L1203 E1206	P382-K386 WeakPolarHBondContact O-CG 3.36Å; P382-K386 PolarHBondContact O-N 2.87Å; I383-K386 WeakPolarHBondContact O-CB 3.31Å; I383-K386 PolarHBondContact O-N 3.22Å; I383-K386 VanDerWaalsContact O-N 3.13Å; K386-A389 PolarHBondContact O-N 3.43Å; K386-F390 WeakPolarHBondContact O-CB 3.5Å; K386-F390 PolarHBondContact O-N 2.86Å; K386-L1203 HydrophobicContact CB-CD2 3.54Å; K386-L1203 HydrophobicContact CD-CD2 4.07Å; K386-L1203 HydrophobicContact CG-CD2 4.42Å; K386-E1206 IonicContact NZ-OE1 2.7Å; K386-E1206 PolarHBondContact NZ-OE1 2.92Å; K386-E1206 IonicContact NZ-OE2 3.08Å; K386-E1206 PolarHBondContact NZ-OE2 2.97Å
387	I	94.6	Very high	90.2	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-61.9	-47	174.9	-69	169.7	0	0	0	110.4	I383 L384 A389 F390 L391 L1166 F1170 L1203 L1207	I383-I387 HydrophobicContact CG2-CD1 3.99Å; I383-I387 HydrophobicContact CG2-CG1 4.43Å; I383-I387 WeakPolarHBondContact O-CG1 3.13Å; I383-I387 PolarHBondContact O-N 3.25Å; L384-I387 PolarHBondContact O-N 3.31Å; I387-A389 PolarHBondContact O-N 3.35Å; I387-F390 PolarHBondContact O-N 2.94Å; I387-L391 HydrophobicContact CG2-CD1 3.7Å; I387-L391 HydrophobicContact CG2-CG 4.28Å; I387-L391 WeakPolarHBondContact O-CB 3.34Å; I387-L391 VanDerWaalsContact O-CG 3.27Å; I387-L391 WeakPolarHBondContact O-CG 3.14Å; I387-L391 PolarHBondContact O-N 2.88Å; I387-L1166 HydrophobicContact CG2-CB 4.46Å; I387-F1170 HydrophobicContact CG1-CD2 4.19Å; I387-F1170 HydrophobicContact CG1-CE2 4.19Å; I387-F1170 HydrophobicContact CG2-CB 4.11Å; I387-F1170 HydrophobicContact CG2-CD2 3.81Å; I387-F1170 HydrophobicContact CG2-CG 4.2Å; I387-L1203 HydrophobicContact CG1-CD1 4.46Å; I387-L1207 HydrophobicContact CD1-CD2 4.4Å
388	E	95.6	Very high	88.9	Confident	84 Å²	84	65.8 Å²	65.8	39%	0.393	35%	0.354	S	S	.	.	H	α-helix	trans	-61.2	-43.8	177.7	-173.3	165.5	-148.5	0	0	111.8	L384 R385 L391 S392 R1162 L1166	L384-E388 WeakPolarHBondContact O-CB 3.48Å; L384-E388 PolarHBondContact O-N 3.17Å; R385-E388 PolarHBondContact O-N 2.9Å; E388-L391 PolarHBondContact O-N 2.97Å; E388-S392 WeakPolarHBondContact O-CB 3.35Å; E388-S392 PolarHBondContact O-N 3.2Å; E388-R1162 IonicContact OE2-CZ 3.13Å; E388-R1162 IonicContact OE2-NE 2.8Å; E388-R1162 PolarHBondContact OE2-NE 3.34Å; E388-R1162 IonicContact OE2-NH2 2.7Å; E388-R1162 PolarHBondContact OE2-NH2 3.11Å; E388-L1166 HydrophobicContact CB-CD1 4.31Å; E388-L1166 HydrophobicContact CB-CD2 3.92Å; E388-L1166 HydrophobicContact CG-CD2 4.13Å
389	A	96.1	Very high	87.5	Confident	56 Å²	56	62.2 Å²	62.2	46%	0.463	35%	0.345	S	S	.	.	H	α-helix	trans	-61.2	-45.7	174.1	0	0	0	0	0	112	R385 K386 I387 S392 H393	R385-A389 VanDerWaalsContact O-CB 3.31Å; R385-A389 WeakPolarHBondContact O-CB 3.46Å; R385-A389 PolarHBondContact O-N 3.05Å; K386-A389 PolarHBondContact O-N 3.43Å; I387-A389 PolarHBondContact O-N 3.35Å; A389-S392 PolarHBondContact O-N 3.47Å; A389-S392 PolarHBondContact O-OG 3.45Å; A389-H393 PolarHBondContact O-N 2.82Å; A389-H393 VanDerWaalsContact O-N 3.07Å
390	F	96.2	Very high	85.6	Confident	11 Å²	11	68 Å²	68	5%	0.048	37%	0.365	C	S	.	.	H	α-helix	trans	-59.7	-48.1	175.9	175.5	-87.9	0	0	0	111.7	K386 I387 S392 H393 Y394 A1173 E1196 Q1199 L1200 L1203	K386-F390 WeakPolarHBondContact O-CB 3.5Å; K386-F390 PolarHBondContact O-N 2.86Å; I387-F390 PolarHBondContact O-N 2.94Å; F390-S392 VanDerWaalsContact C-N 3.28Å; F390-S392 PolarHBondContact O-N 2.8Å; F390-H393 PolarHBondContact O-N 3.38Å; F390-H393 VanDerWaalsContact O-N 3.1Å; F390-Y394 AromaticContact CD2-CD2 3.77Å; F390-Y394 HydrophobicContact CD2-CD2 3.77Å; F390-Y394 HydrophobicContact CD2-CE2 4.14Å; F390-Y394 HydrophobicContact CE1-CD2 4.35Å; F390-Y394 AromaticContact CE2-CD2 3.44Å; F390-Y394 HydrophobicContact CE2-CD2 3.44Å; F390-Y394 VanDerWaalsContact CE2-CD2 3.44Å; F390-Y394 AromaticContact CE2-CE2 3.8Å; F390-Y394 HydrophobicContact CE2-CE2 3.8Å; F390-Y394 HydrophobicContact CE2-CG 4.41Å; F390-Y394 HydrophobicContact CG-CD2 4.36Å; F390-Y394 AromaticContact CZ-CD2 3.74Å; F390-Y394 HydrophobicContact CZ-CD2 3.74Å; F390-Y394 HydrophobicContact CZ-CE2 4.45Å; F390-Y394 HydrophobicContact CZ-CG 4.31Å; F390-Y394 PolarHBondContact O-N 2.96Å; F390-A1173 HydrophobicContact CE1-CB 4.33Å; F390-E1196 HydrophobicContact CE2-CG 4.41Å; F390-E1196 HydrophobicContact CZ-CG 4.14Å; F390-Q1199 HydrophobicContact CD2-CB 4.07Å; F390-Q1199 HydrophobicContact CE2-CB 3.93Å; F390-L1200 HydrophobicContact CD1-CD1 4.37Å; F390-L1200 HydrophobicContact CE1-CB 4.34Å; F390-L1200 HydrophobicContact CE1-CD1 3.79Å; F390-L1200 HydrophobicContact CE1-CG 4.47Å; F390-L1200 HydrophobicContact CE2-CB 4.1Å; F390-L1200 HydrophobicContact CZ-CB 3.73Å; F390-L1200 HydrophobicContact CZ-CD1 4.07Å; F390-L1200 HydrophobicContact CZ-CD2 4.43Å; F390-L1200 HydrophobicContact CZ-CG 4.29Å; F390-L1203 HydrophobicContact CB-CD1 3.63Å; F390-L1203 HydrophobicContact CD2-CD1 4.21Å; F390-L1203 HydrophobicContact CG-CD1 3.88Å
391	L	94.3	Very high	83.4	Confident	20 Å²	20	69.4 Å²	69.4	11%	0.105	37%	0.369	C	S	.	.	H	α-helix	trans	-66.3	-30.1	179.5	-69.2	170.9	0	0	0	112.5	I387 E388 H393 Y394 P395 V396 L1166 E1169 A1173	I387-L391 HydrophobicContact CG2-CD1 3.7Å; I387-L391 HydrophobicContact CG2-CG 4.28Å; I387-L391 WeakPolarHBondContact O-CB 3.34Å; I387-L391 VanDerWaalsContact O-CG 3.27Å; I387-L391 WeakPolarHBondContact O-CG 3.14Å; I387-L391 PolarHBondContact O-N 2.88Å; E388-L391 PolarHBondContact O-N 2.97Å; L391-H393 VanDerWaalsContact C-N 3.34Å; L391-Y394 CarbonylContact O-C 3.24Å; L391-P395 VanDerWaalsContact O-CA 3.3Å; L391-P395 WeakPolarHBondContact O-CA 3.47Å; L391-V396 HydrophobicContact CD2-CG2 4.01Å; L391-L1166 HydrophobicContact CD1-CD2 4.09Å; L391-E1169 HydrophobicContact CD1-CB 3.72Å; L391-E1169 HydrophobicContact CD2-CB 4.17Å; L391-A1173 HydrophobicContact CD2-CB 4.17Å
392	S	93.7	Very high	80.9	Confident	95 Å²	95	68.7 Å²	68.7	66%	0.664	37%	0.371	S	S	*	.	H	α-helix	trans	-69.5	-32.9	172.6	76.9	0	0	0	0	112.5	E388 A389 F390	E388-S392 WeakPolarHBondContact O-CB 3.35Å; E388-S392 PolarHBondContact O-N 3.2Å; A389-S392 PolarHBondContact O-N 3.47Å; A389-S392 PolarHBondContact O-OG 3.45Å; F390-S392 VanDerWaalsContact C-N 3.28Å; F390-S392 PolarHBondContact O-N 2.8Å
393	H	92.6	Very high	78.6	Confident	130 Å²	130	68.4 Å²	68.4	60%	0.602	37%	0.369	S	S	*	.	H	α-helix	trans	-80.9	-35.1	178.4	-162.9	50.2	0	0	0	112.3	A389 F390 L391 P395	A389-H393 PolarHBondContact O-N 2.82Å; A389-H393 VanDerWaalsContact O-N 3.07Å; F390-H393 PolarHBondContact O-N 3.38Å; F390-H393 VanDerWaalsContact O-N 3.1Å; L391-H393 VanDerWaalsContact C-N 3.34Å; H393-P395 WeakPolarHBondContact O-CD 3.28Å
394	Y	90.6	Very high	76	Confident	52 Å²	52	74.7 Å²	74.7	20%	0.204	40%	0.398	C	S	.	.	S	Bend	trans	-123.3	71.3	-179.9	-59.7	-73.1	0	0	0	111.9	F390 L391 V396 R1176 E1196	F390-Y394 AromaticContact CD2-CD2 3.77Å; F390-Y394 HydrophobicContact CD2-CD2 3.77Å; F390-Y394 HydrophobicContact CD2-CE2 4.14Å; F390-Y394 HydrophobicContact CE1-CD2 4.35Å; F390-Y394 AromaticContact CE2-CD2 3.44Å; F390-Y394 HydrophobicContact CE2-CD2 3.44Å; F390-Y394 VanDerWaalsContact CE2-CD2 3.44Å; F390-Y394 AromaticContact CE2-CE2 3.8Å; F390-Y394 HydrophobicContact CE2-CE2 3.8Å; F390-Y394 HydrophobicContact CE2-CG 4.41Å; F390-Y394 HydrophobicContact CG-CD2 4.36Å; F390-Y394 AromaticContact CZ-CD2 3.74Å; F390-Y394 HydrophobicContact CZ-CD2 3.74Å; F390-Y394 HydrophobicContact CZ-CE2 4.45Å; F390-Y394 HydrophobicContact CZ-CG 4.31Å; F390-Y394 PolarHBondContact O-N 2.96Å; L391-Y394 CarbonylContact O-C 3.24Å; Y394-V396 PolarHBondContact O-N 3.21Å; Y394-R1176 PolarHBondContact O-NH2 2.97Å; Y394-R1176 VanDerWaalsContact O-NH2 3.08Å; Y394-E1196 HydrophobicContact CD1-CG 3.89Å; Y394-E1196 HydrophobicContact CD2-CG 4.15Å; Y394-E1196 HydrophobicContact CE1-CB 4.14Å; Y394-E1196 HydrophobicContact CE1-CG 3.94Å; Y394-E1196 HydrophobicContact CE2-CB 4.48Å; Y394-E1196 HydrophobicContact CE2-CG 4.16Å; Y394-E1196 HydrophobicContact CG-CG 4Å
395	P	86.6	Confident	73.4	Confident	83 Å²	83	79 Å²	79	54%	0.539	42%	0.421	S	S	.	.			trans	-57.7	134.7	-171.3	20.2	-31.8	0	0	0	114.6	L391 H393 D397 R1176	L391-P395 VanDerWaalsContact O-CA 3.3Å; L391-P395 WeakPolarHBondContact O-CA 3.47Å; H393-P395 WeakPolarHBondContact O-CD 3.28Å; P395-D397 PolarHBondContact O-N 3.18Å; P395-R1176 PolarHBondContact O-NH1 3.31Å
396	V	82.1	Confident	70.9	Confident	26 Å²	26	80.8 Å²	80.8	16%	0.158	43%	0.427	C	S	.	.			trans	-55.9	82	161.1	-115.1	0	0	0	0	117.8	L391 Y394 S398 R1172 A1173	L391-V396 HydrophobicContact CD2-CG2 4.01Å; Y394-V396 PolarHBondContact O-N 3.21Å; V396-S398 PolarHBondContact O-N 3.23Å; V396-R1172 HydrophobicContact CB-CB 4.33Å; V396-R1172 HydrophobicContact CG1-CB 4.18Å; V396-A1173 HydrophobicContact CG2-CB 3.86Å
397	D	71.4	Confident	68.2	Low	84 Å²	84	80.9 Å²	80.9	45%	0.449	43%	0.432	S	S	.	.			trans	-65	127.8	174.2	-89.1	-11.7	0	0	0	111.8	P395 S399 W400	P395-D397 PolarHBondContact O-N 3.18Å; D397-S399 PolarHBondContact O-N 3.14Å; D397-W400 HydrophobicContact CB-CG 4.14Å; D397-W400 VanDerWaalsContact CB-NE1 3.33Å; D397-W400 PolarHBondContact OD2-NE1 2.99Å; D397-W400 VanDerWaalsContact OD2-NE1 3.07Å
398	S	58.1	Low	65.4	Low	98 Å²	98	87.4 Å²	87.4	69%	0.685	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-62.9	-28.5	179	-45.8	0	0	0	0	113.6	V396 W400	V396-S398 PolarHBondContact O-N 3.23Å; S398-W400 VanDerWaalsContact C-N 3.33Å; S398-W400 PolarHBondContact O-N 3.38Å
399	S	52.1	Low	62.9	Low	71 Å²	71	87.8 Å²	87.8	50%	0.497	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-79.6	-8.7	-170.8	50.6	0	0	0	0	114.5	D397	D397-S399 PolarHBondContact O-N 3.14Å
400	W	47.3	Very low	60.3	Low	138 Å²	138	92.6 Å²	92.6	52%	0.523	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-84.1	-12.5	-171.4	-71.6	50.4	0	0	0	113.8	D397 S398	D397-W400 HydrophobicContact CB-CG 4.14Å; D397-W400 VanDerWaalsContact CB-NE1 3.33Å; D397-W400 PolarHBondContact OD2-NE1 2.99Å; D397-W400 VanDerWaalsContact OD2-NE1 3.07Å; S398-W400 VanDerWaalsContact C-N 3.33Å; S398-W400 PolarHBondContact O-N 3.38Å
401	I	43.2	Very low	57.6	Low	88 Å²	88	98.3 Å²	98.3	45%	0.451	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-94.8	2.5	-177.2	-46.4	179.4	0	0	0	112.3	P403 R1172	I401-P403 WeakPolarHBondContact O-CD 3.2Å; I401-P403 VanDerWaalsContact O-N 3.1Å; I401-R1172 HydrophobicContact CD1-CB 4.24Å; I401-R1172 HydrophobicContact CD1-CG 3.55Å
402	S	39.1	Very low	55.1	Low	52 Å²	52	101 Å²	101	36%	0.364	54%	0.537	S	S	.	.			trans	-58.5	117	174.1	-65.5	0	0	0	0	110.4	E404 L405	S402-E404 PolarHBondContact O-N 2.99Å; S402-L405 PolarHBondContact O-N 3.43Å; S402-L405 VanDerWaalsContact O-N 3.12Å
403	P	42.3	Very low	52.7	Low	78 Å²	78	99.5 Å²	99.5	51%	0.506	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-56.1	-24.1	177.1	-22.6	33.2	0	0	0	112.6	I401 L405 R406	I401-P403 WeakPolarHBondContact O-CD 3.2Å; I401-P403 VanDerWaalsContact O-N 3.1Å; P403-L405 PolarHBondContact O-N 3.14Å; P403-R406 WeakPolarHBondContact O-CB 3.28Å; P403-R406 VanDerWaalsContact O-CG 3.3Å; P403-R406 WeakPolarHBondContact O-CG 3.34Å; P403-R406 PolarHBondContact O-N 3.23Å
404	E	36.2	Very low	50.4	Low	145 Å²	145	97 Å²	97	68%	0.678	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-70.8	-24.1	-179.7	-61.1	87.7	-171.9	0	0	114.4	S402 R406	S402-E404 PolarHBondContact O-N 2.99Å; E404-R406 PolarHBondContact O-N 3.37Å
405	L	38.5	Very low	48.3	Very low	94 Å²	94	96.7 Å²	96.7	49%	0.492	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-79.1	0.4	177.2	-79	167.6	0	0	0	113.4	S402 P403 L407	S402-L405 PolarHBondContact O-N 3.43Å; S402-L405 VanDerWaalsContact O-N 3.12Å; P403-L405 PolarHBondContact O-N 3.14Å; L405-L407 PolarHBondContact O-N 2.93Å; L405-L407 VanDerWaalsContact O-N 3.1Å
406	R	42.4	Very low	46.2	Very low	197 Å²	197	95.5 Å²	95.5	74%	0.743	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-66.4	-1.7	171.1	-66.8	-179.8	176.7	169.2	0.7	114.1	P403 E404	P403-R406 WeakPolarHBondContact O-CB 3.28Å; P403-R406 VanDerWaalsContact O-CG 3.3Å; P403-R406 WeakPolarHBondContact O-CG 3.34Å; P403-R406 PolarHBondContact O-N 3.23Å; E404-R406 PolarHBondContact O-N 3.37Å
407	L	39	Very low	44.3	Very low	97 Å²	97	103.1 Å²	103.1	51%	0.508	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-113.2	8.7	-170	-73.4	169.4	0	0	0	116	L405 S409	L405-L407 PolarHBondContact O-N 2.93Å; L405-L407 VanDerWaalsContact O-N 3.1Å; L407-S409 PolarHBondContact O-N 2.84Å; L407-S409 VanDerWaalsContact O-N 3.13Å
408	Q	35.7	Very low	43.1	Very low	137 Å²	137	105.3 Å²	105.3	64%	0.64	56%	0.564	S	S	*	*			trans	-75.2	107	169.2	-72.8	-173.7	-2.4	0	0	109.5	D410	Q408-D410 PolarHBondContact O-N 2.89Å
409	S	44.5	Very low	42.7	Very low	91 Å²	91	106.6 Å²	106.6	64%	0.636	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-14.9	-168.9	-21.1	0	0	0	0	113.7	L407	L407-S409 PolarHBondContact O-N 2.84Å; L407-S409 VanDerWaalsContact O-N 3.13Å
410	D	40.2	Very low	43.1	Very low	157 Å²	157	105.6 Å²	105.6	84%	0.84	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-16.1	-162.1	-70	-18.1	0	0	0	115	Q408	Q408-D410 PolarHBondContact O-N 2.89Å
411	D	39.3	Very low	44.4	Very low	132 Å²	132	103.7 Å²	103.7	71%	0.706	58%	0.579	S	S	*	*	S	Bend	trans	-101.6	5.1	179.6	-84.1	-14.4	0	0	0	113.8	L413	D411-L413 PolarHBondContact O-N 3.36Å
412	I	42.8	Very low	46.5	Very low	77 Å²	77	102 Å²	102	40%	0.395	57%	0.571	S	S	.	*	S	Bend	trans	-75.9	121.9	174.1	-52.8	175.4	0	0	0	106.1
413	L	43.9	Very low	48.9	Very low	62 Å²	62	100.9 Å²	100.9	33%	0.325	56%	0.563	S	S	.	*			trans	-41	134.3	166.2	-79	162.5	0	0	0	108.6	D411 L415 R1183	D411-L413 PolarHBondContact O-N 3.36Å; L413-L415 HydrophobicContact CB-CD1 3.46Å; L413-L415 VanDerWaalsContact CB-CD1 3.46Å; L413-L415 HydrophobicContact CD1-CD1 3.55Å; L413-L415 HydrophobicContact CG-CD1 4.11Å; L413-L415 PolarHBondContact O-N 3.39Å; L413-R1183 VanDerWaalsContact CD1-O 3.29Å; L413-R1183 WeakPolarHBondContact CD1-O 3.1Å; L413-R1183 WeakPolarHBondContact CG-O 3.45Å
414	P	42.3	Very low	51.4	Low	79 Å²	79	97.5 Å²	97.5	51%	0.513	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	57.7	168.8	29.6	-31.3	0	0	0	109.6	G416	P414-G416 PolarHBondContact O-N 3.06Å
415	L	48.2	Very low	54.2	Low	45 Å²	45	90.7 Å²	90.7	24%	0.236	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-23.2	161.6	-104.9	87.7	0	0	0	110	L413 F1019	L413-L415 HydrophobicContact CB-CD1 3.46Å; L413-L415 VanDerWaalsContact CB-CD1 3.46Å; L413-L415 HydrophobicContact CD1-CD1 3.55Å; L413-L415 HydrophobicContact CG-CD1 4.11Å; L413-L415 PolarHBondContact O-N 3.39Å; L415-F1019 HydrophobicContact CD1-CD2 4.02Å; L415-F1019 HydrophobicContact CD1-CE2 4Å; L415-F1019 HydrophobicContact CD2-CD2 3.95Å; L415-F1019 HydrophobicContact CD2-CE2 3.94Å; L415-F1019 HydrophobicContact CG-CD2 4.1Å; L415-F1019 HydrophobicContact CG-CE2 3.77Å
416	G	42.3	Very low	57	Low	58 Å²	58	86.2 Å²	86.2	60%	0.598	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	105.1	171.2	0	0	0	0	0	111.8	P414	P414-G416 PolarHBondContact O-N 3.06Å
417	K	42.5	Very low	59.4	Low	185 Å²	185	78.5 Å²	78.5	80%	0.804	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	35.8	162.5	-57.3	-179.6	176.8	175.4	0	117.9	S419	K417-S419 PolarHBondContact O-N 3.22Å; K417-S419 VanDerWaalsContact O-N 3.08Å
418	D	44.6	Very low	61.8	Low	130 Å²	130	76 Å²	76	70%	0.695	46%	0.458	S	S	*	.			trans	-59.2	119.7	146.7	-97.9	-11.1	0	0	0	107.2	G420	D418-G420 PolarHBondContact O-N 3.46Å
419	S	49.8	Very low	64.4	Low	125 Å²	125	76.5 Å²	76.5	87%	0.874	46%	0.458	S	S	*	.			trans	-71.9	58.4	-174.5	-53.2	0	0	0	0	110	K417	K417-S419 PolarHBondContact O-N 3.22Å; K417-S419 VanDerWaalsContact O-N 3.08Å
420	G	60.2	Low	66.6	Low	50 Å²	50	76.3 Å²	76.3	52%	0.515	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-55.3	153.3	167.2	0	0	0	0	0	109.3	D418 L422	D418-G420 PolarHBondContact O-N 3.46Å; G420-L422 PolarHBondContact O-N 2.84Å
421	P	74.8	Confident	69.1	Low	98 Å²	98	70.2 Å²	70.2	64%	0.636	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-54.6	131.3	176.5	24.9	-33.3	0	0	0	108.9	S423 P430	P421-S423 PolarHBondContact O-N 3.15Å; P421-P430 HydrophobicContact CB-CB 4.07Å; P421-P430 HydrophobicContact CG-CB 3.96Å; P421-P430 HydrophobicContact CG-CG 4.4Å
422	L	87.1	Confident	71.5	Confident	54 Å²	54	71 Å²	71	28%	0.283	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-46	143	175.4	-69.8	168.4	0	0	0	109.6	G420 Y431 N576 E580	G420-L422 PolarHBondContact O-N 2.84Å; L422-Y431 WeakPolarHBondContact O-CA 3.24Å; L422-Y431 WeakPolarHBondContact O-CB 3.48Å; L422-Y431 PolarHBondContact O-N 3.33Å; L422-N576 HydrophobicContact CD2-CB 4.43Å; L422-E580 HydrophobicContact CD1-CB 4.26Å; L422-E580 VanDerWaalsContact CD1-OE2 3.31Å; L422-E580 WeakPolarHBondContact CD1-OE2 3.43Å
423	S	91.5	Very high	73.8	Confident	27 Å²	27	71.5 Å²	71.5	19%	0.189	43%	0.429	C	S	.	.	B	Isolated β-bridge	trans	-79.9	135	170.7	-168.1	0	0	0	0	109.4	P421 P425 G428 S575 N576	P421-S423 PolarHBondContact O-N 3.15Å; S423-P425 VanDerWaalsContact O-CD 3.23Å; S423-P425 WeakPolarHBondContact O-CD 3.4Å; S423-G428 VanDerWaalsContact OG-C 3.32Å; S423-G428 WeakPolarHBondContact OG-CA 3.37Å; S423-G428 PolarHBondContact OG-O 3.14Å; S423-S575 WeakPolarHBondContact CB-OG 3.35Å; S423-N576 WeakPolarHBondContact O-CB 3.34Å; S423-N576 PolarHBondContact O-ND2 2.74Å
424	D	94.4	Very high	76.1	Confident	8 Å²	8	70.9 Å²	70.9	4%	0.043	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-63.7	116.5	170.9	178.2	-21.7	0	0	0	108.9	I426 T427 G428 K429 Y431 R557	D424-I426 PolarHBondContact O-N 2.97Å; D424-I426 VanDerWaalsContact O-N 3.1Å; D424-I426 WeakPolarHBondContact OD1-CA 3.37Å; D424-I426 WeakPolarHBondContact OD1-CB 3.38Å; D424-I426 PolarHBondContact OD1-N 3.01Å; D424-T427 WeakPolarHBondContact CB-OG1 3.39Å; D424-T427 VanDerWaalsContact CG-OG1 3.24Å; D424-T427 PolarHBondContact O-N 2.92Å; D424-T427 PolarHBondContact OD1-N 2.94Å; D424-T427 PolarHBondContact OD2-OG1 3.22Å; D424-G428 WeakPolarHBondContact O-CA 3.4Å; D424-G428 PolarHBondContact O-N 3.33Å; D424-K429 WeakPolarHBondContact CB-O 3.5Å; D424-K429 PolarHBondContact N-O 3.44Å; D424-Y431 HydrophobicContact CB-CD2 4.39Å; D424-R557 WeakPolarHBondContact OD2-CD 3.38Å
425	P	95	Very high	78.5	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.006	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-21.3	-177.2	-25.1	37.8	0	0	0	113.4	S423 I516 K572 N576 L579 E580 V582	S423-P425 VanDerWaalsContact O-CD 3.23Å; S423-P425 WeakPolarHBondContact O-CD 3.4Å; P425-I516 HydrophobicContact CB-CD1 3.81Å; P425-K572 WeakPolarHBondContact O-CD 3.46Å; P425-K572 WeakPolarHBondContact O-CE 3.41Å; P425-K572 PolarHBondContact O-NZ 3.3Å; P425-N576 WeakPolarHBondContact CD-ND2 3.32Å; P425-N576 HydrophobicContact CG-CB 4.09Å; P425-N576 WeakPolarHBondContact CG-ND2 3.36Å; P425-L579 HydrophobicContact CB-CD2 4.12Å; P425-L579 HydrophobicContact CG-CD2 4.01Å; P425-E580 WeakPolarHBondContact CD-O 3.49Å; P425-V582 HydrophobicContact CB-CG2 3.62Å; P425-V582 HydrophobicContact CG-CG2 3.78Å
426	I	96	Very high	80.7	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-53.9	175.8	-57.2	-59.2	0	0	0	110.5	D424 N514 I516 P554 P555 A560 L562	D424-I426 PolarHBondContact O-N 2.97Å; D424-I426 VanDerWaalsContact O-N 3.1Å; D424-I426 WeakPolarHBondContact OD1-CA 3.37Å; D424-I426 WeakPolarHBondContact OD1-CB 3.38Å; D424-I426 PolarHBondContact OD1-N 3.01Å; I426-N514 HydrophobicContact CD1-CB 4.29Å; I426-N514 HydrophobicContact CG1-CB 4.13Å; I426-I516 HydrophobicContact CD1-CD1 4.26Å; I426-I516 HydrophobicContact CD1-CG1 3.71Å; I426-P554 VanDerWaalsContact O-CB 3.28Å; I426-P554 WeakPolarHBondContact O-CB 3.41Å; I426-P555 HydrophobicContact CG2-CG 3.91Å; I426-A560 HydrophobicContact CD1-CB 4.45Å; I426-A560 HydrophobicContact CG1-CB 4.36Å; I426-A560 HydrophobicContact CG2-CB 3.81Å; I426-L562 HydrophobicContact CD1-CB 4.08Å; I426-L562 HydrophobicContact CD1-CD2 4.46Å
427	T	93.5	Very high	83.2	Confident	35 Å²	35	76 Å²	76	22%	0.215	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-20	-166.9	67.4	0	0	0	0	114.7	D424 K429 R557	D424-T427 WeakPolarHBondContact CB-OG1 3.39Å; D424-T427 VanDerWaalsContact CG-OG1 3.24Å; D424-T427 PolarHBondContact O-N 2.92Å; D424-T427 PolarHBondContact OD1-N 2.94Å; D424-T427 PolarHBondContact OD2-OG1 3.22Å; T427-K429 PolarHBondContact O-N 2.83Å; T427-K429 PolarHBondContact OG1-N 3.43Å; T427-R557 HydrophobicContact CG2-CB 4.29Å
428	G	89.3	Confident	85.7	Confident	45 Å²	45	70.6 Å²	70.6	46%	0.464	42%	0.422	S	S	.	.	S	Bend	trans	75.2	0.6	-173.5	0	0	0	0	0	114.8	S423 D424	S423-G428 VanDerWaalsContact OG-C 3.32Å; S423-G428 WeakPolarHBondContact OG-CA 3.37Å; S423-G428 PolarHBondContact OG-O 3.14Å; D424-G428 WeakPolarHBondContact O-CA 3.4Å; D424-G428 PolarHBondContact O-N 3.33Å
429	K	90.8	Very high	88.1	Confident	147 Å²	147	66.2 Å²	66.2	64%	0.639	40%	0.398	S	S	*	.	S	Bend	trans	-84.8	167.4	176.7	-64	-179.4	-178.7	178.4	0	110.6	D424 T427 Y431	D424-K429 WeakPolarHBondContact CB-O 3.5Å; D424-K429 PolarHBondContact N-O 3.44Å; T427-K429 PolarHBondContact O-N 2.83Å; T427-K429 PolarHBondContact OG1-N 3.43Å; K429-Y431 PolarHBondContact O-N 3.38Å
430	P	90.8	Very high	90.3	Very high	88 Å²	88	63.5 Å²	63.5	57%	0.571	38%	0.376	S	S	*	.	B	Isolated β-bridge	trans	-51.7	129.2	168.1	-27.2	36.2	0	0	0	111	P421 M432	P421-P430 HydrophobicContact CB-CB 4.07Å; P421-P430 HydrophobicContact CG-CB 3.96Å; P421-P430 HydrophobicContact CG-CG 4.4Å; P430-M432 PolarHBondContact O-N 3.36Å
431	Y	92.2	Very high	92.1	Very high	29 Å²	29	68 Å²	68	11%	0.114	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-71.9	124.1	-179.4	175.1	-99	0	0	0	109.7	L422 D424 K429 P433 R557 E580	L422-Y431 WeakPolarHBondContact O-CA 3.24Å; L422-Y431 WeakPolarHBondContact O-CB 3.48Å; L422-Y431 PolarHBondContact O-N 3.33Å; D424-Y431 HydrophobicContact CB-CD2 4.39Å; K429-Y431 PolarHBondContact O-N 3.38Å; Y431-P433 HydrophobicContact CE1-CG 3.74Å; Y431-R557 VanDerWaalsContact CD2-NH1 3.34Å; Y431-R557 PolarHBondContact OH-NH2 3.47Å; Y431-R557 VanDerWaalsContact OH-NH2 3.14Å; Y431-E580 HydrophobicContact CE1-CB 4.37Å; Y431-E580 VanDerWaalsContact CE1-CD 3.43Å; Y431-E580 HydrophobicContact CE1-CG 3.98Å; Y431-E580 WeakPolarHBondContact CE1-OE1 3.36Å; Y431-E580 WeakPolarHBondContact CE2-O 3.09Å; Y431-E580 PolarHBondContact OH-OE1 3.37Å; Y431-E580 VanDerWaalsContact OH-OE1 3.08Å
432	M	90.6	Very high	93.1	Very high	148 Å²	148	65.7 Å²	65.7	73%	0.729	36%	0.36	S	S	*	.			trans	-125.2	122.2	169.5	-66.1	-175	68.1	0	0	108	P430 R557	P430-M432 PolarHBondContact O-N 3.36Å; M432-R557 PolarHBondContact O-NH1 3.36Å
433	P	90.2	Very high	93.6	Very high	87 Å²	87	63.3 Å²	63.3	57%	0.565	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-54.4	142.5	170.3	-24.1	33.1	0	0	0	111.1	Y431	Y431-P433 HydrophobicContact CE1-CG 3.74Å
434	L	91.7	Very high	93.9	Very high	49 Å²	49	67.5 Å²	67.5	26%	0.257	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-69.1	135.9	172.1	-68.8	170.8	0	0	0	108.8	E438 E439 L442 A511	L434-E438 HydrophobicContact CD2-CB 4.34Å; L434-E439 HydrophobicContact CB-CB 4.43Å; L434-L442 HydrophobicContact CD1-CD1 3.95Å; L434-L442 HydrophobicContact CD2-CD1 3.82Å; L434-A511 HydrophobicContact CD1-CB 4.26Å
435	S	94	Very high	94	Very high	56 Å²	56	69.7 Å²	69.7	39%	0.392	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-68.2	155.2	166.7	62.6	0	0	0	0	110.4	A437 E438 E439	S435-A437 PolarHBondContact O-N 2.94Å; S435-E438 PolarHBondContact N-OE2 3.09Å; S435-E438 PolarHBondContact O-N 3.3Å; S435-E438 WeakPolarHBondContact OG-CB 3.32Å; S435-E438 VanDerWaalsContact OG-CD 3.23Å; S435-E438 WeakPolarHBondContact OG-CG 3.26Å; S435-E438 PolarHBondContact OG-N 3.24Å; S435-E438 PolarHBondContact OG-OE2 2.96Å; S435-E439 PolarHBondContact O-N 3.34Å
436	E	94.1	Very high	94	Very high	161 Å²	161	70 Å²	70	75%	0.752	38%	0.381	S	S	*	.	H	α-helix	trans	-55.3	-41.3	-179.8	-172	175.2	-169.5	0	0	112.1	E438 E439 V440	E436-E438 PolarHBondContact O-N 2.75Å; E436-E439 PolarHBondContact O-N 2.9Å; E436-V440 WeakPolarHBondContact O-CG2 3.41Å; E436-V440 PolarHBondContact O-N 3.08Å
437	A	94.9	Very high	94	Very high	72 Å²	72	71.7 Å²	71.7	60%	0.595	39%	0.39	S	S	*	.	H	α-helix	trans	-64	-39.3	176.5	0	0	0	0	0	112.9	S435 R441	S435-A437 PolarHBondContact O-N 2.94Å; A437-R441 VanDerWaalsContact O-CB 3.25Å; A437-R441 WeakPolarHBondContact O-CB 3.08Å; A437-R441 PolarHBondContact O-N 2.86Å
438	E	93.7	Very high	94.1	Very high	72 Å²	72	74.7 Å²	74.7	34%	0.336	40%	0.402	S	S	.	.	H	α-helix	trans	-70	-38.9	176.1	-68.9	173.8	131.3	0	0	111.7	L434 S435 E436 R441 L442	L434-E438 HydrophobicContact CD2-CB 4.34Å; S435-E438 PolarHBondContact N-OE2 3.09Å; S435-E438 PolarHBondContact O-N 3.3Å; S435-E438 WeakPolarHBondContact OG-CB 3.32Å; S435-E438 VanDerWaalsContact OG-CD 3.23Å; S435-E438 WeakPolarHBondContact OG-CG 3.26Å; S435-E438 PolarHBondContact OG-N 3.24Å; S435-E438 PolarHBondContact OG-OE2 2.96Å; E436-E438 PolarHBondContact O-N 2.75Å; E438-R441 PolarHBondContact O-N 2.59Å; E438-L442 VanDerWaalsContact O-CB 3.27Å; E438-L442 WeakPolarHBondContact O-CB 3.46Å; E438-L442 VanDerWaalsContact O-CG 3.26Å; E438-L442 WeakPolarHBondContact O-CG 3.49Å; E438-L442 PolarHBondContact O-N 3.36Å
439	E	94.7	Very high	94.3	Very high	38 Å²	38	74.5 Å²	74.5	18%	0.178	39%	0.39	C	S	.	.	H	α-helix	trans	-63.4	-46.2	178	-165.8	-163.9	116.6	0	0	111.6	L434 S435 E436 S443 A511 R512	L434-E439 HydrophobicContact CB-CB 4.43Å; S435-E439 PolarHBondContact O-N 3.34Å; E436-E439 PolarHBondContact O-N 2.9Å; E439-S443 VanDerWaalsContact O-CB 3.27Å; E439-S443 WeakPolarHBondContact O-CB 3.36Å; E439-S443 PolarHBondContact O-N 3.22Å; E439-S443 PolarHBondContact O-OG 3.06Å; E439-A511 HydrophobicContact CG-CB 3.8Å; E439-A511 WeakPolarHBondContact O-CB 3.39Å; E439-R512 VanDerWaalsContact CD-NE 3.25Å; E439-R512 HydrophobicContact CG-CG 4.33Å; E439-R512 IonicContact OE1-CZ 2.93Å; E439-R512 IonicContact OE1-NE 3.87Å; E439-R512 PolarHBondContact OE1-NE 3.04Å; E439-R512 IonicContact OE1-NH2 2.91Å; E439-R512 PolarHBondContact OE1-NH2 3Å; E439-R512 IonicContact OE2-CZ 3.71Å; E439-R512 IonicContact OE2-NE 3.8Å; E439-R512 PolarHBondContact OE2-NE 2.95Å; E439-R512 IonicContact OE2-NH2 3.38Å
440	V	96.9	Very high	94.4	Very high	69 Å²	69	69 Å²	69	42%	0.418	37%	0.365	S	S	.	.	H	α-helix	trans	-61.6	-48.5	175.1	171.3	0	0	0	0	110.4	E436 L442 S443 Q444	E436-V440 WeakPolarHBondContact O-CG2 3.41Å; E436-V440 PolarHBondContact O-N 3.08Å; V440-L442 PolarHBondContact O-N 2.83Å; V440-S443 PolarHBondContact O-N 2.76Å; V440-Q444 HydrophobicContact CG1-CG 4.44Å; V440-Q444 WeakPolarHBondContact O-CB 3.41Å; V440-Q444 VanDerWaalsContact O-CG 3.31Å; V440-Q444 WeakPolarHBondContact O-CG 3.37Å; V440-Q444 PolarHBondContact O-N 3Å
441	R	97.1	Very high	94.4	Very high	143 Å²	143	73.3 Å²	73.3	54%	0.54	37%	0.37	S	S	.	.	H	α-helix	trans	-60.7	-46	179.7	-176	-176.3	67.5	-140.3	0.3	112.3	A437 E438 S445	A437-R441 VanDerWaalsContact O-CB 3.25Å; A437-R441 WeakPolarHBondContact O-CB 3.08Å; A437-R441 PolarHBondContact O-N 2.86Å; E438-R441 PolarHBondContact O-N 2.59Å; R441-S445 WeakPolarHBondContact O-CB 3.38Å; R441-S445 PolarHBondContact O-N 3Å
442	L	96	Very high	94.2	Very high	51 Å²	51	80.1 Å²	80.1	27%	0.267	40%	0.396	S	S	.	.	H	α-helix	trans	-65.1	-41.5	177.5	-76.1	171.4	0	0	0	111.1	L434 E438 V440 S445 L446 A511	L434-L442 HydrophobicContact CD1-CD1 3.95Å; L434-L442 HydrophobicContact CD2-CD1 3.82Å; E438-L442 VanDerWaalsContact O-CB 3.27Å; E438-L442 WeakPolarHBondContact O-CB 3.46Å; E438-L442 VanDerWaalsContact O-CG 3.26Å; E438-L442 WeakPolarHBondContact O-CG 3.49Å; E438-L442 PolarHBondContact O-N 3.36Å; V440-L442 PolarHBondContact O-N 2.83Å; L442-S445 PolarHBondContact O-N 3.48Å; L442-L446 VanDerWaalsContact O-CG 3.27Å; L442-L446 WeakPolarHBondContact O-CG 3.35Å; L442-L446 PolarHBondContact O-N 3.19Å; L442-A511 HydrophobicContact CB-CB 3.69Å; L442-A511 HydrophobicContact CD1-CB 4.49Å
443	S	98	Very high	93.7	Very high	3 Å²	3	74.4 Å²	74.4	2%	0.021	37%	0.366	C	S	.	.	H	α-helix	trans	-65.4	-41.1	178.4	-60.3	0	0	0	0	112.2	E439 V440 L446 L447 G508 G510 A511	E439-S443 VanDerWaalsContact O-CB 3.27Å; E439-S443 WeakPolarHBondContact O-CB 3.36Å; E439-S443 PolarHBondContact O-N 3.22Å; E439-S443 PolarHBondContact O-OG 3.06Å; V440-S443 PolarHBondContact O-N 2.76Å; S443-L446 PolarHBondContact O-N 3.28Å; S443-L447 WeakPolarHBondContact O-CB 3.19Å; S443-L447 PolarHBondContact O-N 3.27Å; S443-G508 WeakPolarHBondContact CB-O 3.28Å; S443-G510 PolarHBondContact OG-N 3.14Å; S443-A511 VanDerWaalsContact OG-CB 3.24Å; S443-A511 WeakPolarHBondContact OG-CB 3.46Å; S443-A511 PolarHBondContact OG-N 2.9Å
444	Q	97.3	Very high	92.7	Very high	115 Å²	115	72 Å²	72	54%	0.537	36%	0.357	S	S	.	.	H	α-helix	trans	-62.3	-45.6	172.8	-73.1	172.9	-6.4	0	0	111.6	V440 L446 L447 E448	V440-Q444 HydrophobicContact CG1-CG 4.44Å; V440-Q444 WeakPolarHBondContact O-CB 3.41Å; V440-Q444 VanDerWaalsContact O-CG 3.31Å; V440-Q444 WeakPolarHBondContact O-CG 3.37Å; V440-Q444 PolarHBondContact O-N 3Å; Q444-L446 PolarHBondContact O-N 2.98Å; Q444-L447 WeakPolarHBondContact O-CB 3.19Å; Q444-L447 PolarHBondContact O-N 3Å; Q444-E448 PolarHBondContact O-N 3.04Å
445	S	96.5	Very high	91.5	Very high	55 Å²	55	73.5 Å²	73.5	39%	0.385	37%	0.37	S	S	.	.	H	α-helix	trans	-61.1	-42.5	176.7	179.4	0	0	0	0	112.2	R441 L442 L447 E448 L449	R441-S445 WeakPolarHBondContact O-CB 3.38Å; R441-S445 PolarHBondContact O-N 3Å; L442-S445 PolarHBondContact O-N 3.48Å; S445-L447 VanDerWaalsContact C-N 3.34Å; S445-L447 PolarHBondContact O-N 2.92Å; S445-E448 PolarHBondContact O-N 3.16Å; S445-L449 VanDerWaalsContact O-CG 3.29Å; S445-L449 WeakPolarHBondContact O-CG 3.38Å; S445-L449 PolarHBondContact O-N 3.45Å
446	L	96.4	Very high	89.9	Confident	7 Å²	7	77 Å²	77	4%	0.037	38%	0.383	C	S	.	.	H	α-helix	trans	-62.9	-40.6	175.3	-71.6	167.6	0	0	0	112	L442 S443 Q444 E448 L449 W450 V505 L540 N543	L442-L446 VanDerWaalsContact O-CG 3.27Å; L442-L446 WeakPolarHBondContact O-CG 3.35Å; L442-L446 PolarHBondContact O-N 3.19Å; S443-L446 PolarHBondContact O-N 3.28Å; Q444-L446 PolarHBondContact O-N 2.98Å; L446-E448 VanDerWaalsContact C-N 3.34Å; L446-L449 PolarHBondContact O-N 2.95Å; L446-W450 WeakPolarHBondContact O-CB 3.38Å; L446-W450 PolarHBondContact O-N 2.74Å; L446-V505 HydrophobicContact CB-CG1 4.07Å; L446-V505 HydrophobicContact CB-CG2 3.97Å; L446-V505 HydrophobicContact CD1-CG2 4.35Å; L446-V505 WeakPolarHBondContact O-CG1 3.48Å; L446-L540 HydrophobicContact CD2-CD2 4.17Å; L446-N543 VanDerWaalsContact CD2-ND2 3.32Å; L446-N543 WeakPolarHBondContact CD2-ND2 3.28Å
447	L	95.9	Very high	88.3	Confident	36 Å²	36	73.2 Å²	73.2	19%	0.188	36%	0.362	C	S	.	.	H	α-helix	trans	-63.6	-40.3	176.8	-179.8	60.5	0	0	0	111.5	S443 Q444 S445 W450 R451 V505	S443-L447 WeakPolarHBondContact O-CB 3.19Å; S443-L447 PolarHBondContact O-N 3.27Å; Q444-L447 WeakPolarHBondContact O-CB 3.19Å; Q444-L447 PolarHBondContact O-N 3Å; S445-L447 VanDerWaalsContact C-N 3.34Å; S445-L447 PolarHBondContact O-N 2.92Å; L447-W450 PolarHBondContact O-N 3Å; L447-R451 VanDerWaalsContact O-CG 3.31Å; L447-R451 WeakPolarHBondContact O-CG 3.26Å; L447-R451 PolarHBondContact O-N 3.09Å; L447-V505 HydrophobicContact CB-CG1 4.42Å
448	E	95.1	Very high	86.8	Confident	98 Å²	98	77 Å²	77	46%	0.458	37%	0.367	S	S	.	.	H	α-helix	trans	-63.6	-45.7	172.5	-71.8	178.1	-160.7	0	0	112.3	Q444 S445 L446 W450 R451 R452	Q444-E448 PolarHBondContact O-N 3.04Å; S445-E448 PolarHBondContact O-N 3.16Å; L446-E448 VanDerWaalsContact C-N 3.34Å; E448-W450 VanDerWaalsContact C-N 3.29Å; E448-W450 PolarHBondContact O-N 3.33Å; E448-R451 PolarHBondContact O-N 3.43Å; E448-R452 WeakPolarHBondContact O-CG 3.3Å; E448-R452 PolarHBondContact O-N 2.99Å; E448-R452 IonicContact OE2-NH2 3.33Å
449	L	93.7	Very high	85.3	Confident	41 Å²	41	80.9 Å²	80.9	22%	0.215	39%	0.385	C	S	.	.	H	α-helix	trans	-62.1	-38.1	177.1	-70.1	173.6	0	0	0	111.7	S445 L446 R452 R453 S539 L540	S445-L449 VanDerWaalsContact O-CG 3.29Å; S445-L449 WeakPolarHBondContact O-CG 3.38Å; S445-L449 PolarHBondContact O-N 3.45Å; L446-L449 PolarHBondContact O-N 2.95Å; L449-R452 PolarHBondContact O-N 3.19Å; L449-R453 PolarHBondContact O-N 3.02Å; L449-S539 WeakPolarHBondContact O-CB 3.05Å; L449-L540 HydrophobicContact CB-CD2 3.88Å; L449-L540 HydrophobicContact CB-CG 4.23Å; L449-L540 HydrophobicContact CD1-CD2 4.41Å
450	W	92	Very high	84.1	Confident	32 Å²	32	80.9 Å²	80.9	12%	0.121	39%	0.391	C	S	.	.	H	α-helix	trans	-63.8	-46.3	174.4	-170.1	-89.2	0	0	0	111.7	L446 L447 E448 R452 R453 E502 V505 L536 L540	L446-W450 WeakPolarHBondContact O-CB 3.38Å; L446-W450 PolarHBondContact O-N 2.74Å; L447-W450 PolarHBondContact O-N 3Å; E448-W450 VanDerWaalsContact C-N 3.29Å; E448-W450 PolarHBondContact O-N 3.33Å; W450-R452 VanDerWaalsContact C-N 3.3Å; W450-R452 PolarHBondContact O-N 2.9Å; W450-R453 WeakPolarHBondContact O-CB 3.37Å; W450-R453 PolarHBondContact O-N 3.4Å; W450-R453 VanDerWaalsContact O-N 3.08Å; W450-E502 HydrophobicContact CH2-CB 3.42Å; W450-E502 VanDerWaalsContact CH2-CB 3.42Å; W450-E502 HydrophobicContact CH2-CG 3.77Å; W450-E502 HydrophobicContact CZ2-CB 3.58Å; W450-E502 HydrophobicContact CZ2-CG 3.32Å; W450-E502 HydrophobicContact CZ3-CB 4.09Å; W450-V505 HydrophobicContact CB-CG1 3.66Å; W450-V505 HydrophobicContact CD2-CG1 4.42Å; W450-V505 HydrophobicContact CE3-CG1 4.49Å; W450-V505 HydrophobicContact CG-CG1 4.06Å; W450-L536 HydrophobicContact CZ3-CD2 4.09Å; W450-L540 HydrophobicContact CB-CD1 4.43Å; W450-L540 HydrophobicContact CD2-CD1 4.24Å; W450-L540 HydrophobicContact CE3-CD1 3.36Å; W450-L540 HydrophobicContact CZ3-CD1 3.89Å
451	R	91	Very high	83	Confident	178 Å²	178	82.6 Å²	82.6	67%	0.672	40%	0.404	S	S	*	.	H	α-helix	trans	-61.4	-36.8	176.1	-72.2	171.3	-179.1	174.5	0.3	112.5	L447 E448 R453	L447-R451 VanDerWaalsContact O-CG 3.31Å; L447-R451 WeakPolarHBondContact O-CG 3.26Å; L447-R451 PolarHBondContact O-N 3.09Å; E448-R451 PolarHBondContact O-N 3.43Å; R451-R453 PolarHBondContact O-N 3.14Å
452	R	88.8	Confident	82.3	Confident	171 Å²	171	82.9 Å²	82.9	65%	0.645	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-13.9	176.1	-70.7	176.8	-166.8	-168	7.2	114.1	E448 L449 W450 G454	E448-R452 WeakPolarHBondContact O-CG 3.3Å; E448-R452 PolarHBondContact O-N 2.99Å; E448-R452 IonicContact OE2-NH2 3.33Å; L449-R452 PolarHBondContact O-N 3.19Å; W450-R452 VanDerWaalsContact C-N 3.3Å; W450-R452 PolarHBondContact O-N 2.9Å; R452-G454 PolarHBondContact O-N 3.33Å
453	R	79.7	Confident	81.8	Confident	28 Å²	28	82.5 Å²	82.5	11%	0.106	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-28.5	178.2	-167.3	-178.8	-180	-157.6	2.6	112.1	L449 W450 R451 W457 E535 L536	L449-R453 PolarHBondContact O-N 3.02Å; W450-R453 WeakPolarHBondContact O-CB 3.37Å; W450-R453 PolarHBondContact O-N 3.4Å; W450-R453 VanDerWaalsContact O-N 3.08Å; R451-R453 PolarHBondContact O-N 3.14Å; R453-W457 VanDerWaalsContact CZ-CD1 3.46Å; R453-W457 VanDerWaalsContact CZ-CG 3.43Å; R453-E535 PolarHBondContact NH2-O 3.36Å; R453-L536 PolarHBondContact NE-O 2.89Å
454	G	69.1	Low	81.3	Confident	37 Å²	37	83.6 Å²	83.6	38%	0.381	42%	0.417	S	S	.	.			trans	70.2	179.6	175.1	0	0	0	0	0	114.7	R452 I456	R452-G454 PolarHBondContact O-N 3.33Å; G454-I456 VanDerWaalsContact C-N 3.27Å; G454-I456 PolarHBondContact O-N 2.82Å
455	P	66	Low	80.9	Confident	81 Å²	81	78.1 Å²	78.1	53%	0.526	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-74.2	-10	-176.1	28.7	-33.7	0	0	0	114.3	W457 Q458 E459	P455-W457 PolarHBondContact O-N 3.36Å; P455-Q458 WeakPolarHBondContact O-CA 3.42Å; P455-Q458 VanDerWaalsContact O-CB 3.26Å; P455-Q458 WeakPolarHBondContact O-CB 3.42Å; P455-Q458 PolarHBondContact O-N 2.98Å; P455-E459 PolarHBondContact O-N 2.84Å
456	I	60.4	Low	80.7	Confident	128 Å²	128	77 Å²	77	66%	0.656	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-54.4	-29.8	-179.1	-61.2	169.2	0	0	0	112.2	G454 E459	G454-I456 VanDerWaalsContact C-N 3.27Å; G454-I456 PolarHBondContact O-N 2.82Å; I456-E459 PolarHBondContact O-N 2.78Å
457	W	61.4	Low	80.4	Confident	82 Å²	82	80.7 Å²	80.7	31%	0.311	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-74.1	-31.2	173.6	167.4	75	0	0	0	113.5	R453 P455 E459 A460	R453-W457 VanDerWaalsContact CZ-CD1 3.46Å; R453-W457 VanDerWaalsContact CZ-CG 3.43Å; P455-W457 PolarHBondContact O-N 3.36Å; W457-E459 PolarHBondContact O-N 2.8Å; W457-A460 WeakPolarHBondContact O-CB 3.32Å; W457-A460 PolarHBondContact O-N 3.11Å
458	Q	62.5	Low	80.3	Confident	153 Å²	153	81.4 Å²	81.4	72%	0.715	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-21.5	174.3	-61.4	176.9	-15.2	0	0	111.7	P455 A460	P455-Q458 WeakPolarHBondContact O-CA 3.42Å; P455-Q458 VanDerWaalsContact O-CB 3.26Å; P455-Q458 WeakPolarHBondContact O-CB 3.42Å; P455-Q458 PolarHBondContact O-N 2.98Å; Q458-A460 VanDerWaalsContact C-N 3.31Å
459	E	63.7	Low	80.2	Confident	153 Å²	153	79.6 Å²	79.6	72%	0.715	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-8.9	172.5	-61.3	175.3	-175.4	0	0	113.2	P455 I456 W457	P455-E459 PolarHBondContact O-N 2.84Å; I456-E459 PolarHBondContact O-N 2.78Å; W457-E459 PolarHBondContact O-N 2.8Å
460	A	68.9	Low	80.3	Confident	37 Å²	37	82.3 Å²	82.3	31%	0.306	41%	0.411	S	S	.	.	S	Bend	trans	-66	141.3	178.1	0	0	0	0	0	110.4	W457 Q458 Q462	W457-A460 WeakPolarHBondContact O-CB 3.32Å; W457-A460 PolarHBondContact O-N 3.11Å; Q458-A460 VanDerWaalsContact C-N 3.31Å; A460-Q462 PolarHBondContact O-N 3.46Å
461	P	74.2	Confident	80.5	Confident	106 Å²	106	84.8 Å²	84.8	69%	0.688	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-54.5	128.9	175.8	-22.2	30.6	0	0	0	110.7	L463 R495	P461-L463 PolarHBondContact O-N 3.27Å; P461-R495 PolarHBondContact O-NH2 3.47Å
462	Q	81.7	Confident	80.8	Confident	148 Å²	148	76.3 Å²	76.3	69%	0.692	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-63.5	124.7	176.1	-167.8	175.7	19.1	0	0	109.2	A460 D466	A460-Q462 PolarHBondContact O-N 3.46Å; Q462-D466 HydrophobicContact CG-CB 3.93Å
463	L	85.2	Confident	81.2	Confident	44 Å²	44	68.4 Å²	68.4	23%	0.23	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-92.9	155.4	175	-65.6	-178.1	0	0	0	110.1	P461 V465 D466 P467 R495	P461-L463 PolarHBondContact O-N 3.27Å; L463-V465 HydrophobicContact CB-CG1 4.38Å; L463-V465 PolarHBondContact O-N 2.94Å; L463-D466 PolarHBondContact N-OD2 3.34Å; L463-D466 WeakPolarHBondContact O-CB 3.48Å; L463-D466 PolarHBondContact O-N 2.75Å; L463-P467 WeakPolarHBondContact O-CD 3.01Å; L463-R495 HydrophobicContact CD1-CG 3.88Å
464	P	86.9	Confident	82.1	Confident	26 Å²	26	69.1 Å²	69.1	17%	0.169	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-22.2	-175.9	-24.6	32	0	0	0	115.4	P467 H468 C490 P641 F643	P464-P467 WeakPolarHBondContact O-CD 3.3Å; P464-H468 PolarHBondContact O-CD2 2.77Å; P464-C490 HydrophobicContact CB-CB 3.97Å; P464-C490 HydrophobicContact CG-CB 4.17Å; P464-P641 WeakPolarHBondContact CB-O 3.23Å; P464-F643 HydrophobicContact CG-CB 3.79Å
465	V	90.8	Very high	83.4	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-25.2	174.4	69.2	0	0	0	0	113.9	L463 H468 I472 C490 R495 I496 V640	L463-V465 HydrophobicContact CB-CG1 4.38Å; L463-V465 PolarHBondContact O-N 2.94Å; V465-H468 PolarHBondContact O-N 2.8Å; V465-I472 HydrophobicContact CG2-CD1 3.52Å; V465-C490 VanDerWaalsContact CB-O 3.31Å; V465-C490 WeakPolarHBondContact CB-O 3.36Å; V465-C490 VanDerWaalsContact CG1-O 3.29Å; V465-C490 WeakPolarHBondContact CG1-O 3.33Å; V465-C490 PolarHBondContact N-O 3.34Å; V465-R495 HydrophobicContact CG1-CB 3.51Å; V465-R495 HydrophobicContact CG1-CG 3.61Å; V465-I496 HydrophobicContact CG2-CD1 4.31Å; V465-I496 HydrophobicContact CG2-CG1 4.03Å; V465-V640 HydrophobicContact CB-CG1 4.01Å; V465-V640 HydrophobicContact CG2-CG1 4.34Å; V465-V640 HydrophobicContact CG2-CG2 4.3Å
466	D	90.6	Very high	84.9	Confident	32 Å²	32	64.1 Å²	64.1	17%	0.171	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-63.7	-41.2	-171.9	-61.1	-28.8	0	0	0	112.7	Q462 L463 H468 R469 R495	Q462-D466 HydrophobicContact CG-CB 3.93Å; L463-D466 PolarHBondContact N-OD2 3.34Å; L463-D466 WeakPolarHBondContact O-CB 3.48Å; L463-D466 PolarHBondContact O-N 2.75Å; D466-H468 PolarHBondContact O-N 3.1Å; D466-R469 VanDerWaalsContact O-CB 3.24Å; D466-R469 WeakPolarHBondContact O-CB 3.13Å; D466-R469 PolarHBondContact O-N 2.84Å; D466-R495 WeakPolarHBondContact OD1-CG 3.33Å; D466-R495 IonicContact OD1-NE 2.84Å; D466-R495 PolarHBondContact OD1-NE 2.87Å; D466-R495 IonicContact OD2-NE 3.57Å; D466-R495 IonicContact OD2-NH2 3.69Å
467	P	91.3	Very high	86.6	Confident	83 Å²	83	60.8 Å²	60.8	54%	0.539	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-61	-22.6	172.3	-22.7	32.5	0	0	0	114.8	L463 P464 R469	L463-P467 WeakPolarHBondContact O-CD 3.01Å; P464-P467 WeakPolarHBondContact O-CD 3.3Å; P467-R469 VanDerWaalsContact C-N 3.34Å
468	H	93.1	Very high	88.3	Confident	51 Å²	51	63.5 Å²	63.5	24%	0.236	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-93.5	7.4	-179	-63.7	-86	0	0	0	112.9	P464 V465 D466 D470 T471 I472 P641	P464-H468 PolarHBondContact O-CD2 2.77Å; V465-H468 PolarHBondContact O-N 2.8Å; D466-H468 PolarHBondContact O-N 3.1Å; H468-D470 PolarHBondContact O-N 3.24Å; H468-T471 PolarHBondContact O-N 2.67Å; H468-I472 HydrophobicContact CB-CD1 3.93Å; H468-I472 HydrophobicContact CB-CG1 4.31Å; H468-I472 WeakPolarHBondContact O-CB 3.46Å; H468-I472 VanDerWaalsContact O-CG1 3.31Å; H468-I472 WeakPolarHBondContact O-CG1 3.43Å; H468-I472 PolarHBondContact O-N 3.17Å; H468-P641 VanDerWaalsContact NE2-CD 3.3Å; H468-P641 WeakPolarHBondContact NE2-CD 3.37Å
469	R	93.6	Very high	90	Very high	60 Å²	60	59.4 Å²	59.4	23%	0.226	32%	0.318	C	S	.	.	H	α-helix	trans	-46.1	-56.5	-177.2	171.2	179	-174.4	-81.2	5	113	D466 P467 T471 I472 L473 L499 E502	D466-R469 VanDerWaalsContact O-CB 3.24Å; D466-R469 WeakPolarHBondContact O-CB 3.13Å; D466-R469 PolarHBondContact O-N 2.84Å; P467-R469 VanDerWaalsContact C-N 3.34Å; R469-T471 PolarHBondContact O-N 3.15Å; R469-I472 PolarHBondContact O-N 2.88Å; R469-L473 HydrophobicContact CG-CD1 3.83Å; R469-L473 WeakPolarHBondContact O-CB 3.38Å; R469-L473 VanDerWaalsContact O-CG 3.32Å; R469-L473 WeakPolarHBondContact O-CG 3.38Å; R469-L473 PolarHBondContact O-N 3.23Å; R469-L499 HydrophobicContact CB-CD1 4.18Å; R469-L499 HydrophobicContact CB-CD2 4.4Å; R469-L499 HydrophobicContact CG-CD1 4.18Å; R469-L499 HydrophobicContact CG-CD2 3.84Å; R469-L499 HydrophobicContact CG-CG 4.5Å; R469-E502 IonicContact CZ-OE2 3.02Å; R469-E502 IonicContact NE-OE2 3.27Å; R469-E502 PolarHBondContact NE-OE2 3.09Å; R469-E502 IonicContact NH2-OE1 2.74Å; R469-E502 IonicContact NH2-OE2 2.65Å; R469-E502 PolarHBondContact NH2-OE2 2.94Å
470	D	95.6	Very high	91.6	Very high	99 Å²	99	55.1 Å²	55.1	53%	0.529	30%	0.304	S	S	.	.	H	α-helix	trans	-70.9	-36.1	-172.3	-62.1	-27.2	0	0	0	111.7	H468 S474	H468-D470 PolarHBondContact O-N 3.24Å; D470-S474 WeakPolarHBondContact O-CB 3.27Å; D470-S474 PolarHBondContact O-N 2.91Å; D470-S474 PolarHBondContact O-OG 3.44Å
471	T	96.5	Very high	93	Very high	84 Å²	84	53.6 Å²	53.6	52%	0.515	29%	0.29	S	S	.	.	H	α-helix	trans	-61.9	-44.8	173.2	-52.6	0	0	0	0	111.5	H468 R469 A475 I638	H468-T471 PolarHBondContact O-N 2.67Å; R469-T471 PolarHBondContact O-N 3.15Å; T471-A475 WeakPolarHBondContact O-CB 3.24Å; T471-A475 PolarHBondContact O-N 2.79Å; T471-A475 VanDerWaalsContact O-N 3.1Å; T471-I638 HydrophobicContact CG2-CD1 4.35Å
472	I	96.7	Very high	94.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.5	-52	179	-70.6	166.7	0	0	0	110.7	V465 H468 R469 S474 A475 I476 I484 I638 V640	V465-I472 HydrophobicContact CG2-CD1 3.52Å; H468-I472 HydrophobicContact CB-CD1 3.93Å; H468-I472 HydrophobicContact CB-CG1 4.31Å; H468-I472 WeakPolarHBondContact O-CB 3.46Å; H468-I472 VanDerWaalsContact O-CG1 3.31Å; H468-I472 WeakPolarHBondContact O-CG1 3.43Å; H468-I472 PolarHBondContact O-N 3.17Å; R469-I472 PolarHBondContact O-N 2.88Å; I472-S474 PolarHBondContact O-N 3.12Å; I472-A475 PolarHBondContact O-N 3.24Å; I472-I476 HydrophobicContact CG2-CD1 3.71Å; I472-I476 VanDerWaalsContact O-CG1 3.29Å; I472-I476 WeakPolarHBondContact O-CG1 3.44Å; I472-I476 PolarHBondContact O-N 3.21Å; I472-I476 VanDerWaalsContact O-N 3.09Å; I472-I484 HydrophobicContact CG1-CD1 4.47Å; I472-I484 HydrophobicContact CG2-CD1 3.72Å; I472-I638 HydrophobicContact CG1-CD1 4.19Å; I472-I638 HydrophobicContact CG1-CG2 4.12Å; I472-V640 HydrophobicContact CD1-CG2 4.08Å
473	L	97.8	Very high	94.9	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-62.2	-44.2	-178.4	-68.6	173.8	0	0	0	111.5	R469 A475 I476 E477 L499 L500 R503	R469-L473 HydrophobicContact CG-CD1 3.83Å; R469-L473 WeakPolarHBondContact O-CB 3.38Å; R469-L473 VanDerWaalsContact O-CG 3.32Å; R469-L473 WeakPolarHBondContact O-CG 3.38Å; R469-L473 PolarHBondContact O-N 3.23Å; L473-A475 PolarHBondContact O-N 2.92Å; L473-I476 PolarHBondContact O-N 3.42Å; L473-E477 WeakPolarHBondContact O-CG 3.14Å; L473-E477 PolarHBondContact O-N 3.37Å; L473-L499 HydrophobicContact CD2-CB 4.14Å; L473-L500 HydrophobicContact CD2-CD2 3.82Å; L473-L500 HydrophobicContact CD2-CG 4.4Å; L473-R503 HydrophobicContact CD1-CB 4.07Å; L473-R503 HydrophobicContact CD1-CG 4.33Å; L473-R503 HydrophobicContact CD2-CB 4.21Å
474	S	97.5	Very high	95.4	Very high	44 Å²	44	39.5 Å²	39.5	31%	0.308	21%	0.214	S	C	.	.	H	α-helix	trans	-61.9	-43	178.7	-58.7	0	0	0	0	111.9	D470 I472 E477 Q478	D470-S474 WeakPolarHBondContact O-CB 3.27Å; D470-S474 PolarHBondContact O-N 2.91Å; D470-S474 PolarHBondContact O-OG 3.44Å; I472-S474 PolarHBondContact O-N 3.12Å; S474-E477 PolarHBondContact O-N 3Å; S474-Q478 WeakPolarHBondContact O-CB 3.15Å; S474-Q478 WeakPolarHBondContact O-CG 3.49Å; S474-Q478 PolarHBondContact O-N 3.33Å
475	A	97.7	Very high	95.7	Very high	11 Å²	11	39.1 Å²	39.1	9%	0.091	21%	0.212	C	C	.	.	H	α-helix	trans	-65.6	-41	178.7	0	0	0	0	0	112.5	T471 I472 L473 E477 Q478 H479 V482 I638	T471-A475 WeakPolarHBondContact O-CB 3.24Å; T471-A475 PolarHBondContact O-N 2.79Å; T471-A475 VanDerWaalsContact O-N 3.1Å; I472-A475 PolarHBondContact O-N 3.24Å; L473-A475 PolarHBondContact O-N 2.92Å; A475-E477 VanDerWaalsContact C-N 3.33Å; A475-Q478 PolarHBondContact O-N 3.13Å; A475-H479 WeakPolarHBondContact O-CB 3.22Å; A475-H479 PolarHBondContact O-N 2.98Å; A475-H479 PolarHBondContact O-ND1 2.83Å; A475-H479 VanDerWaalsContact O-ND1 3.1Å; A475-V482 HydrophobicContact CB-CG1 4.33Å; A475-V482 HydrophobicContact CB-CG2 4.19Å; A475-V482 WeakPolarHBondContact O-CG2 2.88Å; A475-I638 HydrophobicContact CB-CD1 3.51Å; A475-I638 HydrophobicContact CB-CG1 4.46Å
476	I	97.9	Very high	95.5	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-65.8	-36.6	177.7	-65.7	168.6	0	0	0	111	I472 L473 H479 V482 I484 L500 R615 V617	I472-I476 HydrophobicContact CG2-CD1 3.71Å; I472-I476 VanDerWaalsContact O-CG1 3.29Å; I472-I476 WeakPolarHBondContact O-CG1 3.44Å; I472-I476 PolarHBondContact O-N 3.21Å; I472-I476 VanDerWaalsContact O-N 3.09Å; L473-I476 PolarHBondContact O-N 3.42Å; I476-H479 VanDerWaalsContact O-O 3.14Å; I476-V482 HydrophobicContact CG1-CB 4.29Å; I476-V482 HydrophobicContact CG1-CG2 4.08Å; I476-I484 HydrophobicContact CD1-CD1 4.34Å; I476-L500 HydrophobicContact CD1-CD2 4.02Å; I476-L500 HydrophobicContact CG2-CD2 4.07Å; I476-R615 HydrophobicContact CG2-CB 4.04Å; I476-R615 HydrophobicContact CG2-CG 4.33Å; I476-R615 VanDerWaalsContact O-CD 3.28Å; I476-R615 WeakPolarHBondContact O-CD 3.19Å; I476-R615 PolarHBondContact O-NE 3.16Å; I476-V617 HydrophobicContact CD1-CG2 3.74Å; I476-V617 HydrophobicContact CG1-CG2 3.95Å; I476-V617 HydrophobicContact CG2-CG2 4.29Å
477	E	95.9	Very high	95.1	Very high	57 Å²	57	40.6 Å²	40.6	27%	0.266	22%	0.221	S	C	.	.	H	α-helix	trans	-68.6	-40.8	175.9	-74.7	179	164.9	0	0	111.7	L473 S474 A475 R503 R509 R615	L473-E477 WeakPolarHBondContact O-CG 3.14Å; L473-E477 PolarHBondContact O-N 3.37Å; S474-E477 PolarHBondContact O-N 3Å; A475-E477 VanDerWaalsContact C-N 3.33Å; E477-R503 IonicContact OE1-NE 3.12Å; E477-R503 PolarHBondContact OE1-NE 3.39Å; E477-R503 IonicContact OE1-NH2 2.89Å; E477-R503 IonicContact OE2-NE 3.87Å; E477-R503 IonicContact OE2-NH2 4Å; E477-R503 PolarHBondContact OE2-NH2 3.15Å; E477-R509 IonicContact OE1-NH2 3.1Å; E477-R509 PolarHBondContact OE1-NH2 2.78Å; E477-R615 PolarHBondContact O-NE 2.93Å; E477-R615 PolarHBondContact O-NH2 2.86Å
478	Q	96.7	Very high	94.4	Very high	139 Å²	139	37.6 Å²	37.6	65%	0.65	20%	0.201	S	C	*	.	H	α-helix	trans	-80.6	-29.2	-174.8	-70.9	170.7	5.7	0	0	114.3	S474 A475	S474-Q478 WeakPolarHBondContact O-CB 3.15Å; S474-Q478 WeakPolarHBondContact O-CG 3.49Å; S474-Q478 PolarHBondContact O-N 3.33Å; A475-Q478 PolarHBondContact O-N 3.13Å
479	H	97.4	Very high	93.5	Very high	67 Å²	67	37.2 Å²	37.2	31%	0.31	21%	0.211	S	C	.	.			trans	-119.5	139.2	-173.4	-57.1	81.6	0	0	0	111.4	A475 I476 V481 V482 R615 P636	A475-H479 WeakPolarHBondContact O-CB 3.22Å; A475-H479 PolarHBondContact O-N 2.98Å; A475-H479 PolarHBondContact O-ND1 2.83Å; A475-H479 VanDerWaalsContact O-ND1 3.1Å; I476-H479 VanDerWaalsContact O-O 3.14Å; H479-V481 WeakPolarHBondContact CB-O 3.44Å; H479-V481 PolarHBondContact O-N 3.24Å; H479-V482 HydrophobicContact CB-CG2 4.08Å; H479-R615 WeakPolarHBondContact O-CD 3.41Å; H479-P636 HydrophobicContact CB-CG 4.09Å
480	P	97.1	Very high	93.1	Very high	64 Å²	64	34.4 Å²	34.4	42%	0.416	20%	0.201	S	C	.	.	S	Bend	trans	-62.4	-31.4	177	22.8	-31.8	0	0	0	112.9	Q608 L616	P480-Q608 VanDerWaalsContact CB-OE1 3.23Å; P480-L616 PolarHBondContact O-N 2.85Å
481	V	98.2	Very high	92.7	Very high	5 Å²	5	30.1 Å²	30.1	3%	0.03	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	139.9	179	-170.3	0	0	0	0	108.9	H479 Q608 L616 L618 F632 C635	H479-V481 WeakPolarHBondContact CB-O 3.44Å; H479-V481 PolarHBondContact O-N 3.24Å; V481-Q608 HydrophobicContact CG2-CG 4.38Å; V481-L616 CarbonylContact C-O 3.57Å; V481-L616 VanDerWaalsContact CA-O 3.27Å; V481-L616 WeakPolarHBondContact CA-O 3.37Å; V481-L616 HydrophobicContact CB-CB 4.47Å; V481-L616 HydrophobicContact CG1-CB 4.22Å; V481-L616 HydrophobicContact CG1-CD2 4Å; V481-L616 HydrophobicContact CG1-CG 4.08Å; V481-L616 HydrophobicContact CG2-CB 4.16Å; V481-L616 HydrophobicContact CG2-CD2 4.21Å; V481-L618 HydrophobicContact CG1-CD1 4.42Å; V481-L618 HydrophobicContact CG1-CG 4.48Å; V481-F632 HydrophobicContact CB-CB 4.34Å; V481-F632 HydrophobicContact CG1-CB 4.06Å; V481-F632 HydrophobicContact CG1-CD1 4.19Å; V481-F632 HydrophobicContact CG1-CD2 4.27Å; V481-F632 HydrophobicContact CG1-CG 3.92Å; V481-F632 HydrophobicContact CG2-CB 4.36Å; V481-F632 HydrophobicContact CG2-CD1 3.9Å; V481-F632 HydrophobicContact CG2-CG 4.31Å; V481-C635 HydrophobicContact CB-CB 4.06Å; V481-C635 HydrophobicContact CG1-CB 4.44Å; V481-C635 VanDerWaalsContact O-CB 3.31Å; V481-C635 WeakPolarHBondContact O-CB 3.28Å
482	V	98.2	Very high	92.5	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	136.8	172.7	-178.7	0	0	0	0	109.5	A475 I476 H479 I484 L616 V617 L618 P636 I638	A475-V482 HydrophobicContact CB-CG1 4.33Å; A475-V482 HydrophobicContact CB-CG2 4.19Å; A475-V482 WeakPolarHBondContact O-CG2 2.88Å; I476-V482 HydrophobicContact CG1-CB 4.29Å; I476-V482 HydrophobicContact CG1-CG2 4.08Å; H479-V482 HydrophobicContact CB-CG2 4.08Å; V482-I484 HydrophobicContact CG1-CG1 4.04Å; V482-L616 PolarHBondContact N-O 3.01Å; V482-V617 WeakPolarHBondContact O-CA 3.37Å; V482-L618 PolarHBondContact O-N 2.89Å; V482-P636 HydrophobicContact CG1-CG 4.41Å; V482-P636 HydrophobicContact CG2-CG 4.12Å; V482-I638 HydrophobicContact CG1-CD1 4.1Å; V482-I638 HydrophobicContact CG1-CG1 4.31Å
483	V	97.7	Very high	92.3	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	127.5	170	-178	0	0	0	0	108.7	L618 N625 F628 P636 V637 I638	V483-L618 CarbonylContact C-O 3.55Å; V483-L618 WeakPolarHBondContact CA-O 3.48Å; V483-L618 HydrophobicContact CG2-CB 4.3Å; V483-L618 HydrophobicContact CG2-CD1 4.24Å; V483-N625 HydrophobicContact CG1-CB 4.1Å; V483-F628 HydrophobicContact CG2-CB 4.07Å; V483-P636 PolarHBondContact N-O 3.4Å; V483-V637 HydrophobicContact CB-CG1 4.44Å; V483-V637 HydrophobicContact CB-CG2 4.16Å; V483-V637 HydrophobicContact CG1-CG1 4.29Å; V483-V637 CarbonylContact O-C 3.53Å; V483-V637 WeakPolarHBondContact O-CA 3.36Å; V483-I638 PolarHBondContact O-N 3.48Å
484	I	96.2	Very high	92	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	109.1	175.9	-56.4	177.5	0	0	0	108.5	I472 I476 V482 K492 I496 V617 L618 M619 S620 I638 V640	I472-I484 HydrophobicContact CG1-CD1 4.47Å; I472-I484 HydrophobicContact CG2-CD1 3.72Å; I476-I484 HydrophobicContact CD1-CD1 4.34Å; V482-I484 HydrophobicContact CG1-CG1 4.04Å; I484-K492 HydrophobicContact CG2-CD 4.1Å; I484-K492 HydrophobicContact CG2-CG 4.28Å; I484-I496 HydrophobicContact CB-CD1 4.47Å; I484-I496 HydrophobicContact CD1-CD1 3.73Å; I484-I496 HydrophobicContact CD1-CG2 4.45Å; I484-I496 HydrophobicContact CG2-CD1 3.91Å; I484-V617 HydrophobicContact CD1-CG1 3.59Å; I484-V617 HydrophobicContact CG1-CG1 4.07Å; I484-L618 PolarHBondContact N-O 2.66Å; I484-M619 WeakPolarHBondContact O-CA 3.45Å; I484-S620 PolarHBondContact O-N 2.93Å; I484-I638 WeakPolarHBondContact CA-O 3.46Å; I484-V640 HydrophobicContact CG2-CG2 4.03Å
485	S	92.8	Very high	91.8	Very high	18 Å²	18	26.9 Å²	26.9	13%	0.126	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	136.6	176	179.3	0	0	0	0	109.9	S620 N625 I638 K639 V640	S485-S620 WeakPolarHBondContact CA-O 3.38Å; S485-N625 WeakPolarHBondContact CB-ND2 3.46Å; S485-N625 PolarHBondContact OG-ND2 3.16Å; S485-I638 PolarHBondContact N-O 3.42Å; S485-K639 CarbonylContact O-C 3.56Å; S485-K639 WeakPolarHBondContact O-CA 3.49Å; S485-V640 PolarHBondContact O-N 2.95Å
486	G	87.9	Confident	91.8	Very high	4 Å²	4	26.4 Å²	26.4	4%	0.041	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.6	157	167	0	0	0	0	0	111.2	K492 S620 A621 V640	G486-K492 WeakPolarHBondContact O-CE 3.15Å; G486-K492 PolarHBondContact O-NZ 2.98Å; G486-S620 PolarHBondContact N-O 2.9Å; G486-A621 VanDerWaalsContact O-CA 3.25Å; G486-A621 WeakPolarHBondContact O-CA 3.46Å; G486-V640 WeakPolarHBondContact CA-O 3.4Å
487	D	80.7	Confident	91.7	Very high	60 Å²	60	26.3 Å²	26.3	32%	0.321	15%	0.151	S	C	.	.			trans	-58.8	164.3	-171.6	-61	-37.6	0	0	0	113.7	G489 C490 K492 G642 M644	D487-G489 PolarHBondContact O-N 3.47Å; D487-C490 PolarHBondContact O-N 3.44Å; D487-C490 PolarHBondContact O-SG 3.13Å; D487-K492 PolarHBondContact O-NZ 2.83Å; D487-G642 WeakPolarHBondContact OD2-CA 3.36Å; D487-G642 PolarHBondContact OD2-N 3.05Å; D487-M644 HydrophobicContact CB-CE 4.32Å
488	T	76.5	Confident	91.7	Very high	19 Å²	19	24 Å²	24	12%	0.117	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	134.5	171.7	56.3	0	0	0	0	110.2	A621 G810	T488-A621 HydrophobicContact CG2-CB 3.78Å; T488-G810 PolarHBondContact OG1-O 3Å
489	G	75.9	Confident	91.7	Very high	44 Å²	44	17.8 Å²	17.8	45%	0.454	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	-5	178.1	0	0	0	0	0	115.6	D487 G491	D487-G489 PolarHBondContact O-N 3.47Å; G489-G491 PolarHBondContact O-N 2.82Å; G489-G491 VanDerWaalsContact O-N 3.07Å
490	C	84.3	Confident	91.7	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.007	10%	0.098	C	C	.	.	S	Bend	trans	-69.2	-4.8	177.2	68.4	0	0	0	0	114.8	P464 V465 D487 K492 V640	P464-C490 HydrophobicContact CB-CB 3.97Å; P464-C490 HydrophobicContact CG-CB 4.17Å; V465-C490 VanDerWaalsContact CB-O 3.31Å; V465-C490 WeakPolarHBondContact CB-O 3.36Å; V465-C490 VanDerWaalsContact CG1-O 3.29Å; V465-C490 WeakPolarHBondContact CG1-O 3.33Å; V465-C490 PolarHBondContact N-O 3.34Å; D487-C490 PolarHBondContact O-N 3.44Å; D487-C490 PolarHBondContact O-SG 3.13Å; C490-K492 VanDerWaalsContact SG-CG 3.56Å; C490-K492 PolarHBondContact SG-NZ 3.12Å; C490-V640 HydrophobicContact CB-CG1 4.27Å
491	G	87.6	Confident	91.7	Very high	8 Å²	8	11.7 Å²	11.7	8%	0.082	8%	0.078	C	C	.	.	S	Bend	trans	97.8	3.9	174.6	0	0	0	0	0	115.9	G489 T493 T494 R495	G489-G491 PolarHBondContact O-N 2.82Å; G489-G491 VanDerWaalsContact O-N 3.07Å; G491-T493 PolarHBondContact O-N 2.89Å; G491-T494 PolarHBondContact O-N 2.92Å; G491-T494 PolarHBondContact O-OG1 3.49Å; G491-R495 VanDerWaalsContact O-CB 3.26Å; G491-R495 WeakPolarHBondContact O-CB 3.4Å; G491-R495 WeakPolarHBondContact O-CG 3.37Å; G491-R495 PolarHBondContact O-N 2.99Å
492	K	91.7	Very high	91.5	Very high	8 Å²	8	12.4 Å²	12.4	4%	0.035	8%	0.081	C	C	.	.	H	α-helix	trans	-47.3	-61.7	-178.9	-69.4	177.9	-44.8	-64.7	0	113.3	I484 G486 D487 C490 T494 I496 M619 S620	I484-K492 HydrophobicContact CG2-CD 4.1Å; I484-K492 HydrophobicContact CG2-CG 4.28Å; G486-K492 WeakPolarHBondContact O-CE 3.15Å; G486-K492 PolarHBondContact O-NZ 2.98Å; D487-K492 PolarHBondContact O-NZ 2.83Å; C490-K492 VanDerWaalsContact SG-CG 3.56Å; C490-K492 PolarHBondContact SG-NZ 3.12Å; K492-T494 VanDerWaalsContact C-N 3.26Å; K492-T494 PolarHBondContact O-N 3Å; K492-I496 HydrophobicContact CB-CD1 3.82Å; K492-I496 HydrophobicContact CG-CD1 3.98Å; K492-I496 VanDerWaalsContact O-CB 3.31Å; K492-I496 WeakPolarHBondContact O-CB 3.27Å; K492-I496 WeakPolarHBondContact O-CG1 3.41Å; K492-I496 PolarHBondContact O-N 3.27Å; K492-I496 VanDerWaalsContact O-N 3.1Å; K492-M619 HydrophobicContact CB-SD 4.06Å; K492-S620 VanDerWaalsContact CE-O 3.31Å; K492-S620 WeakPolarHBondContact CE-O 3.35Å
493	T	92.2	Very high	91.4	Very high	19 Å²	19	15.8 Å²	15.8	12%	0.117	9%	0.094	C	C	.	.	H	α-helix	trans	-59.2	-33.2	-174.6	-52.7	0	0	0	0	113.5	G491 V528 D588	G491-T493 PolarHBondContact O-N 2.89Å; T493-V528 HydrophobicContact CG2-CB 4.23Å; T493-V528 HydrophobicContact CG2-CG1 3.52Å; T493-V528 HydrophobicContact CG2-CG2 3.68Å; T493-D588 WeakPolarHBondContact CB-OD2 3.5Å; T493-D588 WeakPolarHBondContact CG2-OD2 3.27Å; T493-D588 PolarHBondContact OG1-OD2 2.62Å
494	T	92.3	Very high	91.4	Very high	23 Å²	23	17.2 Å²	17.2	14%	0.141	10%	0.099	C	C	.	.	H	α-helix	trans	-94.5	-44.9	-178.2	54.2	0	0	0	0	112.8	G491 K492 Q498 R531 V532	G491-T494 PolarHBondContact O-N 2.92Å; G491-T494 PolarHBondContact O-OG1 3.49Å; K492-T494 VanDerWaalsContact C-N 3.26Å; K492-T494 PolarHBondContact O-N 3Å; T494-Q498 WeakPolarHBondContact O-CG 3.04Å; T494-Q498 PolarHBondContact O-NE2 3.37Å; T494-R531 HydrophobicContact CG2-CG 4.07Å; T494-V532 HydrophobicContact CG2-CG2 4.16Å
495	R	93.3	Very high	91.4	Very high	15 Å²	15	17.2 Å²	17.2	6%	0.057	10%	0.099	C	C	.	.	H	α-helix	trans	-83.3	-43.6	-172	-63	-61.6	-158.3	-154.1	6.7	113.4	P461 L463 V465 D466 G491 Q498 L499 E535	P461-R495 PolarHBondContact O-NH2 3.47Å; L463-R495 HydrophobicContact CD1-CG 3.88Å; V465-R495 HydrophobicContact CG1-CB 3.51Å; V465-R495 HydrophobicContact CG1-CG 3.61Å; D466-R495 WeakPolarHBondContact OD1-CG 3.33Å; D466-R495 IonicContact OD1-NE 2.84Å; D466-R495 PolarHBondContact OD1-NE 2.87Å; D466-R495 IonicContact OD2-NE 3.57Å; D466-R495 IonicContact OD2-NH2 3.69Å; G491-R495 VanDerWaalsContact O-CB 3.26Å; G491-R495 WeakPolarHBondContact O-CB 3.4Å; G491-R495 WeakPolarHBondContact O-CG 3.37Å; G491-R495 PolarHBondContact O-N 2.99Å; R495-Q498 CarbonylContact O-C 3.58Å; R495-Q498 WeakPolarHBondContact O-CA 3.02Å; R495-Q498 WeakPolarHBondContact O-CB 3.22Å; R495-Q498 PolarHBondContact O-N 2.87Å; R495-L499 WeakPolarHBondContact O-CG 2.93Å; R495-L499 PolarHBondContact O-N 3.46Å; R495-E535 IonicContact CZ-OE2 3.28Å; R495-E535 IonicContact NH1-OE2 2.63Å; R495-E535 PolarHBondContact NH1-OE2 3.4Å
496	I	96.4	Very high	91.5	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-56.9	-45.4	-174	-65.9	167.2	0	0	0	112.3	V465 I484 K492 Q498 L499 L500 I586 M619	V465-I496 HydrophobicContact CG2-CD1 4.31Å; V465-I496 HydrophobicContact CG2-CG1 4.03Å; I484-I496 HydrophobicContact CB-CD1 4.47Å; I484-I496 HydrophobicContact CD1-CD1 3.73Å; I484-I496 HydrophobicContact CD1-CG2 4.45Å; I484-I496 HydrophobicContact CG2-CD1 3.91Å; K492-I496 HydrophobicContact CB-CD1 3.82Å; K492-I496 HydrophobicContact CG-CD1 3.98Å; K492-I496 VanDerWaalsContact O-CB 3.31Å; K492-I496 WeakPolarHBondContact O-CB 3.27Å; K492-I496 WeakPolarHBondContact O-CG1 3.41Å; K492-I496 PolarHBondContact O-N 3.27Å; K492-I496 VanDerWaalsContact O-N 3.1Å; I496-Q498 VanDerWaalsContact C-N 3.27Å; I496-Q498 PolarHBondContact O-N 3.15Å; I496-L499 PolarHBondContact O-N 3.42Å; I496-L500 PolarHBondContact O-N 3.38Å; I496-L500 VanDerWaalsContact O-N 3.09Å; I496-I586 HydrophobicContact CG2-CD1 4.31Å; I496-M619 HydrophobicContact CB-SD 4.29Å; I496-M619 HydrophobicContact CD1-SD 3.65Å; I496-M619 HydrophobicContact CG2-SD 4.45Å
497	P	97.5	Very high	91.9	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-59.7	-36.5	174.2	-23.1	33.8	0	0	0	113.3	L501 I517 L561 F563 I586	P497-L501 PolarHBondContact O-N 2.81Å; P497-I517 HydrophobicContact CB-CD1 4.19Å; P497-I517 HydrophobicContact CB-CG1 4.24Å; P497-I517 HydrophobicContact CG-CD1 4.4Å; P497-I517 HydrophobicContact CG-CG1 3.94Å; P497-L561 HydrophobicContact CB-CD1 4.15Å; P497-L561 HydrophobicContact CB-CD2 4.29Å; P497-F563 HydrophobicContact CB-CZ 4.45Å; P497-F563 HydrophobicContact CG-CZ 4.22Å; P497-I586 HydrophobicContact CB-CD1 4.49Å; P497-I586 HydrophobicContact CG-CD1 4.03Å
498	Q	95.7	Very high	92.6	Very high	7 Å²	7	22.1 Å²	22.1	3%	0.033	13%	0.133	C	C	.	.	H	α-helix	trans	-70.4	-39.2	177.3	-64.6	177.6	64	0	0	112	T494 R495 I496 L500 L501 E502 V532 E535 L536	T494-Q498 WeakPolarHBondContact O-CG 3.04Å; T494-Q498 PolarHBondContact O-NE2 3.37Å; R495-Q498 CarbonylContact O-C 3.58Å; R495-Q498 WeakPolarHBondContact O-CA 3.02Å; R495-Q498 WeakPolarHBondContact O-CB 3.22Å; R495-Q498 PolarHBondContact O-N 2.87Å; I496-Q498 VanDerWaalsContact C-N 3.27Å; I496-Q498 PolarHBondContact O-N 3.15Å; Q498-L500 VanDerWaalsContact C-N 3.35Å; Q498-L501 PolarHBondContact O-N 2.95Å; Q498-E502 VanDerWaalsContact O-CB 3.31Å; Q498-E502 WeakPolarHBondContact O-CB 3.43Å; Q498-E502 PolarHBondContact O-N 3.41Å; Q498-V532 HydrophobicContact CG-CG1 3.76Å; Q498-E535 PolarHBondContact NE2-OE2 3.07Å; Q498-L536 HydrophobicContact CB-CD2 4.26Å; Q498-L536 HydrophobicContact CG-CD2 3.84Å; Q498-L536 HydrophobicContact CG-CG 4.03Å
499	L	96.2	Very high	93.6	Very high	9 Å²	9	24.5 Å²	24.5	5%	0.047	14%	0.139	C	C	.	.	H	α-helix	trans	-63.4	-40.7	177.2	-65	178.3	0	0	0	111.4	R469 L473 R495 I496 E502 R503	R469-L499 HydrophobicContact CB-CD1 4.18Å; R469-L499 HydrophobicContact CB-CD2 4.4Å; R469-L499 HydrophobicContact CG-CD1 4.18Å; R469-L499 HydrophobicContact CG-CD2 3.84Å; R469-L499 HydrophobicContact CG-CG 4.5Å; L473-L499 HydrophobicContact CD2-CB 4.14Å; R495-L499 WeakPolarHBondContact O-CG 2.93Å; R495-L499 PolarHBondContact O-N 3.46Å; I496-L499 PolarHBondContact O-N 3.42Å; L499-E502 PolarHBondContact O-N 3.11Å; L499-R503 WeakPolarHBondContact O-CB 3.45Å; L499-R503 PolarHBondContact O-N 2.71Å
500	L	97.7	Very high	94.6	Very high	4 Å²	4	22.4 Å²	22.4	2%	0.021	12%	0.118	C	C	.	.	H	α-helix	trans	-62.8	-45.2	174.8	-70.7	172.8	0	0	0	111.8	L473 I476 I496 Q498 Y504 H584 I586	L473-L500 HydrophobicContact CD2-CD2 3.82Å; L473-L500 HydrophobicContact CD2-CG 4.4Å; I476-L500 HydrophobicContact CD1-CD2 4.02Å; I476-L500 HydrophobicContact CG2-CD2 4.07Å; I496-L500 PolarHBondContact O-N 3.38Å; I496-L500 VanDerWaalsContact O-N 3.09Å; Q498-L500 VanDerWaalsContact C-N 3.35Å; L500-Y504 WeakPolarHBondContact O-CD2 3.4Å; L500-Y504 PolarHBondContact O-N 2.81Å; L500-H584 HydrophobicContact CD1-CB 4.43Å; L500-I586 HydrophobicContact CD1-CD1 3.94Å
501	L	96.9	Very high	95.2	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.3	-46.8	176.5	-176.7	63.1	0	0	0	111	P497 Q498 R503 Y504 V505 C513 L536 L561	P497-L501 PolarHBondContact O-N 2.81Å; Q498-L501 PolarHBondContact O-N 2.95Å; L501-R503 PolarHBondContact O-N 2.85Å; L501-Y504 PolarHBondContact O-N 3.19Å; L501-V505 HydrophobicContact CD1-CG2 3.91Å; L501-V505 HydrophobicContact CG-CG2 4.16Å; L501-V505 WeakPolarHBondContact O-CB 3.4Å; L501-V505 WeakPolarHBondContact O-CG2 3.06Å; L501-V505 PolarHBondContact O-N 2.99Å; L501-C513 HydrophobicContact CD1-CB 4.3Å; L501-L536 HydrophobicContact CD2-CD1 4.09Å; L501-L561 HydrophobicContact CB-CD2 4.38Å; L501-L561 HydrophobicContact CD2-CD1 4.11Å; L501-L561 HydrophobicContact CD2-CG 4.27Å
502	E	94.9	Very high	95.6	Very high	20 Å²	20	28.9 Å²	28.9	9%	0.093	14%	0.14	C	C	.	.	H	α-helix	trans	-53.2	-52.9	176.8	176.6	178.3	-144.2	0	0	111.6	W450 R469 Q498 L499 Y504 V505 T506	W450-E502 HydrophobicContact CH2-CB 3.42Å; W450-E502 VanDerWaalsContact CH2-CB 3.42Å; W450-E502 HydrophobicContact CH2-CG 3.77Å; W450-E502 HydrophobicContact CZ2-CB 3.58Å; W450-E502 HydrophobicContact CZ2-CG 3.32Å; W450-E502 HydrophobicContact CZ3-CB 4.09Å; R469-E502 IonicContact CZ-OE2 3.02Å; R469-E502 IonicContact NE-OE2 3.27Å; R469-E502 PolarHBondContact NE-OE2 3.09Å; R469-E502 IonicContact NH2-OE1 2.74Å; R469-E502 IonicContact NH2-OE2 2.65Å; R469-E502 PolarHBondContact NH2-OE2 2.94Å; Q498-E502 VanDerWaalsContact O-CB 3.31Å; Q498-E502 WeakPolarHBondContact O-CB 3.43Å; Q498-E502 PolarHBondContact O-N 3.41Å; L499-E502 PolarHBondContact O-N 3.11Å; E502-Y504 PolarHBondContact O-N 2.94Å; E502-V505 PolarHBondContact O-N 3.35Å; E502-T506 HydrophobicContact CG-CG2 4.14Å; E502-T506 WeakPolarHBondContact O-CB 3.35Å; E502-T506 WeakPolarHBondContact O-CG2 3.32Å; E502-T506 PolarHBondContact O-N 3.21Å; E502-T506 PolarHBondContact O-OG1 2.88Å
503	R	95.9	Very high	95.9	Very high	71 Å²	71	28.5 Å²	28.5	27%	0.268	14%	0.139	S	C	.	.	H	α-helix	trans	-55	-50.1	-178.5	-179.5	63.5	162.9	175.4	-1.9	111.3	L473 E477 L499 L501 T506 E507	L473-R503 HydrophobicContact CD1-CB 4.07Å; L473-R503 HydrophobicContact CD1-CG 4.33Å; L473-R503 HydrophobicContact CD2-CB 4.21Å; E477-R503 IonicContact OE1-NE 3.12Å; E477-R503 PolarHBondContact OE1-NE 3.39Å; E477-R503 IonicContact OE1-NH2 2.89Å; E477-R503 IonicContact OE2-NE 3.87Å; E477-R503 IonicContact OE2-NH2 4Å; E477-R503 PolarHBondContact OE2-NH2 3.15Å; L499-R503 WeakPolarHBondContact O-CB 3.45Å; L499-R503 PolarHBondContact O-N 2.71Å; L501-R503 PolarHBondContact O-N 2.85Å; R503-T506 PolarHBondContact O-OG1 2.92Å; R503-E507 VanDerWaalsContact CD-OE1 3.28Å; R503-E507 WeakPolarHBondContact CD-OE1 3.45Å; R503-E507 IonicContact CZ-OE1 3.89Å; R503-E507 IonicContact NE-OE1 3.89Å; R503-E507 PolarHBondContact NE-OE1 2.8Å; R503-E507 IonicContact NH1-OE1 3.5Å; R503-E507 PolarHBondContact NH1-OE1 3.14Å; R503-E507 IonicContact NH2-OE1 3.29Å; R503-E507 WeakPolarHBondContact O-CB 3.49Å; R503-E507 VanDerWaalsContact O-CG 3.29Å; R503-E507 WeakPolarHBondContact O-CG 3.25Å; R503-E507 PolarHBondContact O-N 3.27Å
504	Y	97.5	Very high	96.2	Very high	30 Å²	30	27.8 Å²	27.8	12%	0.118	13%	0.134	C	C	.	.	H	α-helix	trans	-68.2	-39	-179.3	-84.9	-117.6	0	0	0	112.6	L500 L501 E502 G508 R509 G510 R512 C513 H584	L500-Y504 WeakPolarHBondContact O-CD2 3.4Å; L500-Y504 PolarHBondContact O-N 2.81Å; L501-Y504 PolarHBondContact O-N 3.19Å; E502-Y504 PolarHBondContact O-N 2.94Å; Y504-G508 PolarHBondContact O-N 2.97Å; Y504-R509 HydrophobicContact CD1-CG 3.97Å; Y504-R509 HydrophobicContact CG-CG 4.26Å; Y504-R509 VanDerWaalsContact CZ-NH1 3.29Å; Y504-R509 CarbonylContact O-C 3.6Å; Y504-R509 VanDerWaalsContact O-C 3.23Å; Y504-R509 WeakPolarHBondContact O-CA 3.46Å; Y504-R509 WeakPolarHBondContact O-CG 3.36Å; Y504-R509 PolarHBondContact O-N 2.81Å; Y504-R509 PolarHBondContact OH-NH1 2.86Å; Y504-G510 PolarHBondContact O-N 2.9Å; Y504-R512 HydrophobicContact CD1-CB 4.25Å; Y504-R512 HydrophobicContact CE1-CB 4.28Å; Y504-C513 HydrophobicContact CD1-CB 3.73Å; Y504-C513 HydrophobicContact CD2-CB 4.49Å; Y504-C513 HydrophobicContact CG-CB 3.7Å; Y504-H584 AromaticContact CE2-CE1 3.78Å; Y504-H584 AromaticContact CZ-CE1 3.74Å; Y504-H584 PolarHBondContact OH-CE1 3.49Å
505	V	96.4	Very high	96.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-68.7	-45.5	-179.6	171.5	0	0	0	0	111.3	L446 L447 W450 L501 E502 E507 G508	L446-V505 HydrophobicContact CB-CG1 4.07Å; L446-V505 HydrophobicContact CB-CG2 3.97Å; L446-V505 HydrophobicContact CD1-CG2 4.35Å; L446-V505 WeakPolarHBondContact O-CG1 3.48Å; L447-V505 HydrophobicContact CB-CG1 4.42Å; W450-V505 HydrophobicContact CB-CG1 3.66Å; W450-V505 HydrophobicContact CD2-CG1 4.42Å; W450-V505 HydrophobicContact CE3-CG1 4.49Å; W450-V505 HydrophobicContact CG-CG1 4.06Å; L501-V505 HydrophobicContact CD1-CG2 3.91Å; L501-V505 HydrophobicContact CG-CG2 4.16Å; L501-V505 WeakPolarHBondContact O-CB 3.4Å; L501-V505 WeakPolarHBondContact O-CG2 3.06Å; L501-V505 PolarHBondContact O-N 2.99Å; E502-V505 PolarHBondContact O-N 3.35Å; V505-E507 VanDerWaalsContact C-N 3.28Å; V505-E507 PolarHBondContact O-N 3.13Å; V505-G508 PolarHBondContact O-N 2.82Å; V505-G508 VanDerWaalsContact O-N 3.09Å
506	T	94.9	Very high	96.7	Very high	64 Å²	64	26 Å²	26	39%	0.393	13%	0.125	S	C	.	.	H	α-helix	trans	-67.2	-27.4	-179.6	52.2	0	0	0	0	113	E502 R503 G508	E502-T506 HydrophobicContact CG-CG2 4.14Å; E502-T506 WeakPolarHBondContact O-CB 3.35Å; E502-T506 WeakPolarHBondContact O-CG2 3.32Å; E502-T506 PolarHBondContact O-N 3.21Å; E502-T506 PolarHBondContact O-OG1 2.88Å; R503-T506 PolarHBondContact O-OG1 2.92Å; T506-G508 VanDerWaalsContact C-N 3.28Å; T506-G508 PolarHBondContact O-N 2.78Å
507	E	96.2	Very high	96.8	Very high	81 Å²	81	26 Å²	26	38%	0.379	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	7	173.3	-69.2	175.8	172.6	0	0	114	R503 V505 R509	R503-E507 VanDerWaalsContact CD-OE1 3.28Å; R503-E507 WeakPolarHBondContact CD-OE1 3.45Å; R503-E507 IonicContact CZ-OE1 3.89Å; R503-E507 IonicContact NE-OE1 3.89Å; R503-E507 PolarHBondContact NE-OE1 2.8Å; R503-E507 IonicContact NH1-OE1 3.5Å; R503-E507 PolarHBondContact NH1-OE1 3.14Å; R503-E507 IonicContact NH2-OE1 3.29Å; R503-E507 WeakPolarHBondContact O-CB 3.49Å; R503-E507 VanDerWaalsContact O-CG 3.29Å; R503-E507 WeakPolarHBondContact O-CG 3.25Å; R503-E507 PolarHBondContact O-N 3.27Å; V505-E507 VanDerWaalsContact C-N 3.28Å; V505-E507 PolarHBondContact O-N 3.13Å; E507-R509 VanDerWaalsContact C-N 3.27Å; E507-R509 HydrophobicContact CB-CG 4.09Å; E507-R509 PolarHBondContact O-N 2.68Å; E507-R509 IonicContact OE2-CZ 3.95Å; E507-R509 IonicContact OE2-NE 3.07Å; E507-R509 PolarHBondContact OE2-NE 2.75Å; E507-R509 IonicContact OE2-NH2 3.39Å; E507-R509 PolarHBondContact OE2-NH2 2.86Å
508	G	95.9	Very high	96.8	Very high	41 Å²	41	26 Å²	26	42%	0.423	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	17	177.1	0	0	0	0	0	114.5	S443 Y504 V505 T506	S443-G508 WeakPolarHBondContact CB-O 3.28Å; Y504-G508 PolarHBondContact O-N 2.97Å; V505-G508 PolarHBondContact O-N 2.82Å; V505-G508 VanDerWaalsContact O-N 3.09Å; T506-G508 VanDerWaalsContact C-N 3.28Å; T506-G508 PolarHBondContact O-N 2.78Å
509	R	96.4	Very high	96.8	Very high	68 Å²	68	25.6 Å²	25.6	26%	0.257	12%	0.123	S	C	.	.			trans	-119.5	24.4	178.9	59.9	177.7	178.7	135.9	0.9	113.3	E477 Y504 E507 A511 R512	E477-R509 IonicContact OE1-NH2 3.1Å; E477-R509 PolarHBondContact OE1-NH2 2.78Å; Y504-R509 HydrophobicContact CD1-CG 3.97Å; Y504-R509 HydrophobicContact CG-CG 4.26Å; Y504-R509 VanDerWaalsContact CZ-NH1 3.29Å; Y504-R509 CarbonylContact O-C 3.6Å; Y504-R509 VanDerWaalsContact O-C 3.23Å; Y504-R509 WeakPolarHBondContact O-CA 3.46Å; Y504-R509 WeakPolarHBondContact O-CG 3.36Å; Y504-R509 PolarHBondContact O-N 2.81Å; Y504-R509 PolarHBondContact OH-NH1 2.86Å; E507-R509 VanDerWaalsContact C-N 3.27Å; E507-R509 HydrophobicContact CB-CG 4.09Å; E507-R509 PolarHBondContact O-N 2.68Å; E507-R509 IonicContact OE2-CZ 3.95Å; E507-R509 IonicContact OE2-NE 3.07Å; E507-R509 PolarHBondContact OE2-NE 2.75Å; E507-R509 IonicContact OE2-NH2 3.39Å; E507-R509 PolarHBondContact OE2-NH2 2.86Å; R509-A511 PolarHBondContact O-N 2.79Å; R509-A511 VanDerWaalsContact O-N 3.16Å; R509-R512 WeakPolarHBondContact O-CB 3.26Å; R509-R512 PolarHBondContact O-N 2.8Å
510	G	96.6	Very high	96.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-54.8	-34.7	-173.8	0	0	0	0	0	114.6	S443 Y504 R512 C513 G559	S443-G510 PolarHBondContact OG-N 3.14Å; Y504-G510 PolarHBondContact O-N 2.9Å; G510-R512 PolarHBondContact O-N 3.2Å; G510-C513 WeakPolarHBondContact O-CB 3.49Å; G510-C513 PolarHBondContact O-N 2.83Å; G510-G559 WeakPolarHBondContact O-CA 3.4Å; G510-G559 PolarHBondContact O-N 2.86Å
511	A	96.8	Very high	96.2	Very high	2 Å²	2	29.2 Å²	29.2	2%	0.017	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-65.9	-20.6	179.5	0	0	0	0	0	113.5	L434 E439 L442 S443 R509 C513 G558	L434-A511 HydrophobicContact CD1-CB 4.26Å; E439-A511 HydrophobicContact CG-CB 3.8Å; E439-A511 WeakPolarHBondContact O-CB 3.39Å; L442-A511 HydrophobicContact CB-CB 3.69Å; L442-A511 HydrophobicContact CD1-CB 4.49Å; S443-A511 VanDerWaalsContact OG-CB 3.24Å; S443-A511 WeakPolarHBondContact OG-CB 3.46Å; S443-A511 PolarHBondContact OG-N 2.9Å; R509-A511 PolarHBondContact O-N 2.79Å; R509-A511 VanDerWaalsContact O-N 3.16Å; A511-C513 VanDerWaalsContact C-N 3.33Å; A511-G558 WeakPolarHBondContact O-CA 3.43Å
512	R	96	Very high	95.8	Very high	144 Å²	144	32.3 Å²	32.3	54%	0.543	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-80.6	-12.1	174.8	-61	-171.2	179	169.8	11.3	113.3	E439 Y504 R509 G510 N514 S583	E439-R512 VanDerWaalsContact CD-NE 3.25Å; E439-R512 HydrophobicContact CG-CG 4.33Å; E439-R512 IonicContact OE1-CZ 2.93Å; E439-R512 IonicContact OE1-NE 3.87Å; E439-R512 PolarHBondContact OE1-NE 3.04Å; E439-R512 IonicContact OE1-NH2 2.91Å; E439-R512 PolarHBondContact OE1-NH2 3Å; E439-R512 IonicContact OE2-CZ 3.71Å; E439-R512 IonicContact OE2-NE 3.8Å; E439-R512 PolarHBondContact OE2-NE 2.95Å; E439-R512 IonicContact OE2-NH2 3.38Å; Y504-R512 HydrophobicContact CD1-CB 4.25Å; Y504-R512 HydrophobicContact CE1-CB 4.28Å; R509-R512 WeakPolarHBondContact O-CB 3.26Å; R509-R512 PolarHBondContact O-N 2.8Å; G510-R512 PolarHBondContact O-N 3.2Å; R512-N514 PolarHBondContact O-N 2.85Å; R512-S583 WeakPolarHBondContact O-CB 3.29Å
513	C	97.8	Very high	95.4	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.147	C	C	.	.			trans	-87.5	101.4	-178.6	-166.8	0	0	0	0	110.5	L501 Y504 G510 A511 G559 A560	L501-C513 HydrophobicContact CD1-CB 4.3Å; Y504-C513 HydrophobicContact CD1-CB 3.73Å; Y504-C513 HydrophobicContact CD2-CB 4.49Å; Y504-C513 HydrophobicContact CG-CB 3.7Å; G510-C513 WeakPolarHBondContact O-CB 3.49Å; G510-C513 PolarHBondContact O-N 2.83Å; A511-C513 VanDerWaalsContact C-N 3.33Å; C513-G559 CarbonylContact O-C 3.56Å; C513-G559 VanDerWaalsContact O-C 3.32Å; C513-G559 WeakPolarHBondContact O-CA 3.33Å; C513-G559 PolarHBondContact O-N 2.91Å; C513-A560 PolarHBondContact O-N 2.89Å
514	N	98.2	Very high	95.1	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.021	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	114	170.7	-57.1	-61	0	0	0	108	I426 R512 G558 A560 G581 S583 H584	I426-N514 HydrophobicContact CD1-CB 4.29Å; I426-N514 HydrophobicContact CG1-CB 4.13Å; R512-N514 PolarHBondContact O-N 2.85Å; N514-G558 PolarHBondContact OD1-N 3.5Å; N514-A560 WeakPolarHBondContact CA-O 3.29Å; N514-A560 HydrophobicContact CB-CB 4.49Å; N514-G581 WeakPolarHBondContact CB-O 3.42Å; N514-G581 PolarHBondContact ND2-O 3.37Å; N514-S583 PolarHBondContact N-OG 3.28Å; N514-S583 PolarHBondContact O-N 3.48Å; N514-S583 PolarHBondContact O-OG 2.76Å; N514-H584 PolarHBondContact O-N 3.34Å
515	V	98.6	Very high	94.9	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	129.1	-172.2	-172.2	0	0	0	0	109.2	I517 A560 L561 L562 H584 I586	V515-I517 HydrophobicContact CB-CD1 4.15Å; V515-I517 HydrophobicContact CG1-CD1 3.68Å; V515-I517 HydrophobicContact CG1-CG1 3.94Å; V515-A560 PolarHBondContact N-O 2.71Å; V515-L561 HydrophobicContact CB-CD2 3.69Å; V515-L561 HydrophobicContact CG1-CD2 4.49Å; V515-L561 HydrophobicContact CG2-CD2 3.71Å; V515-L562 PolarHBondContact O-N 3.13Å; V515-H584 WeakPolarHBondContact CA-O 3.31Å; V515-H584 HydrophobicContact CB-CB 4.42Å; V515-H584 HydrophobicContact CG1-CB 4Å; V515-H584 HydrophobicContact CG2-CB 4.12Å; V515-I586 HydrophobicContact CG1-CD1 3.8Å; V515-I586 HydrophobicContact CG1-CG1 3.89Å
516	I	98.7	Very high	94.7	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	126.7	168.4	-61	179.2	0	0	0	108.1	P425 I426 T518 L562 L569 V582 H584 V585 I586	P425-I516 HydrophobicContact CB-CD1 3.81Å; I426-I516 HydrophobicContact CD1-CD1 4.26Å; I426-I516 HydrophobicContact CD1-CG1 3.71Å; I516-T518 HydrophobicContact CG2-CG2 4.48Å; I516-L562 CarbonylContact C-O 3.51Å; I516-L562 WeakPolarHBondContact CA-O 3.37Å; I516-L569 HydrophobicContact CD1-CD1 4Å; I516-L569 HydrophobicContact CG2-CD1 4.24Å; I516-L569 HydrophobicContact CG2-CD2 4.24Å; I516-V582 HydrophobicContact CD1-CG1 4.24Å; I516-V582 HydrophobicContact CD1-CG2 3.75Å; I516-V582 HydrophobicContact CG1-CG1 4.17Å; I516-V582 HydrophobicContact CG1-CG2 4.33Å; I516-H584 PolarHBondContact N-O 3.01Å; I516-V585 CarbonylContact O-C 3.57Å; I516-V585 WeakPolarHBondContact O-CA 3.45Å; I516-I586 PolarHBondContact O-N 3.22Å
517	I	98.6	Very high	94.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	112.8	178.6	-52.7	89.4	0	0	0	108.1	P497 V515 L561 L562 F563 C564 I586	P497-I517 HydrophobicContact CB-CD1 4.19Å; P497-I517 HydrophobicContact CB-CG1 4.24Å; P497-I517 HydrophobicContact CG-CD1 4.4Å; P497-I517 HydrophobicContact CG-CG1 3.94Å; V515-I517 HydrophobicContact CB-CD1 4.15Å; V515-I517 HydrophobicContact CG1-CD1 3.68Å; V515-I517 HydrophobicContact CG1-CG1 3.94Å; I517-L561 HydrophobicContact CD1-CB 4.32Å; I517-L562 PolarHBondContact N-O 2.9Å; I517-F563 HydrophobicContact CB-CD1 3.71Å; I517-F563 HydrophobicContact CB-CE1 3.76Å; I517-F563 HydrophobicContact CB-CG 4.32Å; I517-F563 HydrophobicContact CB-CZ 4.41Å; I517-F563 HydrophobicContact CD1-CD2 4.43Å; I517-F563 HydrophobicContact CD1-CE1 4.29Å; I517-F563 HydrophobicContact CD1-CE2 4.16Å; I517-F563 HydrophobicContact CD1-CZ 4.08Å; I517-F563 HydrophobicContact CG1-CD1 4.42Å; I517-F563 HydrophobicContact CG1-CE1 4.06Å; I517-F563 HydrophobicContact CG1-CZ 4.25Å; I517-F563 HydrophobicContact CG2-CD1 3.78Å; I517-F563 HydrophobicContact CG2-CE1 3.64Å; I517-F563 CarbonylContact O-C 3.56Å; I517-F563 VanDerWaalsContact O-CA 3.3Å; I517-F563 WeakPolarHBondContact O-CA 3.1Å; I517-C564 PolarHBondContact O-N 3.47Å; I517-I586 CarbonylContact C-O 3.56Å; I517-I586 WeakPolarHBondContact CA-O 3.27Å; I517-I586 HydrophobicContact CB-CB 4.4Å; I517-I586 HydrophobicContact CG1-CB 4.13Å; I517-I586 HydrophobicContact CG1-CD1 4.01Å; I517-I586 HydrophobicContact CG1-CG1 4.32Å; I517-I586 HydrophobicContact CG2-CB 4.17Å; I517-I586 HydrophobicContact CG2-CG2 4.23Å
518	T	98.1	Very high	94.2	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	141.6	178.1	65.8	0	0	0	0	111.6	I516 C564 L569 I586 V587 D588 L600	I516-T518 HydrophobicContact CG2-CG2 4.48Å; T518-C564 CarbonylContact C-O 3.55Å; T518-C564 VanDerWaalsContact CA-O 3.26Å; T518-C564 WeakPolarHBondContact CA-O 3.45Å; T518-L569 HydrophobicContact CG2-CB 4Å; T518-L569 HydrophobicContact CG2-CD2 3.44Å; T518-L569 VanDerWaalsContact CG2-CD2 3.44Å; T518-L569 HydrophobicContact CG2-CG 4.37Å; T518-I586 PolarHBondContact N-O 3.37Å; T518-I586 PolarHBondContact OG1-O 2.98Å; T518-V587 WeakPolarHBondContact OG1-CA 3.36Å; T518-D588 VanDerWaalsContact O-CB 3.29Å; T518-D588 WeakPolarHBondContact O-CB 3.42Å; T518-D588 PolarHBondContact O-N 3.39Å; T518-L600 HydrophobicContact CG2-CD2 4.06Å
519	Q	95.4	Very high	94.1	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	139.5	171.9	-71.3	-70.6	-28.7	0	0	108.8	R521 A525 C564 T565 V566 D588 S766	Q519-R521 VanDerWaalsContact C-N 3.32Å; Q519-R521 PolarHBondContact O-N 3.38Å; Q519-A525 HydrophobicContact CB-CB 3.95Å; Q519-A525 HydrophobicContact CG-CB 4.32Å; Q519-C564 PolarHBondContact N-O 2.8Å; Q519-T565 VanDerWaalsContact O-CA 3.27Å; Q519-T565 WeakPolarHBondContact O-CA 2.95Å; Q519-V566 PolarHBondContact O-N 3.2Å; Q519-D588 PolarHBondContact NE2-OD2 3.32Å; Q519-S766 PolarHBondContact OE1-OG 3.14Å
520	P	91.4	Very high	94	Very high	24 Å²	24	20.9 Å²	20.9	16%	0.156	9%	0.091	C	C	.	.	S	Bend	trans	-66.5	-37.5	178.4	22.5	-30	0	0	0	111.3	E589 E592	P520-E589 HydrophobicContact CG-CB 3.86Å; P520-E589 HydrophobicContact CG-CG 4.32Å; P520-E592 VanDerWaalsContact CG-CD 3.47Å; P520-E592 HydrophobicContact CG-CG 4.49Å; P520-E592 WeakPolarHBondContact CG-OE1 3.48Å
521	R	88.9	Confident	93.6	Very high	65 Å²	65	26 Å²	26	25%	0.245	11%	0.111	C	C	.	.	S	Bend	trans	-105	141.3	-174.7	-55	-175.8	-168.4	-89.4	-11.2	112.6	Q519 I523 S524 A525 E592 T765	Q519-R521 VanDerWaalsContact C-N 3.32Å; Q519-R521 PolarHBondContact O-N 3.38Å; R521-I523 VanDerWaalsContact C-N 3.34Å; R521-I523 HydrophobicContact CB-CG2 4.23Å; R521-I523 PolarHBondContact O-N 2.78Å; R521-S524 PolarHBondContact O-N 3.5Å; R521-A525 PolarHBondContact O-N 3.23Å; R521-A525 VanDerWaalsContact O-N 3.09Å; R521-E592 IonicContact CZ-OE2 2.75Å; R521-E592 IonicContact NE-OE2 3.83Å; R521-E592 PolarHBondContact NE-OE2 2.83Å; R521-E592 IonicContact NH2-OE2 2.88Å; R521-E592 PolarHBondContact NH2-OE2 2.93Å; R521-T765 WeakPolarHBondContact CD-OG1 3.15Å; R521-T765 PolarHBondContact NE-OG1 3.35Å
522	R	88.8	Confident	93.5	Very high	65 Å²	65	26 Å²	26	25%	0.245	11%	0.11	C	C	.	.	H	α-helix	trans	-57.9	-44.2	176.8	-67	176.8	65.7	-153.4	0.8	112.2	S524 A525 V526 V548 R549 T565	R522-S524 VanDerWaalsContact C-N 3.34Å; R522-S524 PolarHBondContact O-N 3.08Å; R522-A525 PolarHBondContact O-N 2.93Å; R522-V526 WeakPolarHBondContact O-CG2 3.44Å; R522-V526 PolarHBondContact O-N 2.9Å; R522-V526 VanDerWaalsContact O-N 3.13Å; R522-V548 HydrophobicContact CB-CB 4.46Å; R522-V548 HydrophobicContact CB-CG1 4.47Å; R522-V548 HydrophobicContact CG-CB 4.19Å; R522-R549 PolarHBondContact NE-O 2.99Å; R522-R549 PolarHBondContact NH2-O 3.03Å; R522-T565 HydrophobicContact CB-CG2 4.41Å; R522-T565 HydrophobicContact CG-CG2 3.76Å
523	I	86	Confident	93.4	Very high	4 Å²	4	20.4 Å²	20.4	2%	0.021	9%	0.094	C	C	.	.	H	α-helix	trans	-61.6	-41.9	179.7	-176.8	155.9	0	0	0	112.2	R521 V526 S527 M739 Q742 I745 F746 I762 I767	R521-I523 VanDerWaalsContact C-N 3.34Å; R521-I523 HydrophobicContact CB-CG2 4.23Å; R521-I523 PolarHBondContact O-N 2.78Å; I523-V526 PolarHBondContact O-N 3.49Å; I523-S527 VanDerWaalsContact O-CB 3.3Å; I523-S527 WeakPolarHBondContact O-CB 3.29Å; I523-S527 PolarHBondContact O-N 2.89Å; I523-S527 PolarHBondContact O-OG 3.23Å; I523-M739 VanDerWaalsContact CA-CE 3.41Å; I523-M739 HydrophobicContact CB-CE 3.56Å; I523-M739 HydrophobicContact CB-SD 3.83Å; I523-M739 HydrophobicContact CD1-CE 4.26Å; I523-M739 HydrophobicContact CG1-CE 3.84Å; I523-Q742 HydrophobicContact CD1-CB 3.63Å; I523-Q742 VanDerWaalsContact CD1-OE1 3.3Å; I523-I745 HydrophobicContact CD1-CD1 4.38Å; I523-F746 HydrophobicContact CD1-CE2 4.04Å; I523-F746 HydrophobicContact CD1-CZ 4.19Å; I523-F746 HydrophobicContact CG1-CE2 4.2Å; I523-F746 HydrophobicContact CG1-CZ 4.16Å; I523-I762 HydrophobicContact CG2-CG1 4.42Å; I523-I767 HydrophobicContact CD1-CD1 4.01Å; I523-I767 HydrophobicContact CG1-CD1 4.1Å; I523-I767 HydrophobicContact CG1-CG1 4.43Å; I523-I767 HydrophobicContact CG2-CD1 3.64Å; I523-I767 HydrophobicContact CG2-CG1 4.2Å
524	S	89.7	Confident	93	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.8	-46.9	176.6	-52.7	0	0	0	0	111.5	R521 R522 V526 S527 V528	R521-S524 PolarHBondContact O-N 3.5Å; R522-S524 VanDerWaalsContact C-N 3.34Å; R522-S524 PolarHBondContact O-N 3.08Å; S524-V526 VanDerWaalsContact C-N 3.33Å; S524-V526 PolarHBondContact O-N 3.37Å; S524-S527 PolarHBondContact O-N 2.93Å; S524-S527 PolarHBondContact O-OG 3.48Å; S524-V528 VanDerWaalsContact O-CB 3.22Å; S524-V528 WeakPolarHBondContact O-CB 3.37Å; S524-V528 WeakPolarHBondContact O-CG2 3.41Å; S524-V528 PolarHBondContact O-N 3.34Å
525	A	93.2	Very high	92.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-55.6	-46.7	176.8	0	0	0	0	0	112.4	Q519 R521 R522 A529 V548	Q519-A525 HydrophobicContact CB-CB 3.95Å; Q519-A525 HydrophobicContact CG-CB 4.32Å; R521-A525 PolarHBondContact O-N 3.23Å; R521-A525 VanDerWaalsContact O-N 3.09Å; R522-A525 PolarHBondContact O-N 2.93Å; A525-A529 VanDerWaalsContact O-CB 3.24Å; A525-A529 WeakPolarHBondContact O-CB 3.37Å; A525-A529 PolarHBondContact O-N 3.24Å; A525-V548 HydrophobicContact CB-CG1 3.63Å
526	V	91.7	Very high	92.2	Very high	3 Å²	3	28.7 Å²	28.7	2%	0.018	13%	0.132	C	C	.	.	H	α-helix	trans	-71.8	-48.1	-177.7	177.8	0	0	0	0	111.4	R522 I523 S524 A529 Q530 F546 V548	R522-V526 WeakPolarHBondContact O-CG2 3.44Å; R522-V526 PolarHBondContact O-N 2.9Å; R522-V526 VanDerWaalsContact O-N 3.13Å; I523-V526 PolarHBondContact O-N 3.49Å; S524-V526 VanDerWaalsContact C-N 3.33Å; S524-V526 PolarHBondContact O-N 3.37Å; V526-A529 PolarHBondContact O-N 3.49Å; V526-Q530 VanDerWaalsContact O-CG 3.29Å; V526-Q530 WeakPolarHBondContact O-CG 3.15Å; V526-Q530 PolarHBondContact O-N 3.5Å; V526-F546 HydrophobicContact CG1-CE1 4.3Å; V526-F546 HydrophobicContact CG1-CE2 4.44Å; V526-F546 HydrophobicContact CG1-CZ 4.18Å; V526-F546 HydrophobicContact CG2-CD2 3.77Å; V526-F546 HydrophobicContact CG2-CE2 3.76Å; V526-F546 HydrophobicContact CG2-CG 4.34Å; V526-F546 HydrophobicContact CG2-CZ 4.33Å; V526-V548 HydrophobicContact CG2-CG1 4.17Å; V526-V548 HydrophobicContact CG2-CG2 4.11Å
527	S	88.4	Confident	91.8	Very high	17 Å²	17	29.4 Å²	29.4	12%	0.119	14%	0.139	C	C	.	.	H	α-helix	trans	-67.4	-42	-175.2	65.9	0	0	0	0	111.8	I523 S524 Q530 R531	I523-S527 VanDerWaalsContact O-CB 3.3Å; I523-S527 WeakPolarHBondContact O-CB 3.29Å; I523-S527 PolarHBondContact O-N 2.89Å; I523-S527 PolarHBondContact O-OG 3.23Å; S524-S527 PolarHBondContact O-N 2.93Å; S524-S527 PolarHBondContact O-OG 3.48Å; S527-Q530 PolarHBondContact O-N 2.91Å; S527-R531 WeakPolarHBondContact O-CB 3.49Å; S527-R531 PolarHBondContact O-N 3.41Å
528	V	92.3	Very high	91.4	Very high	8 Å²	8	34.8 Å²	34.8	5%	0.048	17%	0.174	C	C	.	.	H	α-helix	trans	-65.2	-45	177.1	175.1	0	0	0	0	110.5	T493 S524 Q530 R531 V532 F563	T493-V528 HydrophobicContact CG2-CB 4.23Å; T493-V528 HydrophobicContact CG2-CG1 3.52Å; T493-V528 HydrophobicContact CG2-CG2 3.68Å; S524-V528 VanDerWaalsContact O-CB 3.22Å; S524-V528 WeakPolarHBondContact O-CB 3.37Å; S524-V528 WeakPolarHBondContact O-CG2 3.41Å; S524-V528 PolarHBondContact O-N 3.34Å; V528-Q530 VanDerWaalsContact C-N 3.31Å; V528-Q530 PolarHBondContact O-N 3.12Å; V528-R531 WeakPolarHBondContact O-CB 3.24Å; V528-R531 PolarHBondContact O-N 3.19Å; V528-R531 VanDerWaalsContact O-N 3.15Å; V528-V532 HydrophobicContact CG1-CG2 4.14Å; V528-V532 WeakPolarHBondContact O-CG2 3.42Å; V528-V532 PolarHBondContact O-N 3.5Å; V528-F563 HydrophobicContact CB-CD1 4.28Å; V528-F563 HydrophobicContact CB-CE1 4.26Å; V528-F563 HydrophobicContact CG1-CD1 3.76Å; V528-F563 HydrophobicContact CG1-CE1 3.27Å; V528-F563 HydrophobicContact CG1-CZ 3.82Å
529	A	95.4	Very high	91	Very high	3 Å²	3	36.6 Å²	36.6	3%	0.025	19%	0.187	C	C	.	.	H	α-helix	trans	-58.6	-43.8	177.2	0	0	0	0	0	112.1	A525 V526 S533 V544 F546 F563	A525-A529 VanDerWaalsContact O-CB 3.24Å; A525-A529 WeakPolarHBondContact O-CB 3.37Å; A525-A529 PolarHBondContact O-N 3.24Å; V526-A529 PolarHBondContact O-N 3.49Å; A529-S533 WeakPolarHBondContact O-CB 3.43Å; A529-S533 PolarHBondContact O-N 3.26Å; A529-V544 HydrophobicContact CB-CG1 4.28Å; A529-V544 WeakPolarHBondContact O-CG1 3.33Å; A529-F546 HydrophobicContact CB-CB 3.76Å; A529-F546 HydrophobicContact CB-CD1 4.14Å; A529-F546 HydrophobicContact CB-CG 4.38Å; A529-F563 HydrophobicContact CB-CB 3.87Å; A529-F563 HydrophobicContact CB-CD2 3.69Å; A529-F563 HydrophobicContact CB-CG 3.91Å
530	Q	92.5	Very high	90.9	Very high	99 Å²	99	36.6 Å²	36.6	46%	0.463	19%	0.187	S	C	.	.	H	α-helix	trans	-63.5	-42.4	176.3	-72.4	177.8	-29.6	0	0	111.7	V526 S527 V528 S533 H534	V526-Q530 VanDerWaalsContact O-CG 3.29Å; V526-Q530 WeakPolarHBondContact O-CG 3.15Å; V526-Q530 PolarHBondContact O-N 3.5Å; S527-Q530 PolarHBondContact O-N 2.91Å; V528-Q530 VanDerWaalsContact C-N 3.31Å; V528-Q530 PolarHBondContact O-N 3.12Å; Q530-S533 PolarHBondContact O-N 3.07Å; Q530-H534 WeakPolarHBondContact O-CB 3.27Å; Q530-H534 PolarHBondContact O-N 3.42Å
531	R	89.2	Confident	91	Very high	109 Å²	109	42.4 Å²	42.4	41%	0.411	21%	0.206	S	C	.	.	H	α-helix	trans	-62.5	-49.4	177.4	179	61.2	-176.7	-133.8	-2.9	111.7	T494 S527 V528 S533 H534 E535	T494-R531 HydrophobicContact CG2-CG 4.07Å; S527-R531 WeakPolarHBondContact O-CB 3.49Å; S527-R531 PolarHBondContact O-N 3.41Å; V528-R531 WeakPolarHBondContact O-CB 3.24Å; V528-R531 PolarHBondContact O-N 3.19Å; V528-R531 VanDerWaalsContact O-N 3.15Å; R531-S533 VanDerWaalsContact C-N 3.35Å; R531-H534 WeakPolarHBondContact O-CB 3.45Å; R531-H534 PolarHBondContact O-N 2.66Å; R531-E535 IonicContact CZ-OE1 3.95Å; R531-E535 IonicContact NE-OE1 3.17Å; R531-E535 PolarHBondContact NE-OE1 3.42Å; R531-E535 IonicContact NH2-OE1 3.2Å; R531-E535 PolarHBondContact NH2-OE1 3.2Å; R531-E535 VanDerWaalsContact NH2-OE1 3.16Å; R531-E535 WeakPolarHBondContact O-CG 3.49Å; R531-E535 PolarHBondContact O-N 3.1Å
532	V	93.8	Very high	91.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.5	-39	178.8	175.1	0	0	0	0	111.3	T494 Q498 V528 H534 E535 L536 V544 L561 F563	T494-V532 HydrophobicContact CG2-CG2 4.16Å; Q498-V532 HydrophobicContact CG-CG1 3.76Å; V528-V532 HydrophobicContact CG1-CG2 4.14Å; V528-V532 WeakPolarHBondContact O-CG2 3.42Å; V528-V532 PolarHBondContact O-N 3.5Å; V532-H534 VanDerWaalsContact C-N 3.3Å; V532-H534 PolarHBondContact O-N 2.8Å; V532-E535 PolarHBondContact O-N 3.48Å; V532-L536 HydrophobicContact CG1-CD1 4.29Å; V532-L536 HydrophobicContact CG1-CG 4.47Å; V532-L536 WeakPolarHBondContact O-CB 3.42Å; V532-L536 WeakPolarHBondContact O-CG 3.32Å; V532-L536 PolarHBondContact O-N 3.25Å; V532-V544 HydrophobicContact CB-CG1 4.44Å; V532-V544 HydrophobicContact CG1-CG1 4.4Å; V532-V544 HydrophobicContact CG1-CG2 4.06Å; V532-L561 HydrophobicContact CG1-CD1 4.19Å; V532-F563 HydrophobicContact CB-CE2 4.18Å; V532-F563 HydrophobicContact CB-CZ 4.26Å; V532-F563 HydrophobicContact CG1-CE2 4.29Å; V532-F563 HydrophobicContact CG1-CZ 4.44Å; V532-F563 HydrophobicContact CG2-CE2 4.31Å; V532-F563 HydrophobicContact CG2-CZ 3.88Å
533	S	94	Very high	91.7	Very high	28 Å²	28	47.1 Å²	47.1	20%	0.196	23%	0.225	C	C	.	.	H	α-helix	trans	-59	-41	173	-174	0	0	0	0	111.9	A529 Q530 R531 R541	A529-S533 WeakPolarHBondContact O-CB 3.43Å; A529-S533 PolarHBondContact O-N 3.26Å; Q530-S533 PolarHBondContact O-N 3.07Å; R531-S533 VanDerWaalsContact C-N 3.35Å; S533-R541 VanDerWaalsContact O-CB 3.26Å; S533-R541 WeakPolarHBondContact O-CB 3.25Å; S533-R541 WeakPolarHBondContact OG-CB 3.38Å; S533-R541 PolarHBondContact OG-O 3.12Å
534	H	90.6	Very high	92.3	Very high	152 Å²	152	47.5 Å²	47.5	70%	0.704	23%	0.228	S	C	*	.	H	α-helix	trans	-68.4	-45.8	174.1	-179.3	-82.9	0	0	0	112.3	Q530 R531 V532 L536 G537	Q530-H534 WeakPolarHBondContact O-CB 3.27Å; Q530-H534 PolarHBondContact O-N 3.42Å; R531-H534 WeakPolarHBondContact O-CB 3.45Å; R531-H534 PolarHBondContact O-N 2.66Å; V532-H534 VanDerWaalsContact C-N 3.3Å; V532-H534 PolarHBondContact O-N 2.8Å; H534-L536 VanDerWaalsContact C-N 3.34Å; H534-L536 PolarHBondContact O-N 3.26Å; H534-G537 PolarHBondContact O-N 2.92Å
535	E	89.5	Confident	92.6	Very high	26 Å²	26	47.8 Å²	47.8	12%	0.121	23%	0.23	C	C	.	.	H	α-helix	trans	-63.5	-34.6	179.7	-73.9	-176.6	-170.7	0	0	113.4	R453 R495 Q498 R531 V532 G537	R453-E535 PolarHBondContact NH2-O 3.36Å; R495-E535 IonicContact CZ-OE2 3.28Å; R495-E535 IonicContact NH1-OE2 2.63Å; R495-E535 PolarHBondContact NH1-OE2 3.4Å; Q498-E535 PolarHBondContact NE2-OE2 3.07Å; R531-E535 IonicContact CZ-OE1 3.95Å; R531-E535 IonicContact NE-OE1 3.17Å; R531-E535 PolarHBondContact NE-OE1 3.42Å; R531-E535 IonicContact NH2-OE1 3.2Å; R531-E535 PolarHBondContact NH2-OE1 3.2Å; R531-E535 VanDerWaalsContact NH2-OE1 3.16Å; R531-E535 WeakPolarHBondContact O-CG 3.49Å; R531-E535 PolarHBondContact O-N 3.1Å; V532-E535 PolarHBondContact O-N 3.48Å; E535-G537 PolarHBondContact O-N 3.14Å
536	L	90.9	Very high	92.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-16.5	174.1	-77.3	178.9	0	0	0	113.4	W450 R453 Q498 L501 V532 H534 L540 V544 L561	W450-L536 HydrophobicContact CZ3-CD2 4.09Å; R453-L536 PolarHBondContact NE-O 2.89Å; Q498-L536 HydrophobicContact CB-CD2 4.26Å; Q498-L536 HydrophobicContact CG-CD2 3.84Å; Q498-L536 HydrophobicContact CG-CG 4.03Å; L501-L536 HydrophobicContact CD2-CD1 4.09Å; V532-L536 HydrophobicContact CG1-CD1 4.29Å; V532-L536 HydrophobicContact CG1-CG 4.47Å; V532-L536 WeakPolarHBondContact O-CB 3.42Å; V532-L536 WeakPolarHBondContact O-CG 3.32Å; V532-L536 PolarHBondContact O-N 3.25Å; H534-L536 VanDerWaalsContact C-N 3.34Å; H534-L536 PolarHBondContact O-N 3.26Å; L536-L540 HydrophobicContact CB-CB 4.03Å; L536-V544 HydrophobicContact CD1-CG2 3.45Å; L536-V544 VanDerWaalsContact CD1-CG2 3.45Å; L536-L561 HydrophobicContact CD1-CD1 4.07Å
537	G	89.3	Confident	93.1	Very high	15 Å²	15	50.2 Å²	50.2	16%	0.155	24%	0.241	C	C	.	.			trans	78.9	172.7	176.2	0	0	0	0	0	114.5	H534 E535 S539 L540 R541	H534-G537 PolarHBondContact O-N 2.92Å; E535-G537 PolarHBondContact O-N 3.14Å; G537-S539 VanDerWaalsContact C-N 3.27Å; G537-S539 PolarHBondContact O-N 2.88Å; G537-S539 VanDerWaalsContact O-N 3.11Å; G537-L540 PolarHBondContact O-N 3.3Å; G537-R541 WeakPolarHBondContact O-CB 3.29Å; G537-R541 PolarHBondContact O-N 3.13Å
538	P	89.3	Confident	93.2	Very high	113 Å²	113	49.6 Å²	49.6	73%	0.734	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-34.2	-169.2	-27.4	34.9	0	0	0	115.5
539	S	90.9	Very high	92.9	Very high	38 Å²	38	52.6 Å²	52.6	27%	0.266	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-34.2	-177.2	-54.7	0	0	0	0	113.4	L449 G537	L449-S539 WeakPolarHBondContact O-CB 3.05Å; G537-S539 VanDerWaalsContact C-N 3.27Å; G537-S539 PolarHBondContact O-N 2.88Å; G537-S539 VanDerWaalsContact O-N 3.11Å
540	L	93.6	Very high	92.2	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-3.8	-173.6	-73.2	167.2	0	0	0	113.4	L446 L449 W450 L536 G537 R542 N543	L446-L540 HydrophobicContact CD2-CD2 4.17Å; L449-L540 HydrophobicContact CB-CD2 3.88Å; L449-L540 HydrophobicContact CB-CG 4.23Å; L449-L540 HydrophobicContact CD1-CD2 4.41Å; W450-L540 HydrophobicContact CB-CD1 4.43Å; W450-L540 HydrophobicContact CD2-CD1 4.24Å; W450-L540 HydrophobicContact CE3-CD1 3.36Å; W450-L540 HydrophobicContact CZ3-CD1 3.89Å; L536-L540 HydrophobicContact CB-CB 4.03Å; G537-L540 PolarHBondContact O-N 3.3Å; L540-R542 PolarHBondContact O-N 3.4Å; L540-N543 VanDerWaalsContact O-CB 3.24Å; L540-N543 WeakPolarHBondContact O-CB 3.29Å; L540-N543 PolarHBondContact O-N 3.49Å; L540-N543 PolarHBondContact O-OD1 3.04Å
541	R	93.1	Very high	91.9	Very high	145 Å²	145	54.4 Å²	54.4	55%	0.547	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-54.3	-25.9	-178.9	78.7	178.5	-150.8	-179.1	3.8	114.4	S533 G537 N543 V544	S533-R541 VanDerWaalsContact O-CB 3.26Å; S533-R541 WeakPolarHBondContact O-CB 3.25Å; S533-R541 WeakPolarHBondContact OG-CB 3.38Å; S533-R541 PolarHBondContact OG-O 3.12Å; G537-R541 WeakPolarHBondContact O-CB 3.29Å; G537-R541 PolarHBondContact O-N 3.13Å; R541-N543 VanDerWaalsContact C-N 3.32Å; R541-V544 PolarHBondContact O-N 2.83Å
542	R	95	Very high	92	Very high	208 Å²	208	52.5 Å²	52.5	79%	0.785	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-77.1	-16	179.8	-64.3	-176.8	179.9	-175.8	-0.2	113.4	L540	L540-R542 PolarHBondContact O-N 3.4Å
543	N	97.1	Very high	92	Very high	21 Å²	21	59.2 Å²	59.2	11%	0.112	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-78.4	-11.3	175.2	-67.8	77.4	0	0	0	112.4	L446 L540 R541 P555 G559 L561	L446-N543 VanDerWaalsContact CD2-ND2 3.32Å; L446-N543 WeakPolarHBondContact CD2-ND2 3.28Å; L540-N543 VanDerWaalsContact O-CB 3.24Å; L540-N543 WeakPolarHBondContact O-CB 3.29Å; L540-N543 PolarHBondContact O-N 3.49Å; L540-N543 PolarHBondContact O-OD1 3.04Å; R541-N543 VanDerWaalsContact C-N 3.32Å; N543-P555 VanDerWaalsContact O-CB 3.29Å; N543-P555 WeakPolarHBondContact O-CB 3.43Å; N543-G559 VanDerWaalsContact CB-O 3.27Å; N543-G559 WeakPolarHBondContact CB-O 3.34Å; N543-G559 PolarHBondContact ND2-O 3.14Å; N543-L561 PolarHBondContact O-N 3.21Å
544	V	98.2	Very high	92.1	Very high	13 Å²	13	60.1 Å²	60.1	8%	0.079	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	131.3	175.6	-169.5	0	0	0	0	109.1	A529 V532 L536 R541 L561 F563	A529-V544 HydrophobicContact CB-CG1 4.28Å; A529-V544 WeakPolarHBondContact O-CG1 3.33Å; V532-V544 HydrophobicContact CB-CG1 4.44Å; V532-V544 HydrophobicContact CG1-CG1 4.4Å; V532-V544 HydrophobicContact CG1-CG2 4.06Å; L536-V544 HydrophobicContact CD1-CG2 3.45Å; L536-V544 VanDerWaalsContact CD1-CG2 3.45Å; R541-V544 PolarHBondContact O-N 2.83Å; V544-L561 WeakPolarHBondContact CA-O 3.4Å; V544-L561 HydrophobicContact CG2-CB 4.34Å; V544-L561 HydrophobicContact CG2-CD1 4.23Å; V544-F563 HydrophobicContact CG1-CD2 3.93Å; V544-F563 HydrophobicContact CG1-CE2 3.83Å
545	G	97.5	Very high	92.4	Very high	5 Å²	5	53.2 Å²	53.2	5%	0.052	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	177	171	0	0	0	0	0	111.6	K553 L561 F563	G545-K553 CarbonylContact C-O 3.58Å; G545-K553 WeakPolarHBondContact CA-O 3.3Å; G545-L561 PolarHBondContact N-O 3.34Å; G545-F563 PolarHBondContact O-N 3.33Å
546	F	97.1	Very high	92.6	Very high	13 Å²	13	55.5 Å²	55.5	6%	0.057	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	156.9	174.1	68.3	-92.2	0	0	0	112.2	V526 A529 V548 E551 K553 F563	V526-F546 HydrophobicContact CG1-CE1 4.3Å; V526-F546 HydrophobicContact CG1-CE2 4.44Å; V526-F546 HydrophobicContact CG1-CZ 4.18Å; V526-F546 HydrophobicContact CG2-CD2 3.77Å; V526-F546 HydrophobicContact CG2-CE2 3.76Å; V526-F546 HydrophobicContact CG2-CG 4.34Å; V526-F546 HydrophobicContact CG2-CZ 4.33Å; A529-F546 HydrophobicContact CB-CB 3.76Å; A529-F546 HydrophobicContact CB-CD1 4.14Å; A529-F546 HydrophobicContact CB-CG 4.38Å; F546-V548 HydrophobicContact CD2-CG2 4.47Å; F546-E551 HydrophobicContact CE2-CB 4.06Å; F546-K553 HydrophobicContact CD1-CB 4.42Å; F546-K553 HydrophobicContact CE1-CB 4.12Å; F546-K553 HydrophobicContact CE1-CD 3.91Å; F546-K553 HydrophobicContact CE1-CG 4.28Å; F546-K553 HydrophobicContact CZ-CB 4.3Å; F546-K553 HydrophobicContact CZ-CD 3.9Å; F546-K553 HydrophobicContact CZ-CG 4.11Å; F546-K553 PolarHBondContact N-O 2.88Å; F546-K553 CarbonylContact O-C 3.01Å; F546-K553 VanDerWaalsContact O-C 3.26Å; F546-K553 PolarHBondContact O-N 3.02Å; F546-F563 CarbonylContact C-O 3.55Å; F546-F563 WeakPolarHBondContact CA-O 3.07Å; F546-F563 HydrophobicContact CB-CB 4.28Å; F546-F563 WeakPolarHBondContact CB-O 3.34Å
547	Q	96.6	Very high	92.7	Very high	41 Å²	41	57.6 Å²	57.6	19%	0.192	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	117.7	171.9	-170.5	175.2	4.2	0	0	110.4	L562 F563 C564 T565 I568	Q547-L562 HydrophobicContact CB-CD1 4.1Å; Q547-F563 PolarHBondContact N-O 3.24Å; Q547-C564 HydrophobicContact CB-CB 4.34Å; Q547-C564 WeakPolarHBondContact O-CA 3.39Å; Q547-C564 WeakPolarHBondContact O-CB 3.27Å; Q547-T565 PolarHBondContact O-N 3.11Å; Q547-I568 HydrophobicContact CB-CG2 4.12Å; Q547-I568 HydrophobicContact CG-CD1 4.32Å; Q547-I568 HydrophobicContact CG-CG1 4.5Å; Q547-I568 HydrophobicContact CG-CG2 3.81Å
548	V	92.5	Very high	92.8	Very high	5 Å²	5	57.1 Å²	57.1	3%	0.03	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	169.7	176	-58.3	0	0	0	0	109.3	R522 A525 V526 F546 L550 E551 T565	R522-V548 HydrophobicContact CB-CB 4.46Å; R522-V548 HydrophobicContact CB-CG1 4.47Å; R522-V548 HydrophobicContact CG-CB 4.19Å; A525-V548 HydrophobicContact CB-CG1 3.63Å; V526-V548 HydrophobicContact CG2-CG1 4.17Å; V526-V548 HydrophobicContact CG2-CG2 4.11Å; F546-V548 HydrophobicContact CD2-CG2 4.47Å; V548-L550 PolarHBondContact O-N 3.35Å; V548-E551 HydrophobicContact CG2-CB 3.82Å; V548-E551 PolarHBondContact N-O 3.3Å; V548-E551 CarbonylContact O-C 3.54Å; V548-E551 PolarHBondContact O-N 3.21Å; V548-E551 VanDerWaalsContact O-N 3.13Å; V548-T565 HydrophobicContact CB-CG2 4.36Å; V548-T565 HydrophobicContact CG1-CG2 3.99Å
549	R	84.4	Confident	93.2	Very high	71 Å²	71	51.7 Å²	51.7	27%	0.268	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	130.7	175.2	-162.6	177.6	177.7	152.2	1.4	110.2	R522 E551 S907 Q1010	R522-R549 PolarHBondContact NE-O 2.99Å; R522-R549 PolarHBondContact NH2-O 3.03Å; R549-E551 PolarHBondContact O-N 2.61Å; R549-E551 VanDerWaalsContact O-N 3.14Å; R549-S907 PolarHBondContact NH2-O 2.87Å; R549-Q1010 VanDerWaalsContact CG-OE1 3.25Å
550	L	81.4	Confident	93.5	Very high	70 Å²	70	49.9 Å²	49.9	37%	0.366	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	-3.6	-178.1	-52.6	177.6	0	0	0	117.4	V548 F1003 G1006 L1007 Q1010	V548-L550 PolarHBondContact O-N 3.35Å; L550-F1003 HydrophobicContact CD1-CD2 3.92Å; L550-F1003 HydrophobicContact CD1-CE2 3.76Å; L550-F1003 HydrophobicContact CD1-CZ 4.47Å; L550-G1006 WeakPolarHBondContact CD2-O 3.4Å; L550-L1007 HydrophobicContact CD1-CD2 4.46Å; L550-Q1010 HydrophobicContact CD2-CB 3.74Å; L550-Q1010 HydrophobicContact CD2-CG 4.38Å
551	E	85.6	Confident	93.7	Very high	69 Å²	69	49.9 Å²	49.9	32%	0.322	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	121.5	177.5	-68.8	-176.3	-140.2	0	0	111	F546 V548 R549	F546-E551 HydrophobicContact CE2-CB 4.06Å; V548-E551 HydrophobicContact CG2-CB 3.82Å; V548-E551 PolarHBondContact N-O 3.3Å; V548-E551 CarbonylContact O-C 3.54Å; V548-E551 PolarHBondContact O-N 3.21Å; V548-E551 VanDerWaalsContact O-N 3.13Å; R549-E551 PolarHBondContact O-N 2.61Å; R549-E551 VanDerWaalsContact O-N 3.14Å
552	S	91.7	Very high	94	Very high	69 Å²	69	43 Å²	43	48%	0.483	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	121.9	-176.7	-169.4	0	0	0	0	110.6	P554	S552-P554 WeakPolarHBondContact OG-CD 3.44Å
553	K	95	Very high	94.1	Very high	141 Å²	141	33.1 Å²	33.1	61%	0.613	18%	0.179	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140.5	64.9	172.3	-63.1	-172.6	-176.3	179.2	0	109.2	G545 F546	G545-K553 CarbonylContact C-O 3.58Å; G545-K553 WeakPolarHBondContact CA-O 3.3Å; F546-K553 HydrophobicContact CD1-CB 4.42Å; F546-K553 HydrophobicContact CE1-CB 4.12Å; F546-K553 HydrophobicContact CE1-CD 3.91Å; F546-K553 HydrophobicContact CE1-CG 4.28Å; F546-K553 HydrophobicContact CZ-CB 4.3Å; F546-K553 HydrophobicContact CZ-CD 3.9Å; F546-K553 HydrophobicContact CZ-CG 4.11Å; F546-K553 PolarHBondContact N-O 2.88Å; F546-K553 CarbonylContact O-C 3.01Å; F546-K553 VanDerWaalsContact O-C 3.26Å; F546-K553 PolarHBondContact O-N 3.02Å
554	P	95.8	Very high	94.2	Very high	48 Å²	48	32.1 Å²	32.1	31%	0.312	17%	0.174	S	C	.	.	P	Polyproline II helix	trans	-69.6	149.4	-179.2	30.1	-34.7	0	0	0	110.9	I426 S552 L562	I426-P554 VanDerWaalsContact O-CB 3.28Å; I426-P554 WeakPolarHBondContact O-CB 3.41Å; S552-P554 WeakPolarHBondContact OG-CD 3.44Å; P554-L562 HydrophobicContact CB-CD1 4.25Å
555	P	96.3	Very high	94.1	Very high	7 Å²	7	32.3 Å²	32.3	5%	0.045	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-74.3	168.2	171	35	-33.9	0	0	0	110.7	I426 N543 A560	I426-P555 HydrophobicContact CG2-CG 3.91Å; N543-P555 VanDerWaalsContact O-CB 3.29Å; N543-P555 WeakPolarHBondContact O-CB 3.43Å; P555-A560 HydrophobicContact CB-CB 4.48Å; P555-A560 HydrophobicContact CG-CB 3.88Å
556	A	93.7	Very high	94	Very high	74 Å²	74	32.3 Å²	32.3	61%	0.612	17%	0.174	S	C	*	.	P	Polyproline II helix	trans	-70.9	150.9	166.2	0	0	0	0	0	110.4	A560	A556-A560 WeakPolarHBondContact O-CB 3.33Å
557	R	91.9	Very high	93.9	Very high	43 Å²	43	33.5 Å²	33.5	16%	0.162	19%	0.19	C	C	.	.	S	Bend	trans	-69.3	148.6	174.6	-176.4	175.1	171.6	-158.7	-0	111.1	D424 T427 Y431 M432	D424-R557 WeakPolarHBondContact OD2-CD 3.38Å; T427-R557 HydrophobicContact CG2-CB 4.29Å; Y431-R557 VanDerWaalsContact CD2-NH1 3.34Å; Y431-R557 PolarHBondContact OH-NH2 3.47Å; Y431-R557 VanDerWaalsContact OH-NH2 3.14Å; M432-R557 PolarHBondContact O-NH1 3.36Å
558	G	92.5	Very high	93.8	Very high	5 Å²	5	32.7 Å²	32.7	5%	0.052	19%	0.187	C	C	.	.	S	Bend	trans	99.9	81.6	179.6	0	0	0	0	0	111.3	A511 N514	A511-G558 WeakPolarHBondContact O-CA 3.43Å; N514-G558 PolarHBondContact OD1-N 3.5Å
559	G	96.5	Very high	94	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.185	C	C	.	.	S	Bend	trans	86.8	43.1	-171.5	0	0	0	0	0	112.1	G510 C513 N543	G510-G559 WeakPolarHBondContact O-CA 3.4Å; G510-G559 PolarHBondContact O-N 2.86Å; C513-G559 CarbonylContact O-C 3.56Å; C513-G559 VanDerWaalsContact O-C 3.32Å; C513-G559 WeakPolarHBondContact O-CA 3.33Å; C513-G559 PolarHBondContact O-N 2.91Å; N543-G559 VanDerWaalsContact CB-O 3.27Å; N543-G559 WeakPolarHBondContact CB-O 3.34Å; N543-G559 PolarHBondContact ND2-O 3.14Å
560	A	97.8	Very high	94.5	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	134.6	-169.5	0	0	0	0	0	113.1	I426 C513 N514 V515 P555 A556	I426-A560 HydrophobicContact CD1-CB 4.45Å; I426-A560 HydrophobicContact CG1-CB 4.36Å; I426-A560 HydrophobicContact CG2-CB 3.81Å; C513-A560 PolarHBondContact O-N 2.89Å; N514-A560 WeakPolarHBondContact CA-O 3.29Å; N514-A560 HydrophobicContact CB-CB 4.49Å; V515-A560 PolarHBondContact N-O 2.71Å; P555-A560 HydrophobicContact CB-CB 4.48Å; P555-A560 HydrophobicContact CG-CB 3.88Å; A556-A560 WeakPolarHBondContact O-CB 3.33Å
561	L	98.6	Very high	94.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	104.7	168.7	-56.7	-176	0	0	0	109.4	P497 L501 V515 I517 V532 L536 N543 V544 G545 F563	P497-L561 HydrophobicContact CB-CD1 4.15Å; P497-L561 HydrophobicContact CB-CD2 4.29Å; L501-L561 HydrophobicContact CB-CD2 4.38Å; L501-L561 HydrophobicContact CD2-CD1 4.11Å; L501-L561 HydrophobicContact CD2-CG 4.27Å; V515-L561 HydrophobicContact CB-CD2 3.69Å; V515-L561 HydrophobicContact CG1-CD2 4.49Å; V515-L561 HydrophobicContact CG2-CD2 3.71Å; I517-L561 HydrophobicContact CD1-CB 4.32Å; V532-L561 HydrophobicContact CG1-CD1 4.19Å; L536-L561 HydrophobicContact CD1-CD1 4.07Å; N543-L561 PolarHBondContact O-N 3.21Å; V544-L561 WeakPolarHBondContact CA-O 3.4Å; V544-L561 HydrophobicContact CG2-CB 4.34Å; V544-L561 HydrophobicContact CG2-CD1 4.23Å; G545-L561 PolarHBondContact N-O 3.34Å; L561-F563 HydrophobicContact CB-CE2 4.47Å
562	L	98.6	Very high	95.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	112.9	178.7	177.2	64.8	0	0	0	110.6	I426 V515 I516 I517 Q547 P554	I426-L562 HydrophobicContact CD1-CB 4.08Å; I426-L562 HydrophobicContact CD1-CD2 4.46Å; V515-L562 PolarHBondContact O-N 3.13Å; I516-L562 CarbonylContact C-O 3.51Å; I516-L562 WeakPolarHBondContact CA-O 3.37Å; I517-L562 PolarHBondContact N-O 2.9Å; Q547-L562 HydrophobicContact CB-CD1 4.1Å; P554-L562 HydrophobicContact CB-CD1 4.25Å
563	F	98.4	Very high	95.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	125.5	169.7	-69.5	-93.6	0	0	0	110.5	P497 I517 V528 A529 V532 V544 G545 F546 Q547 L561	P497-F563 HydrophobicContact CB-CZ 4.45Å; P497-F563 HydrophobicContact CG-CZ 4.22Å; I517-F563 HydrophobicContact CB-CD1 3.71Å; I517-F563 HydrophobicContact CB-CE1 3.76Å; I517-F563 HydrophobicContact CB-CG 4.32Å; I517-F563 HydrophobicContact CB-CZ 4.41Å; I517-F563 HydrophobicContact CD1-CD2 4.43Å; I517-F563 HydrophobicContact CD1-CE1 4.29Å; I517-F563 HydrophobicContact CD1-CE2 4.16Å; I517-F563 HydrophobicContact CD1-CZ 4.08Å; I517-F563 HydrophobicContact CG1-CD1 4.42Å; I517-F563 HydrophobicContact CG1-CE1 4.06Å; I517-F563 HydrophobicContact CG1-CZ 4.25Å; I517-F563 HydrophobicContact CG2-CD1 3.78Å; I517-F563 HydrophobicContact CG2-CE1 3.64Å; I517-F563 CarbonylContact O-C 3.56Å; I517-F563 VanDerWaalsContact O-CA 3.3Å; I517-F563 WeakPolarHBondContact O-CA 3.1Å; V528-F563 HydrophobicContact CB-CD1 4.28Å; V528-F563 HydrophobicContact CB-CE1 4.26Å; V528-F563 HydrophobicContact CG1-CD1 3.76Å; V528-F563 HydrophobicContact CG1-CE1 3.27Å; V528-F563 HydrophobicContact CG1-CZ 3.82Å; A529-F563 HydrophobicContact CB-CB 3.87Å; A529-F563 HydrophobicContact CB-CD2 3.69Å; A529-F563 HydrophobicContact CB-CG 3.91Å; V532-F563 HydrophobicContact CB-CE2 4.18Å; V532-F563 HydrophobicContact CB-CZ 4.26Å; V532-F563 HydrophobicContact CG1-CE2 4.29Å; V532-F563 HydrophobicContact CG1-CZ 4.44Å; V532-F563 HydrophobicContact CG2-CE2 4.31Å; V532-F563 HydrophobicContact CG2-CZ 3.88Å; V544-F563 HydrophobicContact CG1-CD2 3.93Å; V544-F563 HydrophobicContact CG1-CE2 3.83Å; G545-F563 PolarHBondContact O-N 3.33Å; F546-F563 CarbonylContact C-O 3.55Å; F546-F563 WeakPolarHBondContact CA-O 3.07Å; F546-F563 HydrophobicContact CB-CB 4.28Å; F546-F563 WeakPolarHBondContact CB-O 3.34Å; Q547-F563 PolarHBondContact N-O 3.24Å; L561-F563 HydrophobicContact CB-CE2 4.47Å
564	C	98	Very high	95.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	162	179.9	67.4	0	0	0	0	113.1	I517 T518 Q519 Q547 I568	I517-C564 PolarHBondContact O-N 3.47Å; T518-C564 CarbonylContact C-O 3.55Å; T518-C564 VanDerWaalsContact CA-O 3.26Å; T518-C564 WeakPolarHBondContact CA-O 3.45Å; Q519-C564 PolarHBondContact N-O 2.8Å; Q547-C564 HydrophobicContact CB-CB 4.34Å; Q547-C564 WeakPolarHBondContact O-CA 3.39Å; Q547-C564 WeakPolarHBondContact O-CB 3.27Å; C564-I568 HydrophobicContact CB-CB 4.06Å; C564-I568 HydrophobicContact CB-CG2 3.89Å
565	T	95.9	Very high	95	Very high	17 Å²	17	21.4 Å²	21.4	10%	0.104	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	150.9	166.9	45.3	0	0	0	0	110.9	Q519 R522 Q547 V548 G567 I568 L569	Q519-T565 VanDerWaalsContact O-CA 3.27Å; Q519-T565 WeakPolarHBondContact O-CA 2.95Å; R522-T565 HydrophobicContact CB-CG2 4.41Å; R522-T565 HydrophobicContact CG-CG2 3.76Å; Q547-T565 PolarHBondContact O-N 3.11Å; V548-T565 HydrophobicContact CB-CG2 4.36Å; V548-T565 HydrophobicContact CG1-CG2 3.99Å; T565-G567 VanDerWaalsContact C-N 3.27Å; T565-G567 PolarHBondContact O-N 2.81Å; T565-I568 WeakPolarHBondContact O-CB 3.23Å; T565-I568 PolarHBondContact O-N 3.41Å; T565-I568 VanDerWaalsContact OG1-CG1 3.25Å; T565-I568 WeakPolarHBondContact OG1-CG1 3.44Å; T565-L569 PolarHBondContact O-N 3.17Å
566	V	96.5	Very high	94.9	Very high	5 Å²	5	21 Å²	21	3%	0.03	13%	0.125	C	C	.	.	H	α-helix	trans	-50.8	-46.2	178	178.7	0	0	0	0	112.1	Q519 I568 L569 L570 N596 L600	Q519-V566 PolarHBondContact O-N 3.2Å; V566-I568 PolarHBondContact O-N 3.01Å; V566-I568 VanDerWaalsContact O-N 3.14Å; V566-L569 PolarHBondContact O-N 3.09Å; V566-L570 HydrophobicContact CG1-CD1 4.38Å; V566-L570 HydrophobicContact CG1-CG 4.4Å; V566-L570 PolarHBondContact O-N 3.21Å; V566-N596 HydrophobicContact CB-CB 4.29Å; V566-N596 HydrophobicContact CG1-CB 3.71Å; V566-N596 WeakPolarHBondContact CG1-O 3.48Å; V566-L600 HydrophobicContact CG1-CB 4Å; V566-L600 HydrophobicContact CG1-CD2 3.93Å
567	G	93.4	Very high	94.8	Very high	39 Å²	39	21 Å²	21	40%	0.402	12%	0.118	S	C	.	.	H	α-helix	trans	-60.5	-24.6	178	0	0	0	0	0	115.2	T565 R571	T565-G567 VanDerWaalsContact C-N 3.27Å; T565-G567 PolarHBondContact O-N 2.81Å; G567-R571 PolarHBondContact O-N 3.13Å; G567-R571 VanDerWaalsContact O-N 3.14Å
568	I	94.6	Very high	94.9	Very high	23 Å²	23	20.4 Å²	20.4	12%	0.118	12%	0.121	C	C	.	.	H	α-helix	trans	-73.7	-39	174	-67.2	-69.5	0	0	0	110.4	Q547 C564 T565 V566 R571 K572	Q547-I568 HydrophobicContact CB-CG2 4.12Å; Q547-I568 HydrophobicContact CG-CD1 4.32Å; Q547-I568 HydrophobicContact CG-CG1 4.5Å; Q547-I568 HydrophobicContact CG-CG2 3.81Å; C564-I568 HydrophobicContact CB-CB 4.06Å; C564-I568 HydrophobicContact CB-CG2 3.89Å; T565-I568 WeakPolarHBondContact O-CB 3.23Å; T565-I568 PolarHBondContact O-N 3.41Å; T565-I568 VanDerWaalsContact OG1-CG1 3.25Å; T565-I568 WeakPolarHBondContact OG1-CG1 3.44Å; V566-I568 PolarHBondContact O-N 3.01Å; V566-I568 VanDerWaalsContact O-N 3.14Å; I568-R571 PolarHBondContact O-N 3.32Å; I568-K572 HydrophobicContact CG2-CD 4.15Å; I568-K572 VanDerWaalsContact CG2-CE 3.47Å; I568-K572 VanDerWaalsContact O-CG 3.32Å; I568-K572 WeakPolarHBondContact O-CG 3.35Å; I568-K572 PolarHBondContact O-N 3.17Å
569	L	97.3	Very high	95.1	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-67.6	-40	174.6	-178.8	55.3	0	0	0	111.4	I516 T518 T565 V566 R571 K572 L573 L579 V585 L600	I516-L569 HydrophobicContact CD1-CD1 4Å; I516-L569 HydrophobicContact CG2-CD1 4.24Å; I516-L569 HydrophobicContact CG2-CD2 4.24Å; T518-L569 HydrophobicContact CG2-CB 4Å; T518-L569 HydrophobicContact CG2-CD2 3.44Å; T518-L569 VanDerWaalsContact CG2-CD2 3.44Å; T518-L569 HydrophobicContact CG2-CG 4.37Å; T565-L569 PolarHBondContact O-N 3.17Å; V566-L569 PolarHBondContact O-N 3.09Å; L569-R571 VanDerWaalsContact C-N 3.34Å; L569-R571 PolarHBondContact O-N 3.3Å; L569-K572 HydrophobicContact CD1-CB 4.45Å; L569-K572 WeakPolarHBondContact O-CB 3.44Å; L569-K572 PolarHBondContact O-N 2.82Å; L569-K572 VanDerWaalsContact O-N 3.11Å; L569-L573 HydrophobicContact CG-CD1 4.32Å; L569-L573 PolarHBondContact O-N 2.94Å; L569-L579 HydrophobicContact CD1-CD1 4.19Å; L569-L579 HydrophobicContact CD1-CD2 4.05Å; L569-V585 HydrophobicContact CD2-CG1 3.95Å; L569-L600 HydrophobicContact CD2-CD1 3.86Å; L569-L600 HydrophobicContact CD2-CD2 3.9Å; L569-L600 HydrophobicContact CG-CD1 4.11Å
570	L	95.3	Very high	95	Very high	5 Å²	5	23.8 Å²	23.8	3%	0.026	14%	0.136	C	C	.	.	H	α-helix	trans	-56.4	-47.9	173.3	-66.3	179.5	0	0	0	111.3	V566 K572 L573 Q574 N596 F599 L600 L603 H855	V566-L570 HydrophobicContact CG1-CD1 4.38Å; V566-L570 HydrophobicContact CG1-CG 4.4Å; V566-L570 PolarHBondContact O-N 3.21Å; L570-K572 VanDerWaalsContact C-N 3.32Å; L570-K572 PolarHBondContact O-N 3.36Å; L570-L573 HydrophobicContact CD2-CD1 4.43Å; L570-L573 WeakPolarHBondContact O-CB 3.38Å; L570-L573 PolarHBondContact O-N 2.76Å; L570-Q574 PolarHBondContact O-N 3.12Å; L570-N596 HydrophobicContact CD1-CB 4.05Å; L570-F599 HydrophobicContact CD1-CD1 4.01Å; L570-F599 HydrophobicContact CD2-CD1 3.69Å; L570-F599 HydrophobicContact CD2-CE1 4.04Å; L570-L600 HydrophobicContact CD2-CB 4.01Å; L570-L600 HydrophobicContact CD2-CD1 3.96Å; L570-L603 HydrophobicContact CD2-CD1 3.77Å; L570-H855 PolarHBondContact O-CE1 3.49Å
571	R	90.5	Very high	94.9	Very high	87 Å²	87	24.6 Å²	24.6	33%	0.328	14%	0.144	S	C	.	.	H	α-helix	trans	-60.8	-38.3	175	-176.6	174.7	-88.4	-168.6	-15.8	112.8	G567 I568 L569 Q574 N1014	G567-R571 PolarHBondContact O-N 3.13Å; G567-R571 VanDerWaalsContact O-N 3.14Å; I568-R571 PolarHBondContact O-N 3.32Å; L569-R571 VanDerWaalsContact C-N 3.34Å; L569-R571 PolarHBondContact O-N 3.3Å; R571-Q574 WeakPolarHBondContact O-CB 3.29Å; R571-Q574 PolarHBondContact O-N 3.33Å; R571-N1014 PolarHBondContact NH2-OD1 3.4Å
572	K	93.6	Very high	94.8	Very high	14 Å²	14	25 Å²	25	6%	0.061	15%	0.147	C	C	.	.	H	α-helix	trans	-65.1	-38.9	176	-71.9	165.1	-178.3	-67	0	112.1	P425 I568 L569 L570 Q574 S575 N576	P425-K572 WeakPolarHBondContact O-CD 3.46Å; P425-K572 WeakPolarHBondContact O-CE 3.41Å; P425-K572 PolarHBondContact O-NZ 3.3Å; I568-K572 HydrophobicContact CG2-CD 4.15Å; I568-K572 VanDerWaalsContact CG2-CE 3.47Å; I568-K572 VanDerWaalsContact O-CG 3.32Å; I568-K572 WeakPolarHBondContact O-CG 3.35Å; I568-K572 PolarHBondContact O-N 3.17Å; L569-K572 HydrophobicContact CD1-CB 4.45Å; L569-K572 WeakPolarHBondContact O-CB 3.44Å; L569-K572 PolarHBondContact O-N 2.82Å; L569-K572 VanDerWaalsContact O-N 3.11Å; L570-K572 VanDerWaalsContact C-N 3.32Å; L570-K572 PolarHBondContact O-N 3.36Å; K572-Q574 PolarHBondContact O-N 3.05Å; K572-S575 PolarHBondContact O-N 3.31Å; K572-S575 VanDerWaalsContact O-N 3.14Å; K572-S575 PolarHBondContact O-OG 3.03Å; K572-S575 VanDerWaalsContact O-OG 3.09Å; K572-N576 PolarHBondContact O-N 3.18Å
573	L	94.8	Very high	94.8	Very high	7 Å²	7	25.9 Å²	25.9	4%	0.037	15%	0.153	C	C	.	.	H	α-helix	trans	-61.5	-23.9	175.3	-79	163.5	0	0	0	113.2	L569 L570 N576 P577 L579 L600 L603 L607	L569-L573 HydrophobicContact CG-CD1 4.32Å; L569-L573 PolarHBondContact O-N 2.94Å; L570-L573 HydrophobicContact CD2-CD1 4.43Å; L570-L573 WeakPolarHBondContact O-CB 3.38Å; L570-L573 PolarHBondContact O-N 2.76Å; L573-N576 CarbonylContact O-C 3.57Å; L573-P577 WeakPolarHBondContact O-CA 3.33Å; L573-L579 HydrophobicContact CD2-CD1 3.93Å; L573-L579 HydrophobicContact CD2-CD2 3.71Å; L573-L579 HydrophobicContact CD2-CG 3.55Å; L573-L579 HydrophobicContact CG-CD2 4.07Å; L573-L579 HydrophobicContact CG-CG 4.38Å; L573-L600 HydrophobicContact CD1-CD1 3.66Å; L573-L603 HydrophobicContact CD1-CB 4.36Å; L573-L603 HydrophobicContact CD1-CD1 3.94Å; L573-L607 HydrophobicContact CD2-CD2 4.14Å
574	Q	90.7	Very high	94.8	Very high	69 Å²	69	26 Å²	26	32%	0.322	15%	0.153	S	C	.	.	H	α-helix	trans	-69.5	-39.3	175	-60.9	175.1	0.2	0	0	111.8	L570 R571 K572 Q851 I854 H855	L570-Q574 PolarHBondContact O-N 3.12Å; R571-Q574 WeakPolarHBondContact O-CB 3.29Å; R571-Q574 PolarHBondContact O-N 3.33Å; K572-Q574 PolarHBondContact O-N 3.05Å; Q574-Q851 VanDerWaalsContact NE2-OE1 3.17Å; Q574-I854 HydrophobicContact CG-CG2 3.94Å; Q574-H855 WeakPolarHBondContact CG-CE1 3.14Å
575	S	89.5	Confident	94.8	Very high	54 Å²	54	26 Å²	26	38%	0.378	15%	0.153	S	C	.	.	H	α-helix	trans	-91.2	-17.8	-179.1	58.7	0	0	0	0	113.9	S423 K572	S423-S575 WeakPolarHBondContact CB-OG 3.35Å; K572-S575 PolarHBondContact O-N 3.31Å; K572-S575 VanDerWaalsContact O-N 3.14Å; K572-S575 PolarHBondContact O-OG 3.03Å; K572-S575 VanDerWaalsContact O-OG 3.09Å
576	N	94.2	Very high	94.9	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.148	C	C	.	.			trans	-142.6	80.1	174.9	-169.7	-24.3	0	0	0	110.1	L422 S423 P425 K572 L573 S578 L579 E580	L422-N576 HydrophobicContact CD2-CB 4.43Å; S423-N576 WeakPolarHBondContact O-CB 3.34Å; S423-N576 PolarHBondContact O-ND2 2.74Å; P425-N576 WeakPolarHBondContact CD-ND2 3.32Å; P425-N576 HydrophobicContact CG-CB 4.09Å; P425-N576 WeakPolarHBondContact CG-ND2 3.36Å; K572-N576 PolarHBondContact O-N 3.18Å; L573-N576 CarbonylContact O-C 3.57Å; N576-S578 PolarHBondContact O-N 2.9Å; N576-S578 PolarHBondContact OD1-OG 2.87Å; N576-L579 PolarHBondContact O-N 2.85Å; N576-L579 WeakPolarHBondContact OD1-CA 3.45Å; N576-L579 PolarHBondContact OD1-N 3.49Å; N576-E580 PolarHBondContact ND2-N 3.34Å; N576-E580 PolarHBondContact ND2-O 3.33Å; N576-E580 PolarHBondContact OD1-N 2.8Å
577	P	93	Very high	95	Very high	72 Å²	72	25 Å²	25	47%	0.468	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-22.8	-175.2	-24.4	34.9	0	0	0	114.5	L573 L607	L573-P577 WeakPolarHBondContact O-CA 3.33Å; P577-L607 WeakPolarHBondContact O-CD1 3.46Å
578	S	94.2	Very high	95.1	Very high	32 Å²	32	23.1 Å²	23.1	22%	0.224	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-5.9	176.8	56.1	0	0	0	0	113.6	N576 E580 N611	N576-S578 PolarHBondContact O-N 2.9Å; N576-S578 PolarHBondContact OD1-OG 2.87Å; S578-E580 PolarHBondContact O-N 2.85Å; S578-N611 WeakPolarHBondContact O-CB 3.43Å; S578-N611 PolarHBondContact O-ND2 3.33Å
579	L	96.4	Very high	95	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.124	C	C	.	.			trans	46.8	43.4	-166.8	-65	-178	0	0	0	112.6	P425 L569 L573 N576 G581 V582 V585 L604 L607 L614	P425-L579 HydrophobicContact CB-CD2 4.12Å; P425-L579 HydrophobicContact CG-CD2 4.01Å; L569-L579 HydrophobicContact CD1-CD1 4.19Å; L569-L579 HydrophobicContact CD1-CD2 4.05Å; L573-L579 HydrophobicContact CD2-CD1 3.93Å; L573-L579 HydrophobicContact CD2-CD2 3.71Å; L573-L579 HydrophobicContact CD2-CG 3.55Å; L573-L579 HydrophobicContact CG-CD2 4.07Å; L573-L579 HydrophobicContact CG-CG 4.38Å; N576-L579 PolarHBondContact O-N 2.85Å; N576-L579 WeakPolarHBondContact OD1-CA 3.45Å; N576-L579 PolarHBondContact OD1-N 3.49Å; L579-G581 PolarHBondContact O-N 2.81Å; L579-V582 HydrophobicContact CB-CB 4.18Å; L579-V582 HydrophobicContact CB-CG2 4.17Å; L579-V582 WeakPolarHBondContact O-CB 3.36Å; L579-V582 PolarHBondContact O-N 3.08Å; L579-V585 HydrophobicContact CD1-CG2 3.71Å; L579-L604 HydrophobicContact CD1-CD2 4.47Å; L579-L607 HydrophobicContact CB-CD2 4.21Å; L579-L607 HydrophobicContact CD1-CD2 3.61Å; L579-L607 HydrophobicContact CG-CD2 3.81Å; L579-L614 HydrophobicContact CD1-CD2 4.32Å
580	E	94.3	Very high	94.9	Very high	76 Å²	76	22.5 Å²	22.5	36%	0.355	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	134.5	178.6	-154.9	-171.5	145.7	0	0	110.9	L422 P425 Y431 N576 S578	L422-E580 HydrophobicContact CD1-CB 4.26Å; L422-E580 VanDerWaalsContact CD1-OE2 3.31Å; L422-E580 WeakPolarHBondContact CD1-OE2 3.43Å; P425-E580 WeakPolarHBondContact CD-O 3.49Å; Y431-E580 HydrophobicContact CE1-CB 4.37Å; Y431-E580 VanDerWaalsContact CE1-CD 3.43Å; Y431-E580 HydrophobicContact CE1-CG 3.98Å; Y431-E580 WeakPolarHBondContact CE1-OE1 3.36Å; Y431-E580 WeakPolarHBondContact CE2-O 3.09Å; Y431-E580 PolarHBondContact OH-OE1 3.37Å; Y431-E580 VanDerWaalsContact OH-OE1 3.08Å; N576-E580 PolarHBondContact ND2-N 3.34Å; N576-E580 PolarHBondContact ND2-O 3.33Å; N576-E580 PolarHBondContact OD1-N 2.8Å; S578-E580 PolarHBondContact O-N 2.85Å
581	G	94.2	Very high	94.7	Very high	16 Å²	16	23.5 Å²	23.5	17%	0.165	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.7	-12.7	-174.4	0	0	0	0	0	115.7	N514 L579	N514-G581 WeakPolarHBondContact CB-O 3.42Å; N514-G581 PolarHBondContact ND2-O 3.37Å; L579-G581 PolarHBondContact O-N 2.81Å
582	V	97.6	Very high	94.6	Very high	10 Å²	10	20.6 Å²	20.6	6%	0.061	12%	0.119	C	C	.	.			trans	-92.3	133	175.4	-175.9	0	0	0	0	109.4	P425 I516 L579 H584 V585 L614	P425-V582 HydrophobicContact CB-CG2 3.62Å; P425-V582 HydrophobicContact CG-CG2 3.78Å; I516-V582 HydrophobicContact CD1-CG1 4.24Å; I516-V582 HydrophobicContact CD1-CG2 3.75Å; I516-V582 HydrophobicContact CG1-CG1 4.17Å; I516-V582 HydrophobicContact CG1-CG2 4.33Å; L579-V582 HydrophobicContact CB-CB 4.18Å; L579-V582 HydrophobicContact CB-CG2 4.17Å; L579-V582 WeakPolarHBondContact O-CB 3.36Å; L579-V582 PolarHBondContact O-N 3.08Å; V582-H584 VanDerWaalsContact CG1-O 3.27Å; V582-H584 WeakPolarHBondContact CG1-O 3.36Å; V582-V585 HydrophobicContact CG1-CG2 4.1Å; V582-L614 HydrophobicContact CB-CD1 4.08Å; V582-L614 HydrophobicContact CG1-CD1 3.85Å; V582-L614 WeakPolarHBondContact O-CD1 3.34Å
583	S	97.7	Very high	94.5	Very high	18 Å²	18	21.3 Å²	21.3	13%	0.126	12%	0.121	C	C	.	.			trans	-93.5	-37.7	177.9	62.4	0	0	0	0	112.5	R512 N514 R615	R512-S583 WeakPolarHBondContact O-CB 3.29Å; N514-S583 PolarHBondContact N-OG 3.28Å; N514-S583 PolarHBondContact O-N 3.48Å; N514-S583 PolarHBondContact O-OG 2.76Å; S583-R615 PolarHBondContact O-N 3.12Å
584	H	98.7	Very high	94.4	Very high	2 Å²	2	22.3 Å²	22.3	1%	0.009	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	139.2	-175.3	-59.2	76.1	0	0	0	110.4	L500 Y504 N514 V515 I516 V582 R615	L500-H584 HydrophobicContact CD1-CB 4.43Å; Y504-H584 AromaticContact CE2-CE1 3.78Å; Y504-H584 AromaticContact CZ-CE1 3.74Å; Y504-H584 PolarHBondContact OH-CE1 3.49Å; N514-H584 PolarHBondContact O-N 3.34Å; V515-H584 WeakPolarHBondContact CA-O 3.31Å; V515-H584 HydrophobicContact CB-CB 4.42Å; V515-H584 HydrophobicContact CG1-CB 4Å; V515-H584 HydrophobicContact CG2-CB 4.12Å; I516-H584 PolarHBondContact N-O 3.01Å; V582-H584 VanDerWaalsContact CG1-O 3.27Å; V582-H584 WeakPolarHBondContact CG1-O 3.36Å; H584-R615 CarbonylContact C-O 3.47Å; H584-R615 VanDerWaalsContact CA-O 3.23Å; H584-R615 WeakPolarHBondContact CA-O 3.29Å; H584-R615 VanDerWaalsContact CD2-CB 3.45Å; H584-R615 WeakPolarHBondContact CD2-CB 3.19Å
585	V	98.7	Very high	94.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	127.5	163.7	174.8	0	0	0	0	107.8	I516 L569 L579 V582 V587 L604 L614 R615 L616 V617	I516-V585 CarbonylContact O-C 3.57Å; I516-V585 WeakPolarHBondContact O-CA 3.45Å; L569-V585 HydrophobicContact CD2-CG1 3.95Å; L579-V585 HydrophobicContact CD1-CG2 3.71Å; V582-V585 HydrophobicContact CG1-CG2 4.1Å; V585-V587 HydrophobicContact CG1-CG2 4.16Å; V585-L604 HydrophobicContact CB-CD2 4.48Å; V585-L604 HydrophobicContact CG1-CD1 4.09Å; V585-L604 HydrophobicContact CG1-CD2 4.19Å; V585-L604 HydrophobicContact CG2-CD2 4.44Å; V585-L614 HydrophobicContact CG2-CD1 4.21Å; V585-L614 HydrophobicContact CG2-CD2 4.18Å; V585-R615 PolarHBondContact N-O 2.85Å; V585-L616 HydrophobicContact CB-CD1 4.22Å; V585-L616 HydrophobicContact CG1-CD1 4.16Å; V585-L616 WeakPolarHBondContact O-CA 3.32Å; V585-L616 WeakPolarHBondContact O-CD1 3.29Å; V585-V617 PolarHBondContact O-N 3.11Å
586	I	98.6	Very high	94.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	116.8	173.9	-53.5	-174.8	0	0	0	107.6	I496 P497 L500 V515 I516 I517 T518 V617 M619	I496-I586 HydrophobicContact CG2-CD1 4.31Å; P497-I586 HydrophobicContact CB-CD1 4.49Å; P497-I586 HydrophobicContact CG-CD1 4.03Å; L500-I586 HydrophobicContact CD1-CD1 3.94Å; V515-I586 HydrophobicContact CG1-CD1 3.8Å; V515-I586 HydrophobicContact CG1-CG1 3.89Å; I516-I586 PolarHBondContact O-N 3.22Å; I517-I586 CarbonylContact C-O 3.56Å; I517-I586 WeakPolarHBondContact CA-O 3.27Å; I517-I586 HydrophobicContact CB-CB 4.4Å; I517-I586 HydrophobicContact CG1-CB 4.13Å; I517-I586 HydrophobicContact CG1-CD1 4.01Å; I517-I586 HydrophobicContact CG1-CG1 4.32Å; I517-I586 HydrophobicContact CG2-CB 4.17Å; I517-I586 HydrophobicContact CG2-CG2 4.23Å; T518-I586 PolarHBondContact N-O 3.37Å; T518-I586 PolarHBondContact OG1-O 2.98Å; I586-V617 CarbonylContact C-O 3.54Å; I586-V617 VanDerWaalsContact CA-O 3.31Å; I586-V617 WeakPolarHBondContact CA-O 3.22Å; I586-V617 HydrophobicContact CB-CB 4.45Å; I586-V617 HydrophobicContact CG1-CB 4.07Å; I586-V617 HydrophobicContact CG1-CG2 4.35Å; I586-V617 HydrophobicContact CG2-CB 4.28Å; I586-V617 HydrophobicContact CG2-CG1 4.45Å; I586-M619 HydrophobicContact CG2-CE 3.36Å; I586-M619 HydrophobicContact CG2-CG 3.88Å; I586-M619 HydrophobicContact CG2-SD 3.68Å
587	V	97.9	Very high	94.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	102.7	171.5	-170.3	0	0	0	0	107.7	T518 V585 V590 T597 L600 L601 L604 L616 V617 L618 M619	T518-V587 WeakPolarHBondContact OG1-CA 3.36Å; V585-V587 HydrophobicContact CG1-CG2 4.16Å; V587-V590 HydrophobicContact CB-CG1 4.06Å; V587-V590 HydrophobicContact CG1-CG1 3.64Å; V587-V590 WeakPolarHBondContact O-CG1 3.34Å; V587-T597 HydrophobicContact CG1-CG2 3.85Å; V587-L600 HydrophobicContact CG1-CD2 4.49Å; V587-L600 HydrophobicContact CG2-CD2 4.07Å; V587-L601 HydrophobicContact CG1-CD2 4.48Å; V587-L601 HydrophobicContact CG2-CD2 4.38Å; V587-L604 HydrophobicContact CG2-CD1 3.62Å; V587-L616 HydrophobicContact CG2-CD1 3.98Å; V587-V617 PolarHBondContact N-O 2.8Å; V587-L618 HydrophobicContact CB-CD2 3.81Å; V587-L618 HydrophobicContact CG2-CD2 4.01Å; V587-M619 PolarHBondContact O-N 3.07Å
588	D	95.5	Very high	95.1	Very high	1 Å²	1	17 Å²	17	1%	0.005	9%	0.093	C	C	.	.			trans	-86.2	159.9	177.8	-156	5.8	0	0	0	112.1	T493 T518 Q519 V590 M619	T493-D588 WeakPolarHBondContact CB-OD2 3.5Å; T493-D588 WeakPolarHBondContact CG2-OD2 3.27Å; T493-D588 PolarHBondContact OG1-OD2 2.62Å; T518-D588 VanDerWaalsContact O-CB 3.29Å; T518-D588 WeakPolarHBondContact O-CB 3.42Å; T518-D588 PolarHBondContact O-N 3.39Å; Q519-D588 PolarHBondContact NE2-OD2 3.32Å; D588-V590 VanDerWaalsContact C-N 3.29Å; D588-V590 PolarHBondContact O-N 3.15Å; D588-M619 HydrophobicContact CB-CE 3.63Å; D588-M619 WeakPolarHBondContact OD1-CB 3.37Å; D588-M619 VanDerWaalsContact OD1-CE 3.3Å; D588-M619 WeakPolarHBondContact OD1-CE 3.46Å; D588-M619 WeakPolarHBondContact OD2-CE 3.31Å
589	E	92.5	Very high	95.2	Very high	10 Å²	10	15.5 Å²	15.5	5%	0.047	8%	0.082	C	C	.	.			trans	55.2	36.5	176.7	-51.3	-71.1	-146.8	0	0	114.1	P520 H591 E592 M619 S766	P520-E589 HydrophobicContact CG-CB 3.86Å; P520-E589 HydrophobicContact CG-CG 4.32Å; E589-H591 PolarHBondContact O-N 3.33Å; E589-H591 IonicContact OE2-CE1 2.74Å; E589-H591 PolarHBondContact OE2-CE1 3.37Å; E589-H591 IonicContact OE2-ND1 3.5Å; E589-H591 IonicContact OE2-NE2 3.52Å; E589-H591 PolarHBondContact OE2-NE2 3.14Å; E589-E592 HydrophobicContact CB-CG 4.27Å; E589-E592 PolarHBondContact O-N 3.2Å; E589-M619 PolarHBondContact N-O 2.78Å; E589-S766 VanDerWaalsContact CD-OG 3.3Å; E589-S766 WeakPolarHBondContact OE1-CA 3.29Å; E589-S766 WeakPolarHBondContact OE1-CB 3.48Å; E589-S766 PolarHBondContact OE1-N 3.43Å; E589-S766 PolarHBondContact OE1-OG 3.02Å
590	V	94.5	Very high	95.3	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-60.5	-17.2	-177.3	-62.6	0	0	0	0	114.1	V587 D588 E592 R593 T597 L618 M619 F628	V587-V590 HydrophobicContact CB-CG1 4.06Å; V587-V590 HydrophobicContact CG1-CG1 3.64Å; V587-V590 WeakPolarHBondContact O-CG1 3.34Å; D588-V590 VanDerWaalsContact C-N 3.29Å; D588-V590 PolarHBondContact O-N 3.15Å; V590-E592 VanDerWaalsContact C-N 3.32Å; V590-R593 WeakPolarHBondContact O-CD 3.32Å; V590-R593 PolarHBondContact O-N 2.99Å; V590-T597 HydrophobicContact CG1-CG2 4.48Å; V590-L618 HydrophobicContact CG1-CB 4.37Å; V590-L618 HydrophobicContact CG1-CD2 4.4Å; V590-M619 WeakPolarHBondContact CG2-O 3.39Å; V590-M619 PolarHBondContact N-O 3.38Å; V590-F628 HydrophobicContact CB-CE1 4.34Å; V590-F628 HydrophobicContact CB-CE2 4.11Å; V590-F628 HydrophobicContact CB-CZ 3.86Å; V590-F628 HydrophobicContact CG2-CD2 3.97Å; V590-F628 HydrophobicContact CG2-CE2 3.54Å; V590-F628 HydrophobicContact CG2-CZ 3.84Å; V590-F628 WeakPolarHBondContact O-CZ 3.39Å
591	H	90.7	Very high	95.4	Very high	25 Å²	25	11.9 Å²	11.9	12%	0.116	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	-77	-11.4	175.4	56.3	-96.1	0	0	0	114.5	E589 R593 S620 A621 T622 Q807	E589-H591 PolarHBondContact O-N 3.33Å; E589-H591 IonicContact OE2-CE1 2.74Å; E589-H591 PolarHBondContact OE2-CE1 3.37Å; E589-H591 IonicContact OE2-ND1 3.5Å; E589-H591 IonicContact OE2-NE2 3.52Å; E589-H591 PolarHBondContact OE2-NE2 3.14Å; H591-R593 PolarHBondContact O-N 3.49Å; H591-S620 WeakPolarHBondContact CB-OG 3.4Å; H591-S620 PolarHBondContact ND1-OG 3.42Å; H591-A621 VanDerWaalsContact CE1-CB 3.43Å; H591-A621 WeakPolarHBondContact CE1-CB 3.32Å; H591-A621 PolarHBondContact CE1-N 2.94Å; H591-A621 PolarHBondContact ND1-N 3.48Å; H591-T622 WeakPolarHBondContact CB-O 3.3Å; H591-Q807 PolarHBondContact CD2-NE2 2.72Å; H591-Q807 PolarHBondContact NE2-NE2 2.68Å
592	E	89	Confident	95.6	Very high	27 Å²	27	11.6 Å²	11.6	13%	0.126	6%	0.06	C	C	.	.	G	3₁₀ helix	trans	-66	-21.3	171	-73.7	-167.9	-132.3	0	0	111.5	P520 R521 E589 V590 D594 T765	P520-E592 VanDerWaalsContact CG-CD 3.47Å; P520-E592 HydrophobicContact CG-CG 4.49Å; P520-E592 WeakPolarHBondContact CG-OE1 3.48Å; R521-E592 IonicContact CZ-OE2 2.75Å; R521-E592 IonicContact NE-OE2 3.83Å; R521-E592 PolarHBondContact NE-OE2 2.83Å; R521-E592 IonicContact NH2-OE2 2.88Å; R521-E592 PolarHBondContact NH2-OE2 2.93Å; E589-E592 HydrophobicContact CB-CG 4.27Å; E589-E592 PolarHBondContact O-N 3.2Å; V590-E592 VanDerWaalsContact C-N 3.32Å; E592-D594 PolarHBondContact O-N 3Å; E592-T765 HydrophobicContact CG-CG2 3.73Å; E592-T765 WeakPolarHBondContact OE1-CB 3.2Å; E592-T765 WeakPolarHBondContact OE1-CG2 3.39Å
593	R	92	Very high	95.5	Very high	28 Å²	28	12 Å²	12	11%	0.106	6%	0.062	C	C	.	.			trans	50.5	40.4	-179.7	-58.5	-56.3	-56.5	-79.8	-3.5	113	V590 H591 D598 P838 E839 D870	V590-R593 WeakPolarHBondContact O-CD 3.32Å; V590-R593 PolarHBondContact O-N 2.99Å; H591-R593 PolarHBondContact O-N 3.49Å; R593-D598 IonicContact CZ-OD1 3.61Å; R593-D598 IonicContact CZ-OD2 3.99Å; R593-D598 IonicContact NE-OD1 2.74Å; R593-D598 PolarHBondContact NE-OD1 3.34Å; R593-D598 VanDerWaalsContact NE-OD1 3.12Å; R593-D598 IonicContact NE-OD2 3Å; R593-D598 PolarHBondContact NE-OD2 3.41Å; R593-D598 IonicContact NH2-OD1 3.02Å; R593-D598 IonicContact NH2-OD2 3.66Å; R593-D598 PolarHBondContact NH2-OD2 3.17Å; R593-P838 HydrophobicContact CB-CB 4Å; R593-P838 HydrophobicContact CB-CG 4.29Å; R593-P838 HydrophobicContact CG-CG 4.38Å; R593-P838 VanDerWaalsContact CZ-CG 3.44Å; R593-E839 WeakPolarHBondContact O-CB 3.45Å; R593-E839 PolarHBondContact O-N 2.91Å; R593-D870 IonicContact CZ-OD2 2.72Å; R593-D870 VanDerWaalsContact CZ-OD2 3.24Å; R593-D870 IonicContact NH1-OD2 3.99Å; R593-D870 PolarHBondContact NH1-OD2 3.03Å; R593-D870 IonicContact NH2-OD2 4Å; R593-D870 PolarHBondContact NH2-OD2 2.9Å
594	D	92.6	Very high	95.5	Very high	29 Å²	29	11.1 Å²	11.1	16%	0.155	6%	0.056	C	C	.	.			trans	-62.6	141.5	171.8	161.9	95	0	0	0	110.7	E592 N596 T597 D598	E592-D594 PolarHBondContact O-N 3Å; D594-N596 VanDerWaalsContact C-N 3.31Å; D594-N596 PolarHBondContact O-N 2.86Å; D594-N596 WeakPolarHBondContact OD2-CA 3.5Å; D594-N596 WeakPolarHBondContact OD2-CB 3.45Å; D594-N596 PolarHBondContact OD2-N 2.96Å; D594-T597 WeakPolarHBondContact O-CB 3.35Å; D594-T597 PolarHBondContact O-N 2.89Å; D594-T597 VanDerWaalsContact O-N 3.08Å; D594-T597 PolarHBondContact OD2-N 2.62Å; D594-T597 PolarHBondContact OD2-OG1 3.42Å; D594-T597 VanDerWaalsContact OD2-OG1 3.12Å; D594-D598 PolarHBondContact O-N 3.46Å
595	V	94.4	Very high	95.4	Very high	23 Å²	23	15.1 Å²	15.1	14%	0.139	7%	0.073	C	C	.	.	H	α-helix	trans	-60.2	-38.4	-174.1	62.9	0	0	0	0	112.9	T597 F599 E839 I840 L848	V595-T597 VanDerWaalsContact C-N 3.33Å; V595-F599 WeakPolarHBondContact O-CB 3.42Å; V595-F599 PolarHBondContact O-N 3.07Å; V595-F599 VanDerWaalsContact O-N 3.09Å; V595-E839 HydrophobicContact CB-CB 3.91Å; V595-E839 PolarHBondContact N-OE2 3.03Å; V595-I840 HydrophobicContact CG2-CB 4.24Å; V595-I840 HydrophobicContact CG2-CG1 4.43Å; V595-L848 HydrophobicContact CG2-CD1 3.93Å; V595-L848 HydrophobicContact CG2-CD2 3.92Å; V595-L848 HydrophobicContact CG2-CG 4.47Å
596	N	95.1	Very high	95.2	Very high	59 Å²	59	16.9 Å²	16.9	32%	0.316	9%	0.092	S	C	.	.	H	α-helix	trans	-74.1	-29.9	179.6	-62.4	-63.3	0	0	0	111.3	V566 L570 D594 L600	V566-N596 HydrophobicContact CB-CB 4.29Å; V566-N596 HydrophobicContact CG1-CB 3.71Å; V566-N596 WeakPolarHBondContact CG1-O 3.48Å; L570-N596 HydrophobicContact CD1-CB 4.05Å; D594-N596 VanDerWaalsContact C-N 3.31Å; D594-N596 PolarHBondContact O-N 2.86Å; D594-N596 WeakPolarHBondContact OD2-CA 3.5Å; D594-N596 WeakPolarHBondContact OD2-CB 3.45Å; D594-N596 PolarHBondContact OD2-N 2.96Å; N596-L600 VanDerWaalsContact O-CB 3.26Å; N596-L600 WeakPolarHBondContact O-CB 3.43Å; N596-L600 PolarHBondContact O-N 2.88Å
597	T	96.2	Very high	95	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.006	9%	0.093	C	C	.	.	H	α-helix	trans	-66.4	-49.9	175.8	-57.7	0	0	0	0	110.1	V587 V590 D594 V595 F599 L600 L601	V587-T597 HydrophobicContact CG1-CG2 3.85Å; V590-T597 HydrophobicContact CG1-CG2 4.48Å; D594-T597 WeakPolarHBondContact O-CB 3.35Å; D594-T597 PolarHBondContact O-N 2.89Å; D594-T597 VanDerWaalsContact O-N 3.08Å; D594-T597 PolarHBondContact OD2-N 2.62Å; D594-T597 PolarHBondContact OD2-OG1 3.42Å; D594-T597 VanDerWaalsContact OD2-OG1 3.12Å; V595-T597 VanDerWaalsContact C-N 3.33Å; T597-F599 VanDerWaalsContact C-N 3.29Å; T597-F599 PolarHBondContact O-N 2.73Å; T597-L600 WeakPolarHBondContact O-CB 3.47Å; T597-L600 PolarHBondContact O-N 3.33Å; T597-L600 VanDerWaalsContact O-N 3.15Å; T597-L601 WeakPolarHBondContact O-CG 3.29Å; T597-L601 PolarHBondContact O-N 3.39Å
598	D	95.6	Very high	94.9	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-59.3	-41.4	175.7	-83.2	10.6	0	0	0	111.2	R593 D594 L601 I602	R593-D598 IonicContact CZ-OD1 3.61Å; R593-D598 IonicContact CZ-OD2 3.99Å; R593-D598 IonicContact NE-OD1 2.74Å; R593-D598 PolarHBondContact NE-OD1 3.34Å; R593-D598 VanDerWaalsContact NE-OD1 3.12Å; R593-D598 IonicContact NE-OD2 3Å; R593-D598 PolarHBondContact NE-OD2 3.41Å; R593-D598 IonicContact NH2-OD1 3.02Å; R593-D598 IonicContact NH2-OD2 3.66Å; R593-D598 PolarHBondContact NH2-OD2 3.17Å; D594-D598 PolarHBondContact O-N 3.46Å; D598-L601 PolarHBondContact O-N 2.89Å; D598-I602 WeakPolarHBondContact O-CG1 3.41Å; D598-I602 PolarHBondContact O-N 3.36Å
599	F	97	Very high	94.7	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.1	-44.6	173.8	-173.4	-90.6	0	0	0	113.1	L570 V595 T597 L601 I602 L603 L848 Q851 A852 H855 F864 L865	L570-F599 HydrophobicContact CD1-CD1 4.01Å; L570-F599 HydrophobicContact CD2-CD1 3.69Å; L570-F599 HydrophobicContact CD2-CE1 4.04Å; V595-F599 WeakPolarHBondContact O-CB 3.42Å; V595-F599 PolarHBondContact O-N 3.07Å; V595-F599 VanDerWaalsContact O-N 3.09Å; T597-F599 VanDerWaalsContact C-N 3.29Å; T597-F599 PolarHBondContact O-N 2.73Å; F599-L601 VanDerWaalsContact C-N 3.28Å; F599-L601 PolarHBondContact O-N 2.79Å; F599-I602 WeakPolarHBondContact O-CB 3.42Å; F599-I602 PolarHBondContact O-N 3Å; F599-L603 HydrophobicContact CD1-CD1 4.13Å; F599-L603 HydrophobicContact CD1-CG 4.45Å; F599-L603 HydrophobicContact CE1-CD1 3.66Å; F599-L603 HydrophobicContact CE1-CG 4.12Å; F599-L603 PolarHBondContact O-N 3.13Å; F599-L848 HydrophobicContact CB-CD1 3.76Å; F599-L848 HydrophobicContact CD2-CD1 3.32Å; F599-L848 HydrophobicContact CD2-CD2 4.48Å; F599-L848 HydrophobicContact CD2-CG 3.72Å; F599-L848 HydrophobicContact CE2-CD1 4.1Å; F599-L848 HydrophobicContact CE2-CG 4.27Å; F599-L848 HydrophobicContact CG-CD1 3.73Å; F599-Q851 HydrophobicContact CE1-CB 4Å; F599-Q851 HydrophobicContact CE2-CB 4Å; F599-Q851 HydrophobicContact CZ-CB 3.56Å; F599-A852 HydrophobicContact CE2-CB 4.03Å; F599-H855 AromaticContact CE1-CD2 3.74Å; F599-H855 AromaticContact CZ-CD2 3.95Å; F599-F864 AromaticContact CD2-CE1 3.69Å; F599-F864 HydrophobicContact CD2-CE1 3.69Å; F599-F864 HydrophobicContact CD2-CZ 4.43Å; F599-F864 HydrophobicContact CE2-CD1 4.1Å; F599-F864 AromaticContact CE2-CE1 3.26Å; F599-F864 HydrophobicContact CE2-CE1 3.26Å; F599-F864 AromaticContact CE2-CZ 3.93Å; F599-F864 HydrophobicContact CE2-CZ 3.93Å; F599-F864 AromaticContact CZ-CE1 3.8Å; F599-F864 HydrophobicContact CZ-CE1 3.8Å; F599-F864 HydrophobicContact CZ-CZ 4.01Å; F599-L865 HydrophobicContact CD2-CD2 4.28Å
600	L	97.8	Very high	94.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.4	-39.8	175.8	174.3	64.8	0	0	0	111	T518 V566 L569 L570 L573 V587 N596 T597 I602 L603 L604	T518-L600 HydrophobicContact CG2-CD2 4.06Å; V566-L600 HydrophobicContact CG1-CB 4Å; V566-L600 HydrophobicContact CG1-CD2 3.93Å; L569-L600 HydrophobicContact CD2-CD1 3.86Å; L569-L600 HydrophobicContact CD2-CD2 3.9Å; L569-L600 HydrophobicContact CG-CD1 4.11Å; L570-L600 HydrophobicContact CD2-CB 4.01Å; L570-L600 HydrophobicContact CD2-CD1 3.96Å; L573-L600 HydrophobicContact CD1-CD1 3.66Å; V587-L600 HydrophobicContact CG1-CD2 4.49Å; V587-L600 HydrophobicContact CG2-CD2 4.07Å; N596-L600 VanDerWaalsContact O-CB 3.26Å; N596-L600 WeakPolarHBondContact O-CB 3.43Å; N596-L600 PolarHBondContact O-N 2.88Å; T597-L600 WeakPolarHBondContact O-CB 3.47Å; T597-L600 PolarHBondContact O-N 3.33Å; T597-L600 VanDerWaalsContact O-N 3.15Å; L600-I602 VanDerWaalsContact C-N 3.3Å; L600-I602 PolarHBondContact O-N 3.29Å; L600-L603 PolarHBondContact O-N 3.3Å; L600-L604 HydrophobicContact CD1-CD1 3.86Å; L600-L604 HydrophobicContact CD1-CD2 4.34Å; L600-L604 HydrophobicContact CD1-CG 3.83Å; L600-L604 HydrophobicContact CD2-CD1 4.05Å; L600-L604 HydrophobicContact CG-CD1 3.59Å; L600-L604 HydrophobicContact CG-CG 4.04Å; L600-L604 WeakPolarHBondContact O-CB 3.34Å; L600-L604 VanDerWaalsContact O-CG 3.31Å; L600-L604 WeakPolarHBondContact O-CG 3.39Å; L600-L604 PolarHBondContact O-N 3.38Å
601	L	97.6	Very high	94.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.9	-35.4	177.7	-65.7	178.9	0	0	0	112.4	V587 T597 D598 F599 K605 L618 F628 Y631 F632 V869	V587-L601 HydrophobicContact CG1-CD2 4.48Å; V587-L601 HydrophobicContact CG2-CD2 4.38Å; T597-L601 WeakPolarHBondContact O-CG 3.29Å; T597-L601 PolarHBondContact O-N 3.39Å; D598-L601 PolarHBondContact O-N 2.89Å; F599-L601 VanDerWaalsContact C-N 3.28Å; F599-L601 PolarHBondContact O-N 2.79Å; L601-K605 VanDerWaalsContact O-CB 3.31Å; L601-K605 WeakPolarHBondContact O-CB 3.41Å; L601-K605 PolarHBondContact O-N 2.63Å; L601-L618 HydrophobicContact CD2-CD1 4.46Å; L601-L618 HydrophobicContact CD2-CD2 3.6Å; L601-F628 HydrophobicContact CD1-CD1 4.14Å; L601-F628 HydrophobicContact CD1-CE1 3.82Å; L601-Y631 HydrophobicContact CB-CE1 4.5Å; L601-F632 HydrophobicContact CB-CZ 4.34Å; L601-F632 HydrophobicContact CD2-CE2 4.16Å; L601-F632 HydrophobicContact CD2-CZ 4.08Å; L601-V869 HydrophobicContact CD1-CG2 3.95Å
602	I	96.9	Very high	95.1	Very high	10 Å²	10	38.7 Å²	38.7	5%	0.051	20%	0.196	C	C	.	.	H	α-helix	trans	-60.3	-49.7	172.9	-57.6	168.7	0	0	0	110.1	D598 F599 L600 K605 G606 F864 L865 K867 A868	D598-I602 WeakPolarHBondContact O-CG1 3.41Å; D598-I602 PolarHBondContact O-N 3.36Å; F599-I602 WeakPolarHBondContact O-CB 3.42Å; F599-I602 PolarHBondContact O-N 3Å; L600-I602 VanDerWaalsContact C-N 3.3Å; L600-I602 PolarHBondContact O-N 3.29Å; I602-K605 PolarHBondContact O-N 3.07Å; I602-G606 PolarHBondContact O-N 3.49Å; I602-F864 HydrophobicContact CB-CE1 4.27Å; I602-F864 HydrophobicContact CB-CZ 3.94Å; I602-F864 HydrophobicContact CD1-CD1 4.41Å; I602-F864 HydrophobicContact CD1-CE1 3.89Å; I602-F864 HydrophobicContact CD1-CZ 4.43Å; I602-F864 HydrophobicContact CG2-CD1 4.47Å; I602-F864 HydrophobicContact CG2-CD2 4.22Å; I602-F864 HydrophobicContact CG2-CE1 3.89Å; I602-F864 HydrophobicContact CG2-CE2 3.62Å; I602-F864 HydrophobicContact CG2-CZ 3.45Å; I602-F864 VanDerWaalsContact CG2-CZ 3.45Å; I602-L865 HydrophobicContact CD1-CD2 4.43Å; I602-K867 HydrophobicContact CG2-CB 4.02Å; I602-A868 HydrophobicContact CD1-CB 3.87Å; I602-A868 HydrophobicContact CG1-CB 4.35Å
603	L	97.1	Very high	95.4	Very high	19 Å²	19	41.1 Å²	41.1	10%	0.099	22%	0.221	C	C	.	.	H	α-helix	trans	-63.2	-46.7	179.7	-66.3	-177.5	0	0	0	111.5	L570 L573 F599 L600 K605 G606 L607 H855 M856 F864	L570-L603 HydrophobicContact CD2-CD1 3.77Å; L573-L603 HydrophobicContact CD1-CB 4.36Å; L573-L603 HydrophobicContact CD1-CD1 3.94Å; F599-L603 HydrophobicContact CD1-CD1 4.13Å; F599-L603 HydrophobicContact CD1-CG 4.45Å; F599-L603 HydrophobicContact CE1-CD1 3.66Å; F599-L603 HydrophobicContact CE1-CG 4.12Å; F599-L603 PolarHBondContact O-N 3.13Å; L600-L603 PolarHBondContact O-N 3.3Å; L603-K605 VanDerWaalsContact C-N 3.3Å; L603-K605 PolarHBondContact O-N 3.13Å; L603-G606 PolarHBondContact O-N 3.42Å; L603-G606 VanDerWaalsContact O-N 3.13Å; L603-L607 WeakPolarHBondContact O-CB 3.33Å; L603-L607 PolarHBondContact O-N 3.28Å; L603-H855 HydrophobicContact CD1-CB 4.4Å; L603-H855 HydrophobicContact CD2-CB 3.87Å; L603-M856 HydrophobicContact CD2-CG 4.43Å; L603-F864 HydrophobicContact CD2-CE2 3.76Å; L603-F864 HydrophobicContact CD2-CZ 3.61Å; L603-F864 HydrophobicContact CG-CZ 4.17Å
604	L	97.6	Very high	95.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64.1	-35.6	-179.4	-69.2	171.1	0	0	0	112	L579 V585 V587 L600 L607 Q608 L616	L579-L604 HydrophobicContact CD1-CD2 4.47Å; V585-L604 HydrophobicContact CB-CD2 4.48Å; V585-L604 HydrophobicContact CG1-CD1 4.09Å; V585-L604 HydrophobicContact CG1-CD2 4.19Å; V585-L604 HydrophobicContact CG2-CD2 4.44Å; V587-L604 HydrophobicContact CG2-CD1 3.62Å; L600-L604 HydrophobicContact CD1-CD1 3.86Å; L600-L604 HydrophobicContact CD1-CD2 4.34Å; L600-L604 HydrophobicContact CD1-CG 3.83Å; L600-L604 HydrophobicContact CD2-CD1 4.05Å; L600-L604 HydrophobicContact CG-CD1 3.59Å; L600-L604 HydrophobicContact CG-CG 4.04Å; L600-L604 WeakPolarHBondContact O-CB 3.34Å; L600-L604 VanDerWaalsContact O-CG 3.31Å; L600-L604 WeakPolarHBondContact O-CG 3.39Å; L600-L604 PolarHBondContact O-N 3.38Å; L604-L607 HydrophobicContact CD2-CD2 3.93Å; L604-L607 WeakPolarHBondContact O-CB 3.33Å; L604-L607 PolarHBondContact O-N 2.89Å; L604-Q608 WeakPolarHBondContact O-CG 3.38Å; L604-Q608 PolarHBondContact O-N 2.81Å; L604-Q608 VanDerWaalsContact O-N 3.15Å; L604-L616 HydrophobicContact CB-CD2 4.09Å; L604-L616 HydrophobicContact CD1-CD1 3.79Å; L604-L616 HydrophobicContact CD1-CD2 4.46Å
605	K	96.1	Very high	95.9	Very high	85 Å²	85	41.2 Å²	41.2	37%	0.37	22%	0.219	S	C	.	.	H	α-helix	trans	-62.9	-41.2	173.4	-176.8	170	175.1	173.4	0	112.2	L601 I602 L603 Y631 F632	L601-K605 VanDerWaalsContact O-CB 3.31Å; L601-K605 WeakPolarHBondContact O-CB 3.41Å; L601-K605 PolarHBondContact O-N 2.63Å; I602-K605 PolarHBondContact O-N 3.07Å; L603-K605 VanDerWaalsContact C-N 3.3Å; L603-K605 PolarHBondContact O-N 3.13Å; K605-Y631 HydrophobicContact CB-CE1 4.33Å; K605-Y631 HydrophobicContact CD-CD1 4.2Å; K605-Y631 HydrophobicContact CD-CE1 3.52Å; K605-Y631 HydrophobicContact CD-CE2 4.24Å; K605-Y631 WeakPolarHBondContact CE-O 3.33Å; K605-Y631 PolarHBondContact NZ-O 3.48Å; K605-F632 HydrophobicContact CB-CD1 4.35Å; K605-F632 HydrophobicContact CB-CE1 3.69Å; K605-F632 HydrophobicContact CB-CZ 4.34Å; K605-F632 HydrophobicContact CG-CD1 4.38Å; K605-F632 HydrophobicContact CG-CE1 4.2Å
606	G	93.4	Very high	96.1	Very high	38 Å²	38	40.3 Å²	40.3	39%	0.392	21%	0.213	S	C	.	.	H	α-helix	trans	-66.3	-40.5	172.2	0	0	0	0	0	112.4	I602 L603 Q608 R609	I602-G606 PolarHBondContact O-N 3.49Å; L603-G606 PolarHBondContact O-N 3.42Å; L603-G606 VanDerWaalsContact O-N 3.13Å; G606-Q608 VanDerWaalsContact C-N 3.27Å; G606-Q608 PolarHBondContact O-N 2.98Å; G606-R609 WeakPolarHBondContact O-CB 3.28Å; G606-R609 PolarHBondContact O-N 3.28Å; G606-R609 VanDerWaalsContact O-N 3.08Å
607	L	95.2	Very high	96.3	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-60.5	-32.7	-178	-173.6	57.6	0	0	0	113.3	L573 P577 L579 L603 L604 R609 L610 N611 L614	L573-L607 HydrophobicContact CD2-CD2 4.14Å; P577-L607 WeakPolarHBondContact O-CD1 3.46Å; L579-L607 HydrophobicContact CB-CD2 4.21Å; L579-L607 HydrophobicContact CD1-CD2 3.61Å; L579-L607 HydrophobicContact CG-CD2 3.81Å; L603-L607 WeakPolarHBondContact O-CB 3.33Å; L603-L607 PolarHBondContact O-N 3.28Å; L604-L607 HydrophobicContact CD2-CD2 3.93Å; L604-L607 WeakPolarHBondContact O-CB 3.33Å; L604-L607 PolarHBondContact O-N 2.89Å; L607-R609 PolarHBondContact O-N 2.98Å; L607-L610 HydrophobicContact CD1-CB 4.14Å; L607-L610 HydrophobicContact CD1-CD1 4.45Å; L607-L610 PolarHBondContact O-N 2.81Å; L607-N611 HydrophobicContact CD1-CB 4.43Å; L607-N611 PolarHBondContact O-N 3.46Å; L607-L614 HydrophobicContact CD2-CD2 3.5Å; L607-L614 HydrophobicContact CG-CD2 4.06Å
608	Q	95.3	Very high	96.4	Very high	30 Å²	30	37.4 Å²	37.4	14%	0.14	20%	0.198	C	C	.	.	H	α-helix	trans	-55.3	-23.9	175.5	-70.7	-62.8	-53.3	0	0	113.3	P480 V481 L604 G606 L614	P480-Q608 VanDerWaalsContact CB-OE1 3.23Å; V481-Q608 HydrophobicContact CG2-CG 4.38Å; L604-Q608 WeakPolarHBondContact O-CG 3.38Å; L604-Q608 PolarHBondContact O-N 2.81Å; L604-Q608 VanDerWaalsContact O-N 3.15Å; G606-Q608 VanDerWaalsContact C-N 3.27Å; G606-Q608 PolarHBondContact O-N 2.98Å; Q608-L614 PolarHBondContact NE2-O 3.02Å; Q608-L614 VanDerWaalsContact NE2-O 3.13Å; Q608-L614 PolarHBondContact OE1-O 3.15Å
609	R	92.9	Very high	96.4	Very high	222 Å²	222	37.4 Å²	37.4	84%	0.838	20%	0.198	S	C	*	.	H	α-helix	trans	-83.3	-34.5	173.9	-59.3	179.7	-176.7	178.8	-1.7	113	G606 L607	G606-R609 WeakPolarHBondContact O-CB 3.28Å; G606-R609 PolarHBondContact O-N 3.28Å; G606-R609 VanDerWaalsContact O-N 3.08Å; L607-R609 PolarHBondContact O-N 2.98Å
610	L	93.4	Very high	96.2	Very high	122 Å²	122	37.4 Å²	37.4	64%	0.639	20%	0.198	S	C	*	.	H	α-helix	trans	-79.7	-32.7	-179.4	-64.7	175.9	0	0	0	112.1	L607	L607-L610 HydrophobicContact CD1-CB 4.14Å; L607-L610 HydrophobicContact CD1-CD1 4.45Å; L607-L610 PolarHBondContact O-N 2.81Å
611	N	96.1	Very high	95.6	Very high	26 Å²	26	37.7 Å²	37.7	14%	0.139	20%	0.2	C	C	.	.			trans	-135.4	82.6	178	-174.7	-5	0	0	0	110.4	S578 L607 A613 L614	S578-N611 WeakPolarHBondContact O-CB 3.43Å; S578-N611 PolarHBondContact O-ND2 3.33Å; L607-N611 HydrophobicContact CD1-CB 4.43Å; L607-N611 PolarHBondContact O-N 3.46Å; N611-A613 PolarHBondContact O-N 2.91Å; N611-A613 PolarHBondContact OD1-N 2.89Å; N611-L614 HydrophobicContact CB-CB 4.3Å; N611-L614 WeakPolarHBondContact O-CB 3.33Å; N611-L614 PolarHBondContact O-N 2.87Å; N611-L614 PolarHBondContact OD1-N 3.01Å
612	P	95.7	Very high	94.5	Very high	90 Å²	90	38.8 Å²	38.8	58%	0.584	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-16.1	-179.4	-22.1	34.2	0	0	0	114.6	R615	P612-R615 PolarHBondContact O-NH1 3.02Å
613	A	95.4	Very high	93.5	Very high	77 Å²	77	39.4 Å²	39.4	64%	0.636	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-19.4	177.7	0	0	0	0	0	112.5	N611 R615	N611-A613 PolarHBondContact O-N 2.91Å; N611-A613 PolarHBondContact OD1-N 2.89Å; A613-R615 PolarHBondContact O-N 3.39Å
614	L	97.6	Very high	92.8	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	22%	0.223	C	C	.	.			trans	-70.7	122.9	-179.1	-173	74.8	0	0	0	111.1	L579 V582 V585 L607 Q608 N611	L579-L614 HydrophobicContact CD1-CD2 4.32Å; V582-L614 HydrophobicContact CB-CD1 4.08Å; V582-L614 HydrophobicContact CG1-CD1 3.85Å; V582-L614 WeakPolarHBondContact O-CD1 3.34Å; V585-L614 HydrophobicContact CG2-CD1 4.21Å; V585-L614 HydrophobicContact CG2-CD2 4.18Å; L607-L614 HydrophobicContact CD2-CD2 3.5Å; L607-L614 HydrophobicContact CG-CD2 4.06Å; Q608-L614 PolarHBondContact NE2-O 3.02Å; Q608-L614 VanDerWaalsContact NE2-O 3.13Å; Q608-L614 PolarHBondContact OE1-O 3.15Å; N611-L614 HydrophobicContact CB-CB 4.3Å; N611-L614 WeakPolarHBondContact O-CB 3.33Å; N611-L614 PolarHBondContact O-N 2.87Å; N611-L614 PolarHBondContact OD1-N 3.01Å
615	R	98.4	Very high	92.4	Very high	59 Å²	59	41.5 Å²	41.5	22%	0.223	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	129.7	174.2	-60.9	-53.3	-168.4	-139	5	111.5	I476 E477 H479 S583 H584 V585 P612 A613	I476-R615 HydrophobicContact CG2-CB 4.04Å; I476-R615 HydrophobicContact CG2-CG 4.33Å; I476-R615 VanDerWaalsContact O-CD 3.28Å; I476-R615 WeakPolarHBondContact O-CD 3.19Å; I476-R615 PolarHBondContact O-NE 3.16Å; E477-R615 PolarHBondContact O-NE 2.93Å; E477-R615 PolarHBondContact O-NH2 2.86Å; H479-R615 WeakPolarHBondContact O-CD 3.41Å; S583-R615 PolarHBondContact O-N 3.12Å; H584-R615 CarbonylContact C-O 3.47Å; H584-R615 VanDerWaalsContact CA-O 3.23Å; H584-R615 WeakPolarHBondContact CA-O 3.29Å; H584-R615 VanDerWaalsContact CD2-CB 3.45Å; H584-R615 WeakPolarHBondContact CD2-CB 3.19Å; V585-R615 PolarHBondContact N-O 2.85Å; P612-R615 PolarHBondContact O-NH1 3.02Å; A613-R615 PolarHBondContact O-N 3.39Å
616	L	98.5	Very high	92.2	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.016	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	127.4	178.7	178.1	59.3	0	0	0	110.7	P480 V481 V482 V585 V587 L604 L618 F632	P480-L616 PolarHBondContact O-N 2.85Å; V481-L616 CarbonylContact C-O 3.57Å; V481-L616 VanDerWaalsContact CA-O 3.27Å; V481-L616 WeakPolarHBondContact CA-O 3.37Å; V481-L616 HydrophobicContact CB-CB 4.47Å; V481-L616 HydrophobicContact CG1-CB 4.22Å; V481-L616 HydrophobicContact CG1-CD2 4Å; V481-L616 HydrophobicContact CG1-CG 4.08Å; V481-L616 HydrophobicContact CG2-CB 4.16Å; V481-L616 HydrophobicContact CG2-CD2 4.21Å; V482-L616 PolarHBondContact N-O 3.01Å; V585-L616 HydrophobicContact CB-CD1 4.22Å; V585-L616 HydrophobicContact CG1-CD1 4.16Å; V585-L616 WeakPolarHBondContact O-CA 3.32Å; V585-L616 WeakPolarHBondContact O-CD1 3.29Å; V587-L616 HydrophobicContact CG2-CD1 3.98Å; L604-L616 HydrophobicContact CB-CD2 4.09Å; L604-L616 HydrophobicContact CD1-CD1 3.79Å; L604-L616 HydrophobicContact CD1-CD2 4.46Å; L616-L618 HydrophobicContact CD1-CD2 3.94Å; L616-L618 HydrophobicContact CD2-CD2 4.17Å; L616-L618 HydrophobicContact CG-CD2 3.97Å; L616-L618 HydrophobicContact CG-CG 4.43Å; L616-F632 HydrophobicContact CD2-CD1 4.41Å; L616-F632 HydrophobicContact CD2-CE1 3.71Å; L616-F632 HydrophobicContact CD2-CZ 3.8Å
617	V	98.4	Very high	92.1	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	122.6	174.7	-173.7	0	0	0	0	108.9	I476 V482 I484 V585 I586 V587 M619	I476-V617 HydrophobicContact CD1-CG2 3.74Å; I476-V617 HydrophobicContact CG1-CG2 3.95Å; I476-V617 HydrophobicContact CG2-CG2 4.29Å; V482-V617 WeakPolarHBondContact O-CA 3.37Å; I484-V617 HydrophobicContact CD1-CG1 3.59Å; I484-V617 HydrophobicContact CG1-CG1 4.07Å; V585-V617 PolarHBondContact O-N 3.11Å; I586-V617 CarbonylContact C-O 3.54Å; I586-V617 VanDerWaalsContact CA-O 3.31Å; I586-V617 WeakPolarHBondContact CA-O 3.22Å; I586-V617 HydrophobicContact CB-CB 4.45Å; I586-V617 HydrophobicContact CG1-CB 4.07Å; I586-V617 HydrophobicContact CG1-CG2 4.35Å; I586-V617 HydrophobicContact CG2-CB 4.28Å; I586-V617 HydrophobicContact CG2-CG1 4.45Å; V587-V617 PolarHBondContact N-O 2.8Å; V617-M619 HydrophobicContact CG1-CG 3.97Å
618	L	98	Very high	92.2	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	118.9	174.3	-54.3	-178.3	0	0	0	108.3	V481 V482 V483 I484 V587 V590 L601 L616 F628 F632	V481-L618 HydrophobicContact CG1-CD1 4.42Å; V481-L618 HydrophobicContact CG1-CG 4.48Å; V482-L618 PolarHBondContact O-N 2.89Å; V483-L618 CarbonylContact C-O 3.55Å; V483-L618 WeakPolarHBondContact CA-O 3.48Å; V483-L618 HydrophobicContact CG2-CB 4.3Å; V483-L618 HydrophobicContact CG2-CD1 4.24Å; I484-L618 PolarHBondContact N-O 2.66Å; V587-L618 HydrophobicContact CB-CD2 3.81Å; V587-L618 HydrophobicContact CG2-CD2 4.01Å; V590-L618 HydrophobicContact CG1-CB 4.37Å; V590-L618 HydrophobicContact CG1-CD2 4.4Å; L601-L618 HydrophobicContact CD2-CD1 4.46Å; L601-L618 HydrophobicContact CD2-CD2 3.6Å; L616-L618 HydrophobicContact CD1-CD2 3.94Å; L616-L618 HydrophobicContact CD2-CD2 4.17Å; L616-L618 HydrophobicContact CG-CD2 3.97Å; L616-L618 HydrophobicContact CG-CG 4.43Å; L618-F628 HydrophobicContact CD1-CB 4.12Å; L618-F632 HydrophobicContact CD1-CD2 3.67Å; L618-F632 HydrophobicContact CD1-CE2 3.47Å; L618-F632 VanDerWaalsContact CD1-CE2 3.47Å; L618-F632 HydrophobicContact CD1-CZ 4.4Å
619	M	96.1	Very high	92.2	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	132.3	-178.7	-58.3	-170.1	-51.4	0	0	110.8	I484 K492 I496 I586 V587 D588 E589 V590 V617	I484-M619 WeakPolarHBondContact O-CA 3.45Å; K492-M619 HydrophobicContact CB-SD 4.06Å; I496-M619 HydrophobicContact CB-SD 4.29Å; I496-M619 HydrophobicContact CD1-SD 3.65Å; I496-M619 HydrophobicContact CG2-SD 4.45Å; I586-M619 HydrophobicContact CG2-CE 3.36Å; I586-M619 HydrophobicContact CG2-CG 3.88Å; I586-M619 HydrophobicContact CG2-SD 3.68Å; V587-M619 PolarHBondContact O-N 3.07Å; D588-M619 HydrophobicContact CB-CE 3.63Å; D588-M619 WeakPolarHBondContact OD1-CB 3.37Å; D588-M619 VanDerWaalsContact OD1-CE 3.3Å; D588-M619 WeakPolarHBondContact OD1-CE 3.46Å; D588-M619 WeakPolarHBondContact OD2-CE 3.31Å; E589-M619 PolarHBondContact N-O 2.78Å; V590-M619 WeakPolarHBondContact CG2-O 3.39Å; V590-M619 PolarHBondContact N-O 3.38Å; V617-M619 HydrophobicContact CG1-CG 3.97Å
620	S	92.1	Very high	92.4	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	142	-180	-154.9	0	0	0	0	113.1	I484 S485 G486 K492 H591 T622 N625	I484-S620 PolarHBondContact O-N 2.93Å; S485-S620 WeakPolarHBondContact CA-O 3.38Å; G486-S620 PolarHBondContact N-O 2.9Å; K492-S620 VanDerWaalsContact CE-O 3.31Å; K492-S620 WeakPolarHBondContact CE-O 3.35Å; H591-S620 WeakPolarHBondContact CB-OG 3.4Å; H591-S620 PolarHBondContact ND1-OG 3.42Å; S620-T622 PolarHBondContact OG-O 3.1Å; S620-N625 WeakPolarHBondContact CB-OD1 3.44Å
621	A	85.2	Confident	92.5	Very high	5 Å²	5	35.6 Å²	35.6	4%	0.041	19%	0.186	C	C	.	.	S	Bend	trans	-89.5	-40.9	173.3	0	0	0	0	0	112.9	G486 T488 H591	G486-A621 VanDerWaalsContact O-CA 3.25Å; G486-A621 WeakPolarHBondContact O-CA 3.46Å; T488-A621 HydrophobicContact CG2-CB 3.78Å; H591-A621 VanDerWaalsContact CE1-CB 3.43Å; H591-A621 WeakPolarHBondContact CE1-CB 3.32Å; H591-A621 PolarHBondContact CE1-N 2.94Å; H591-A621 PolarHBondContact ND1-N 3.48Å
622	T	76.4	Confident	92.5	Very high	23 Å²	23	35.8 Å²	35.8	14%	0.141	19%	0.185	C	C	.	.	S	Bend	trans	-134.2	-174.3	177.6	60.1	0	0	0	0	109.1	H591 S620 I806 Q807	H591-T622 WeakPolarHBondContact CB-O 3.3Å; S620-T622 PolarHBondContact OG-O 3.1Å; T622-I806 HydrophobicContact CG2-CG2 4.32Å; T622-Q807 HydrophobicContact CG2-CG 3.8Å; T622-Q807 PolarHBondContact OG1-NE2 3.43Å
623	G	74	Confident	92.4	Very high	23 Å²	23	34.9 Å²	34.9	24%	0.237	19%	0.193	C	C	.	.	S	Bend	trans	105.7	174.4	171.2	0	0	0	0	0	115.8	N625	G623-N625 VanDerWaalsContact C-N 3.33Å; G623-N625 PolarHBondContact O-N 3.11Å; G623-N625 VanDerWaalsContact O-N 3.1Å
624	D	82.3	Confident	92.4	Very high	47 Å²	47	33.7 Å²	33.7	25%	0.251	19%	0.188	S	C	.	.			trans	-81.2	73.8	176.5	-175.9	-0	0	0	0	110	E626 R627 R630 F835	D624-E626 PolarHBondContact O-N 3.36Å; D624-R627 HydrophobicContact CB-CB 4.09Å; D624-R627 VanDerWaalsContact CG-CB 3.49Å; D624-R627 WeakPolarHBondContact O-CB 3.42Å; D624-R627 PolarHBondContact O-N 3.24Å; D624-R627 PolarHBondContact OD1-N 3Å; D624-R627 VanDerWaalsContact OD1-N 3.15Å; D624-R627 WeakPolarHBondContact OD2-CB 3.46Å; D624-R627 IonicContact OD2-CZ 3.54Å; D624-R627 IonicContact OD2-NE 3.11Å; D624-R627 PolarHBondContact OD2-NE 2.79Å; D624-R627 IonicContact OD2-NH2 2.8Å; D624-R627 PolarHBondContact OD2-NH2 2.86Å; D624-R630 IonicContact OD2-NH2 2.93Å; D624-F835 HydrophobicContact CB-CE2 4.35Å
625	N	89.3	Confident	92.3	Very high	17 Å²	17	34.3 Å²	34.3	9%	0.091	19%	0.192	C	C	.	.	H	α-helix	trans	-59.7	-30.3	-178.1	-63.1	-52.9	0	0	0	113.2	V483 S485 S620 G623 R627 F628 S629 V637	V483-N625 HydrophobicContact CG1-CB 4.1Å; S485-N625 WeakPolarHBondContact CB-ND2 3.46Å; S485-N625 PolarHBondContact OG-ND2 3.16Å; S620-N625 WeakPolarHBondContact CB-OD1 3.44Å; G623-N625 VanDerWaalsContact C-N 3.33Å; G623-N625 PolarHBondContact O-N 3.11Å; G623-N625 VanDerWaalsContact O-N 3.1Å; N625-R627 PolarHBondContact O-N 2.87Å; N625-F628 PolarHBondContact O-N 3.28Å; N625-S629 PolarHBondContact O-N 3.08Å; N625-V637 HydrophobicContact CB-CG1 4.06Å
626	E	92.1	Very high	92.3	Very high	92 Å²	92	33.3 Å²	33.3	43%	0.43	19%	0.193	S	C	.	.	H	α-helix	trans	-64.3	-29.1	174.7	-64.1	-57.7	151.3	0	0	111.8	D624 S629 R630	D624-E626 PolarHBondContact O-N 3.36Å; E626-S629 PolarHBondContact O-N 3.36Å; E626-R630 WeakPolarHBondContact O-CB 3.44Å; E626-R630 VanDerWaalsContact O-CG 3.27Å; E626-R630 WeakPolarHBondContact O-CG 3.2Å; E626-R630 PolarHBondContact O-N 3.4Å; E626-R630 PolarHBondContact O-NE 3.32Å
627	R	93	Very high	92.2	Very high	83 Å²	83	34.9 Å²	34.9	31%	0.313	20%	0.203	S	C	.	.	H	α-helix	trans	-64.2	-44.8	172.2	-172.4	-179.2	-63	-138.7	-3.8	111.9	D624 N625 R630 Y631 V869 D870	D624-R627 HydrophobicContact CB-CB 4.09Å; D624-R627 VanDerWaalsContact CG-CB 3.49Å; D624-R627 WeakPolarHBondContact O-CB 3.42Å; D624-R627 PolarHBondContact O-N 3.24Å; D624-R627 PolarHBondContact OD1-N 3Å; D624-R627 VanDerWaalsContact OD1-N 3.15Å; D624-R627 WeakPolarHBondContact OD2-CB 3.46Å; D624-R627 IonicContact OD2-CZ 3.54Å; D624-R627 IonicContact OD2-NE 3.11Å; D624-R627 PolarHBondContact OD2-NE 2.79Å; D624-R627 IonicContact OD2-NH2 2.8Å; D624-R627 PolarHBondContact OD2-NH2 2.86Å; N625-R627 PolarHBondContact O-N 2.87Å; R627-R630 PolarHBondContact O-N 2.99Å; R627-Y631 VanDerWaalsContact O-CB 3.25Å; R627-Y631 WeakPolarHBondContact O-CB 3.29Å; R627-Y631 PolarHBondContact O-N 3.38Å; R627-V869 HydrophobicContact CG-CG1 3.93Å; R627-D870 IonicContact NH1-OD1 2.77Å; R627-D870 PolarHBondContact NH1-OD1 3.15Å; R627-D870 IonicContact NH1-OD2 3.69Å; R627-D870 PolarHBondContact NH1-OD2 3.03Å
628	F	95.3	Very high	92	Very high	5 Å²	5	35.7 Å²	35.7	2%	0.022	21%	0.207	C	C	.	.	H	α-helix	trans	-65.4	-41.7	176.1	-64.9	-64	0	0	0	111.4	V483 V590 L601 L618 N625 Y631 F632 V869	V483-F628 HydrophobicContact CG2-CB 4.07Å; V590-F628 HydrophobicContact CB-CE1 4.34Å; V590-F628 HydrophobicContact CB-CE2 4.11Å; V590-F628 HydrophobicContact CB-CZ 3.86Å; V590-F628 HydrophobicContact CG2-CD2 3.97Å; V590-F628 HydrophobicContact CG2-CE2 3.54Å; V590-F628 HydrophobicContact CG2-CZ 3.84Å; V590-F628 WeakPolarHBondContact O-CZ 3.39Å; L601-F628 HydrophobicContact CD1-CD1 4.14Å; L601-F628 HydrophobicContact CD1-CE1 3.82Å; L618-F628 HydrophobicContact CD1-CB 4.12Å; N625-F628 PolarHBondContact O-N 3.28Å; F628-Y631 PolarHBondContact O-N 3.35Å; F628-F632 WeakPolarHBondContact O-CD2 3.34Å; F628-F632 PolarHBondContact O-N 2.95Å; F628-F632 VanDerWaalsContact O-N 3.08Å; F628-V869 HydrophobicContact CD1-CG2 4.38Å; F628-V869 HydrophobicContact CE1-CG1 4.36Å; F628-V869 HydrophobicContact CE1-CG2 4.23Å
629	S	96.3	Very high	91.8	Very high	9 Å²	9	42.7 Å²	42.7	6%	0.063	24%	0.238	C	C	.	.	H	α-helix	trans	-55.7	-54.5	173.5	174.5	0	0	0	0	111.6	N625 E626 Y631 F632 G633 G634 C635	N625-S629 PolarHBondContact O-N 3.08Å; E626-S629 PolarHBondContact O-N 3.36Å; S629-Y631 VanDerWaalsContact C-N 3.33Å; S629-Y631 PolarHBondContact O-N 2.86Å; S629-F632 CarbonylContact O-C 3.57Å; S629-F632 PolarHBondContact O-N 3.43Å; S629-G633 PolarHBondContact O-N 3.47Å; S629-G634 WeakPolarHBondContact O-CA 3.29Å; S629-G634 PolarHBondContact O-N 3.36Å; S629-G634 WeakPolarHBondContact OG-CA 3.43Å; S629-C635 WeakPolarHBondContact CB-O 3.49Å; S629-C635 PolarHBondContact O-N 3.36Å; S629-C635 PolarHBondContact OG-N 3.42Å; S629-C635 PolarHBondContact OG-O 2.86Å
630	R	96.4	Very high	91.4	Very high	158 Å²	158	42.9 Å²	42.9	60%	0.596	24%	0.239	S	C	*	.	H	α-helix	trans	-58.3	-43	177.4	-74.1	-179.5	-67.3	136.6	-6	112.4	D624 E626 R627 F632 G633	D624-R630 IonicContact OD2-NH2 2.93Å; E626-R630 WeakPolarHBondContact O-CB 3.44Å; E626-R630 VanDerWaalsContact O-CG 3.27Å; E626-R630 WeakPolarHBondContact O-CG 3.2Å; E626-R630 PolarHBondContact O-N 3.4Å; E626-R630 PolarHBondContact O-NE 3.32Å; R627-R630 PolarHBondContact O-N 2.99Å; R630-F632 VanDerWaalsContact C-N 3.26Å; R630-F632 PolarHBondContact O-N 2.92Å; R630-G633 PolarHBondContact O-N 3.2Å
631	Y	96.1	Very high	90.9	Very high	30 Å²	30	46.7 Å²	46.7	12%	0.118	26%	0.263	C	S	.	.	H	α-helix	trans	-60.2	-36.1	179.5	178.2	-98.4	0	0	0	112.5	L601 K605 R627 F628 S629 K867 V869	L601-Y631 HydrophobicContact CB-CE1 4.5Å; K605-Y631 HydrophobicContact CB-CE1 4.33Å; K605-Y631 HydrophobicContact CD-CD1 4.2Å; K605-Y631 HydrophobicContact CD-CE1 3.52Å; K605-Y631 HydrophobicContact CD-CE2 4.24Å; K605-Y631 WeakPolarHBondContact CE-O 3.33Å; K605-Y631 PolarHBondContact NZ-O 3.48Å; R627-Y631 VanDerWaalsContact O-CB 3.25Å; R627-Y631 WeakPolarHBondContact O-CB 3.29Å; R627-Y631 PolarHBondContact O-N 3.38Å; F628-Y631 PolarHBondContact O-N 3.35Å; S629-Y631 VanDerWaalsContact C-N 3.33Å; S629-Y631 PolarHBondContact O-N 2.86Å; Y631-K867 WeakPolarHBondContact CE2-O 3.45Å; Y631-K867 VanDerWaalsContact CZ-O 3.23Å; Y631-K867 PolarHBondContact OH-O 3.33Å; Y631-V869 HydrophobicContact CD1-CG2 4.05Å; Y631-V869 HydrophobicContact CD2-CG2 4.13Å; Y631-V869 HydrophobicContact CE1-CG2 4.14Å; Y631-V869 HydrophobicContact CE2-CG2 4.21Å; Y631-V869 HydrophobicContact CG-CG2 4.04Å
632	F	96.4	Very high	90.1	Very high	29 Å²	29	47.7 Å²	47.7	13%	0.127	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	17.6	175.3	-75	-80.3	0	0	0	114	V481 L601 K605 L616 L618 F628 S629 R630	V481-F632 HydrophobicContact CB-CB 4.34Å; V481-F632 HydrophobicContact CG1-CB 4.06Å; V481-F632 HydrophobicContact CG1-CD1 4.19Å; V481-F632 HydrophobicContact CG1-CD2 4.27Å; V481-F632 HydrophobicContact CG1-CG 3.92Å; V481-F632 HydrophobicContact CG2-CB 4.36Å; V481-F632 HydrophobicContact CG2-CD1 3.9Å; V481-F632 HydrophobicContact CG2-CG 4.31Å; L601-F632 HydrophobicContact CB-CZ 4.34Å; L601-F632 HydrophobicContact CD2-CE2 4.16Å; L601-F632 HydrophobicContact CD2-CZ 4.08Å; K605-F632 HydrophobicContact CB-CD1 4.35Å; K605-F632 HydrophobicContact CB-CE1 3.69Å; K605-F632 HydrophobicContact CB-CZ 4.34Å; K605-F632 HydrophobicContact CG-CD1 4.38Å; K605-F632 HydrophobicContact CG-CE1 4.2Å; L616-F632 HydrophobicContact CD2-CD1 4.41Å; L616-F632 HydrophobicContact CD2-CE1 3.71Å; L616-F632 HydrophobicContact CD2-CZ 3.8Å; L618-F632 HydrophobicContact CD1-CD2 3.67Å; L618-F632 HydrophobicContact CD1-CE2 3.47Å; L618-F632 VanDerWaalsContact CD1-CE2 3.47Å; L618-F632 HydrophobicContact CD1-CZ 4.4Å; F628-F632 WeakPolarHBondContact O-CD2 3.34Å; F628-F632 PolarHBondContact O-N 2.95Å; F628-F632 VanDerWaalsContact O-N 3.08Å; S629-F632 CarbonylContact O-C 3.57Å; S629-F632 PolarHBondContact O-N 3.43Å; R630-F632 VanDerWaalsContact C-N 3.26Å; R630-F632 PolarHBondContact O-N 2.92Å
633	G	94.4	Very high	89.8	Confident	72 Å²	72	53.3 Å²	53.3	74%	0.742	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.5	27.1	172.6	0	0	0	0	0	115.3	S629 R630	S629-G633 PolarHBondContact O-N 3.47Å; R630-G633 PolarHBondContact O-N 3.2Å
634	G	94.5	Very high	89.5	Confident	52 Å²	52	54.9 Å²	54.9	54%	0.536	30%	0.299	S	S	.	.	S	Bend	trans	83.5	35	178.3	0	0	0	0	0	113.7	S629	S629-G634 WeakPolarHBondContact O-CA 3.29Å; S629-G634 PolarHBondContact O-N 3.36Å; S629-G634 WeakPolarHBondContact OG-CA 3.43Å
635	C	96.2	Very high	89.5	Confident	13 Å²	13	56.9 Å²	56.9	9%	0.088	30%	0.303	C	S	.	.			trans	-66.8	153.9	179.5	68.6	0	0	0	0	112.2	V481 S629	V481-C635 HydrophobicContact CB-CB 4.06Å; V481-C635 HydrophobicContact CG1-CB 4.44Å; V481-C635 VanDerWaalsContact O-CB 3.31Å; V481-C635 WeakPolarHBondContact O-CB 3.28Å; S629-C635 WeakPolarHBondContact CB-O 3.49Å; S629-C635 PolarHBondContact O-N 3.36Å; S629-C635 PolarHBondContact OG-N 3.42Å; S629-C635 PolarHBondContact OG-O 2.86Å
636	P	97.2	Very high	89.5	Confident	38 Å²	38	60.5 Å²	60.5	25%	0.247	33%	0.328	C	S	.	.			trans	-63.9	139.8	-173.7	25.8	-36	0	0	0	112.4	H479 V482 V483	H479-P636 HydrophobicContact CB-CG 4.09Å; V482-P636 HydrophobicContact CG1-CG 4.41Å; V482-P636 HydrophobicContact CG2-CG 4.12Å; V483-P636 PolarHBondContact N-O 3.4Å
637	V	96.5	Very high	89.4	Confident	36 Å²	36	57.5 Å²	57.5	22%	0.218	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	107.4	173.3	-174.7	0	0	0	0	109	V483 N625	V483-V637 HydrophobicContact CB-CG1 4.44Å; V483-V637 HydrophobicContact CB-CG2 4.16Å; V483-V637 HydrophobicContact CG1-CG1 4.29Å; V483-V637 CarbonylContact O-C 3.53Å; V483-V637 WeakPolarHBondContact O-CA 3.36Å; N625-V637 HydrophobicContact CB-CG1 4.06Å
638	I	95.4	Very high	89.6	Confident	17 Å²	17	59.4 Å²	59.4	9%	0.087	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	120.7	173.8	-60.9	-180	0	0	0	108.7	T471 I472 A475 V482 V483 I484 S485 V640	T471-I638 HydrophobicContact CG2-CD1 4.35Å; I472-I638 HydrophobicContact CG1-CD1 4.19Å; I472-I638 HydrophobicContact CG1-CG2 4.12Å; A475-I638 HydrophobicContact CB-CD1 3.51Å; A475-I638 HydrophobicContact CB-CG1 4.46Å; V482-I638 HydrophobicContact CG1-CD1 4.1Å; V482-I638 HydrophobicContact CG1-CG1 4.31Å; V483-I638 PolarHBondContact O-N 3.48Å; I484-I638 WeakPolarHBondContact CA-O 3.46Å; S485-I638 PolarHBondContact N-O 3.42Å; I638-V640 HydrophobicContact CG2-CG2 4.35Å
639	K	92.9	Very high	89.7	Confident	148 Å²	148	61.8 Å²	61.8	64%	0.643	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	116.3	172.8	-65.1	-178.1	-176.3	175.7	0	109.5	S485	S485-K639 CarbonylContact O-C 3.56Å; S485-K639 WeakPolarHBondContact O-CA 3.49Å
640	V	88.8	Confident	89.7	Confident	3 Å²	3	62 Å²	62	2%	0.018	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	111.1	170.7	-179.6	0	0	0	0	107.1	V465 I472 I484 S485 G486 C490 I638 G642	V465-V640 HydrophobicContact CB-CG1 4.01Å; V465-V640 HydrophobicContact CG2-CG1 4.34Å; V465-V640 HydrophobicContact CG2-CG2 4.3Å; I472-V640 HydrophobicContact CD1-CG2 4.08Å; I484-V640 HydrophobicContact CG2-CG2 4.03Å; S485-V640 PolarHBondContact O-N 2.95Å; G486-V640 WeakPolarHBondContact CA-O 3.4Å; C490-V640 HydrophobicContact CB-CG1 4.27Å; I638-V640 HydrophobicContact CG2-CG2 4.35Å; V640-G642 PolarHBondContact O-N 2.91Å
641	P	80.6	Confident	89.7	Confident	80 Å²	80	55.5 Å²	55.5	52%	0.519	31%	0.313	S	S	.	.			trans	-60.9	136.3	176.3	26.7	-31.8	0	0	0	109.7	P464 H468	P464-P641 WeakPolarHBondContact CB-O 3.23Å; H468-P641 VanDerWaalsContact NE2-CD 3.3Å; H468-P641 WeakPolarHBondContact NE2-CD 3.37Å
642	G	69	Low	89.6	Confident	26 Å²	26	55.2 Å²	55.2	27%	0.268	31%	0.313	S	S	.	.			trans	-76.8	139.3	167.7	0	0	0	0	0	110.7	D487 V640	D487-G642 WeakPolarHBondContact OD2-CA 3.36Å; D487-G642 PolarHBondContact OD2-N 3.05Å; V640-G642 PolarHBondContact O-N 2.91Å
643	F	69.2	Low	89.4	Confident	141 Å²	141	57.2 Å²	57.2	62%	0.618	32%	0.323	S	S	*	.			trans	-95.3	101.4	152.1	-174	-96.5	0	0	0	106.5	P464 Y645	P464-F643 HydrophobicContact CG-CB 3.79Å; F643-Y645 HydrophobicContact CD1-CE2 4.48Å; F643-Y645 HydrophobicContact CE1-CD1 4.33Å; F643-Y645 HydrophobicContact CE1-CD2 4.19Å; F643-Y645 HydrophobicContact CE1-CE1 4.13Å; F643-Y645 AromaticContact CE1-CE2 3.98Å; F643-Y645 HydrophobicContact CE1-CE2 3.98Å; F643-Y645 HydrophobicContact CE1-CG 4.36Å; F643-Y645 AromaticContact CE1-CZ 3.95Å
644	M	68.6	Low	89.5	Confident	56 Å²	56	55.9 Å²	55.9	28%	0.276	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-103.9	133.1	165	-69.7	-172.1	-67.8	0	0	107.4	D487	D487-M644 HydrophobicContact CB-CE 4.32Å
645	Y	82	Confident	89.5	Confident	89 Å²	89	53.5 Å²	53.5	35%	0.349	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-59	148.5	164.4	-69.2	-92.9	0	0	0	108.9	F643 V647 G813 C815 Q816 S817	F643-Y645 HydrophobicContact CD1-CE2 4.48Å; F643-Y645 HydrophobicContact CE1-CD1 4.33Å; F643-Y645 HydrophobicContact CE1-CD2 4.19Å; F643-Y645 HydrophobicContact CE1-CE1 4.13Å; F643-Y645 AromaticContact CE1-CE2 3.98Å; F643-Y645 HydrophobicContact CE1-CE2 3.98Å; F643-Y645 HydrophobicContact CE1-CG 4.36Å; F643-Y645 AromaticContact CE1-CZ 3.95Å; Y645-V647 PolarHBondContact O-N 2.73Å; Y645-G813 WeakPolarHBondContact CB-O 3.47Å; Y645-G813 PolarHBondContact N-O 3.12Å; Y645-C815 VanDerWaalsContact CE2-O 3.31Å; Y645-C815 WeakPolarHBondContact CE2-O 3.1Å; Y645-Q816 WeakPolarHBondContact CB-O 3.02Å; Y645-Q816 VanDerWaalsContact CG-C 3.47Å; Y645-S817 VanDerWaalsContact CB-N 3.31Å
646	P	88.4	Confident	89.3	Confident	94 Å²	94	53.9 Å²	53.9	61%	0.61	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-58.3	131.7	-177	23.3	-33.2	0	0	0	110.9	S817 G818	P646-S817 WeakPolarHBondContact CG-OG 3.35Å; P646-S817 WeakPolarHBondContact O-CA 3.45Å; P646-S817 WeakPolarHBondContact O-CB 3.47Å; P646-G818 PolarHBondContact O-N 2.68Å; P646-G818 VanDerWaalsContact O-N 3.1Å
647	V	91.3	Very high	89	Confident	28 Å²	28	55.2 Å²	55.2	17%	0.17	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	116.2	173.1	-178.7	0	0	0	0	108.2	Y645 E649 R809 A812 G818 A820	Y645-V647 PolarHBondContact O-N 2.73Å; V647-E649 PolarHBondContact O-N 3.48Å; V647-R809 HydrophobicContact CB-CG 4.26Å; V647-R809 HydrophobicContact CG1-CG 3.85Å; V647-A812 HydrophobicContact CG1-CB 4.09Å; V647-A812 HydrophobicContact CG2-CB 4.07Å; V647-G818 CarbonylContact C-O 3.54Å; V647-G818 VanDerWaalsContact CA-O 3.29Å; V647-G818 WeakPolarHBondContact CA-O 3.45Å; V647-A820 HydrophobicContact CG1-CB 3.73Å
648	K	96.1	Very high	88.8	Confident	124 Å²	124	57.4 Å²	57.4	54%	0.539	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	120.1	176.9	-171.1	175.8	-172.5	174.6	0	109.6	G818 F819 A820	K648-G818 PolarHBondContact N-O 2.85Å; K648-F819 HydrophobicContact CB-CD1 3.85Å; K648-F819 HydrophobicContact CB-CE1 4.18Å; K648-F819 HydrophobicContact CD-CD1 4.29Å; K648-F819 HydrophobicContact CD-CE1 4.11Å; K648-F819 WeakPolarHBondContact O-CA 3.3Å; K648-A820 PolarHBondContact O-N 2.76Å
649	E	96.9	Very high	88.6	Confident	54 Å²	54	58.4 Å²	58.4	25%	0.252	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	132.9	-178.8	-59	-171.6	-130.2	0	0	111.3	V647 Y651 R809 A820 H822	V647-E649 PolarHBondContact O-N 3.48Å; E649-Y651 HydrophobicContact CB-CE2 3.94Å; E649-Y651 PolarHBondContact OE2-OH 3.36Å; E649-R809 HydrophobicContact CG-CG 4.46Å; E649-R809 WeakPolarHBondContact OE1-CD 3.5Å; E649-R809 IonicContact OE1-CZ 2.97Å; E649-R809 IonicContact OE1-NE 3.61Å; E649-R809 IonicContact OE1-NH1 3.33Å; E649-R809 PolarHBondContact OE1-NH1 2.85Å; E649-A820 CarbonylContact C-O 3.56Å; E649-A820 WeakPolarHBondContact CA-O 3.28Å; E649-A820 HydrophobicContact CG-CB 4.45Å; E649-H822 IonicContact OE2-CD2 3.03Å; E649-H822 IonicContact OE2-NE2 3.36Å; E649-H822 PolarHBondContact OE2-NE2 3.39Å
650	H	97.4	Very high	88.3	Confident	13 Å²	13	53.9 Å²	53.9	6%	0.06	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	121.9	175.1	-69	-61.6	0	0	0	108.4	D654 I655 K658 A820 Y821 H822	H650-D654 WeakPolarHBondContact CA-OD2 3.48Å; H650-D654 HydrophobicContact CB-CB 4.26Å; H650-I655 HydrophobicContact CB-CG1 4.15Å; H650-K658 WeakPolarHBondContact CE1-CE 3.18Å; H650-K658 WeakPolarHBondContact ND1-CE 3.36Å; H650-A820 PolarHBondContact N-O 3.4Å; H650-Y821 HydrophobicContact CB-CD1 3.74Å; H650-Y821 HydrophobicContact CB-CE1 4.23Å; H650-Y821 HydrophobicContact CB-CG 4.48Å; H650-Y821 AromaticContact CD2-CD1 3.9Å; H650-Y821 AromaticContact CD2-CE1 3.51Å; H650-Y821 CarbonylContact O-C 3.53Å; H650-Y821 WeakPolarHBondContact O-CA 3.41Å; H650-H822 PolarHBondContact O-N 2.99Å
651	Y	96.5	Very high	87.8	Confident	23 Å²	23	57 Å²	57	9%	0.09	31%	0.31	C	S	.	.			trans	-96.2	173.9	176.9	-69.1	-98.7	0	0	0	110.4	E649 E653 D654 I655 H822 F824 R826 L829	E649-Y651 HydrophobicContact CB-CE2 3.94Å; E649-Y651 PolarHBondContact OE2-OH 3.36Å; Y651-E653 VanDerWaalsContact C-N 3.26Å; Y651-E653 PolarHBondContact O-N 3.14Å; Y651-E653 VanDerWaalsContact O-N 3.17Å; Y651-D654 PolarHBondContact N-OD2 3.03Å; Y651-D654 WeakPolarHBondContact O-CA 3.46Å; Y651-D654 WeakPolarHBondContact O-CB 3.49Å; Y651-D654 PolarHBondContact O-N 3.36Å; Y651-I655 WeakPolarHBondContact O-CG1 3.43Å; Y651-I655 PolarHBondContact O-N 3.5Å; Y651-H822 CarbonylContact C-O 3.49Å; Y651-H822 HydrophobicContact CD1-CB 4.12Å; Y651-H822 HydrophobicContact CE1-CB 4.4Å; Y651-H822 AromaticContact CE1-CD2 3.7Å; Y651-H822 AromaticContact CZ-CD2 3.66Å; Y651-F824 HydrophobicContact CD1-CE2 4.46Å; Y651-F824 HydrophobicContact CE1-CE2 4.26Å; Y651-R826 HydrophobicContact CD1-CB 4.39Å; Y651-R826 HydrophobicContact CD1-CG 3.6Å; Y651-R826 HydrophobicContact CD2-CG 3.66Å; Y651-R826 VanDerWaalsContact CD2-CZ 3.45Å; Y651-R826 HydrophobicContact CE1-CG 3.98Å; Y651-R826 HydrophobicContact CE2-CG 4.06Å; Y651-R826 HydrophobicContact CG-CG 3.42Å; Y651-R826 VanDerWaalsContact CG-CG 3.42Å; Y651-L829 HydrophobicContact CE1-CB 4.37Å; Y651-L829 HydrophobicContact CE1-CD2 3.81Å; Y651-L829 VanDerWaalsContact OH-CD2 3.26Å; Y651-L829 WeakPolarHBondContact OH-CD2 3.44Å
652	L	93.8	Very high	87	Confident	23 Å²	23	61.7 Å²	61.7	12%	0.12	32%	0.324	C	S	.	.	H	α-helix	trans	-50.9	-44.9	-174	-177.7	60.8	0	0	0	112.9	D654 I655 L656 Y664 L683 H822 F824	L652-D654 VanDerWaalsContact C-N 3.32Å; L652-D654 PolarHBondContact O-N 3.1Å; L652-I655 PolarHBondContact O-N 3.31Å; L652-L656 HydrophobicContact CD1-CD1 4.2Å; L652-L656 HydrophobicContact CD1-CD2 4.45Å; L652-L656 HydrophobicContact CD1-CG 4.03Å; L652-L656 HydrophobicContact CG-CD1 4.01Å; L652-L656 HydrophobicContact CG-CG 4.29Å; L652-L656 WeakPolarHBondContact O-CB 3.18Å; L652-L656 VanDerWaalsContact O-CG 3.24Å; L652-L656 WeakPolarHBondContact O-CG 3.2Å; L652-L656 PolarHBondContact O-N 3.38Å; L652-Y664 HydrophobicContact CD1-CD2 4.21Å; L652-Y664 HydrophobicContact CD1-CE2 3.97Å; L652-Y664 HydrophobicContact CD2-CD2 4.17Å; L652-Y664 HydrophobicContact CD2-CE2 4.1Å; L652-L683 HydrophobicContact CD1-CD2 3.87Å; L652-H822 PolarHBondContact N-O 2.9Å; L652-H822 VanDerWaalsContact N-O 3.09Å; L652-F824 VanDerWaalsContact CB-C 3.45Å; L652-F824 PolarHBondContact N-O 2.97Å; L652-F824 VanDerWaalsContact N-O 3.15Å
653	E	92.8	Very high	86.5	Confident	72 Å²	72	66.9 Å²	66.9	34%	0.336	34%	0.342	S	S	.	.	H	α-helix	trans	-59	-38.9	176	56.1	-88.1	-159.1	0	0	113.4	Y651 A657 P825 R826	Y651-E653 VanDerWaalsContact C-N 3.26Å; Y651-E653 PolarHBondContact O-N 3.14Å; Y651-E653 VanDerWaalsContact O-N 3.17Å; E653-A657 WeakPolarHBondContact O-CB 3.36Å; E653-A657 PolarHBondContact O-N 3.45Å; E653-P825 VanDerWaalsContact OE2-CA 3.26Å; E653-P825 WeakPolarHBondContact OE2-CA 3.5Å; E653-R826 WeakPolarHBondContact OE1-CD 3.42Å; E653-R826 VanDerWaalsContact OE1-CG 3.25Å; E653-R826 WeakPolarHBondContact OE1-CG 3.25Å; E653-R826 IonicContact OE1-CZ 3.84Å; E653-R826 PolarHBondContact OE1-N 2.77Å; E653-R826 IonicContact OE1-NE 4Å; E653-R826 IonicContact OE1-NH1 3.54Å; E653-R826 PolarHBondContact OE1-NH1 2.77Å
654	D	94.7	Very high	85.8	Confident	44 Å²	44	63.3 Å²	63.3	24%	0.235	33%	0.325	C	S	.	.	H	α-helix	trans	-73.3	-37.6	178.1	-48.6	-38.9	0	0	0	110.8	H650 Y651 L652 K658 R826	H650-D654 WeakPolarHBondContact CA-OD2 3.48Å; H650-D654 HydrophobicContact CB-CB 4.26Å; Y651-D654 PolarHBondContact N-OD2 3.03Å; Y651-D654 WeakPolarHBondContact O-CA 3.46Å; Y651-D654 WeakPolarHBondContact O-CB 3.49Å; Y651-D654 PolarHBondContact O-N 3.36Å; L652-D654 VanDerWaalsContact C-N 3.32Å; L652-D654 PolarHBondContact O-N 3.1Å; D654-K658 WeakPolarHBondContact O-CB 3.48Å; D654-K658 VanDerWaalsContact O-CG 3.27Å; D654-K658 WeakPolarHBondContact O-CG 3.47Å; D654-K658 PolarHBondContact O-N 3.04Å; D654-R826 IonicContact OD1-CZ 2.95Å; D654-R826 IonicContact OD1-NH1 2.74Å; D654-R826 PolarHBondContact OD1-NH1 3.07Å; D654-R826 VanDerWaalsContact OD1-NH1 3.14Å; D654-R826 IonicContact OD1-NH2 3.24Å; D654-R826 IonicContact OD2-CZ 3.89Å; D654-R826 IonicContact OD2-NH1 2.76Å; D654-R826 PolarHBondContact OD2-NH1 2.72Å; D654-R826 VanDerWaalsContact OD2-NH1 3.16Å; D654-R826 IonicContact OD2-NH2 3.18Å; D654-R826 PolarHBondContact OD2-NH2 2.67Å
655	I	94.4	Very high	85.1	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-67.1	-48.1	179.9	-69	164.8	0	0	0	110.3	H650 Y651 L652 A657 K658 L659 L687 Y821 H822 L823	H650-I655 HydrophobicContact CB-CG1 4.15Å; Y651-I655 WeakPolarHBondContact O-CG1 3.43Å; Y651-I655 PolarHBondContact O-N 3.5Å; L652-I655 PolarHBondContact O-N 3.31Å; I655-A657 VanDerWaalsContact C-N 3.31Å; I655-A657 PolarHBondContact O-N 3.15Å; I655-K658 WeakPolarHBondContact O-CB 3.5Å; I655-K658 PolarHBondContact O-N 3.07Å; I655-K658 VanDerWaalsContact O-N 3.12Å; I655-L659 HydrophobicContact CG2-CD1 3.89Å; I655-L659 HydrophobicContact CG2-CG 4.39Å; I655-L659 WeakPolarHBondContact O-CG 3.29Å; I655-L659 PolarHBondContact O-N 3.38Å; I655-L687 HydrophobicContact CD1-CD2 4.17Å; I655-L687 HydrophobicContact CG2-CD1 3.97Å; I655-L687 HydrophobicContact CG2-CD2 4.27Å; I655-Y821 HydrophobicContact CG1-CD1 4.22Å; I655-H822 VanDerWaalsContact CD1-O 3.29Å; I655-H822 WeakPolarHBondContact CD1-O 3.45Å; I655-L823 HydrophobicContact CD1-CD2 4.21Å; I655-L823 HydrophobicContact CG2-CD2 4.49Å
656	L	92.8	Very high	83.3	Confident	22 Å²	22	66.6 Å²	66.6	12%	0.115	35%	0.35	C	S	.	.	H	α-helix	trans	-59.1	-44.3	177.1	-71.7	175.4	0	0	0	111.1	L652 K658 L659 G660 K661 Y664 L683	L652-L656 HydrophobicContact CD1-CD1 4.2Å; L652-L656 HydrophobicContact CD1-CD2 4.45Å; L652-L656 HydrophobicContact CD1-CG 4.03Å; L652-L656 HydrophobicContact CG-CD1 4.01Å; L652-L656 HydrophobicContact CG-CG 4.29Å; L652-L656 WeakPolarHBondContact O-CB 3.18Å; L652-L656 VanDerWaalsContact O-CG 3.24Å; L652-L656 WeakPolarHBondContact O-CG 3.2Å; L652-L656 PolarHBondContact O-N 3.38Å; L656-K658 VanDerWaalsContact C-N 3.35Å; L656-K658 PolarHBondContact O-N 3.15Å; L656-L659 PolarHBondContact O-N 2.95Å; L656-G660 PolarHBondContact O-N 3.19Å; L656-G660 VanDerWaalsContact O-N 3.12Å; L656-K661 CarbonylContact C-O 3.52Å; L656-K661 WeakPolarHBondContact CB-O 3.33Å; L656-K661 HydrophobicContact CD2-CB 3.99Å; L656-K661 HydrophobicContact CD2-CD 4.44Å; L656-K661 PolarHBondContact O-N 2.98Å; L656-Y664 HydrophobicContact CD1-CD2 3.99Å; L656-Y664 HydrophobicContact CD2-CD2 4.06Å; L656-L683 HydrophobicContact CD2-CD1 4.19Å
657	A	91.5	Very high	81.2	Confident	66 Å²	66	68.5 Å²	68.5	55%	0.545	35%	0.345	S	S	.	.	H	α-helix	trans	-59.7	-42.8	174.2	0	0	0	0	0	112.3	E653 I655 L659 G660	E653-A657 WeakPolarHBondContact O-CB 3.36Å; E653-A657 PolarHBondContact O-N 3.45Å; I655-A657 VanDerWaalsContact C-N 3.31Å; I655-A657 PolarHBondContact O-N 3.15Å; A657-L659 PolarHBondContact O-N 2.95Å; A657-G660 PolarHBondContact O-N 2.94Å
658	K	91.2	Very high	79	Confident	82 Å²	82	73.4 Å²	73.4	36%	0.357	37%	0.366	S	S	.	.	H	α-helix	trans	-64.9	-35.7	176.6	-78	171	174.2	-64.9	0	113.7	H650 D654 I655 L656 G660 H690	H650-K658 WeakPolarHBondContact CE1-CE 3.18Å; H650-K658 WeakPolarHBondContact ND1-CE 3.36Å; D654-K658 WeakPolarHBondContact O-CB 3.48Å; D654-K658 VanDerWaalsContact O-CG 3.27Å; D654-K658 WeakPolarHBondContact O-CG 3.47Å; D654-K658 PolarHBondContact O-N 3.04Å; I655-K658 WeakPolarHBondContact O-CB 3.5Å; I655-K658 PolarHBondContact O-N 3.07Å; I655-K658 VanDerWaalsContact O-N 3.12Å; L656-K658 VanDerWaalsContact C-N 3.35Å; L656-K658 PolarHBondContact O-N 3.15Å; K658-G660 PolarHBondContact O-N 3.49Å; K658-H690 PolarHBondContact O-CE1 3.09Å; K658-H690 VanDerWaalsContact O-CE1 3.24Å
659	L	91.3	Very high	76.4	Confident	38 Å²	38	77.1 Å²	77.1	20%	0.199	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-5.1	177.1	-66.9	176.7	0	0	0	112.8	I655 L656 A657 K661 L683 D686 H690	I655-L659 HydrophobicContact CG2-CD1 3.89Å; I655-L659 HydrophobicContact CG2-CG 4.39Å; I655-L659 WeakPolarHBondContact O-CG 3.29Å; I655-L659 PolarHBondContact O-N 3.38Å; L656-L659 PolarHBondContact O-N 2.95Å; A657-L659 PolarHBondContact O-N 2.95Å; L659-K661 HydrophobicContact CB-CD 4.44Å; L659-K661 HydrophobicContact CB-CG 4.14Å; L659-K661 PolarHBondContact O-N 3.37Å; L659-L683 HydrophobicContact CD1-CD1 3.61Å; L659-D686 HydrophobicContact CD1-CB 4.31Å; L659-D686 HydrophobicContact CD2-CB 4.47Å; L659-H690 HydrophobicContact CD2-CB 3.53Å
660	G	86.1	Confident	73.6	Confident	53 Å²	53	82.4 Å²	82.4	55%	0.546	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	70	19	-175	0	0	0	0	0	113.4	L656 A657 K658	L656-G660 PolarHBondContact O-N 3.19Å; L656-G660 VanDerWaalsContact O-N 3.12Å; A657-G660 PolarHBondContact O-N 2.94Å; K658-G660 PolarHBondContact O-N 3.49Å
661	K	79.5	Confident	71.1	Confident	69 Å²	69	91.7 Å²	91.7	30%	0.3	44%	0.444	S	S	.	.			trans	-94.4	103.9	176.5	-64	-173.2	179.2	-173.7	0	108.2	L656 L659 Q663 D686	L656-K661 CarbonylContact C-O 3.52Å; L656-K661 WeakPolarHBondContact CB-O 3.33Å; L656-K661 HydrophobicContact CD2-CB 3.99Å; L656-K661 HydrophobicContact CD2-CD 4.44Å; L656-K661 PolarHBondContact O-N 2.98Å; L659-K661 HydrophobicContact CB-CD 4.44Å; L659-K661 HydrophobicContact CB-CG 4.14Å; L659-K661 PolarHBondContact O-N 3.37Å; K661-Q663 VanDerWaalsContact C-N 3.34Å; K661-D686 WeakPolarHBondContact CE-OD2 3.48Å; K661-D686 IonicContact NZ-OD2 3.74Å; K661-D686 PolarHBondContact NZ-OD2 3.47Å
662	H	63.9	Low	68.5	Low	177 Å²	177	95.5 Å²	95.5	82%	0.819	46%	0.462	S	S	*	.	S	Bend	trans	-81.1	-13.6	179.4	-68.7	-42	0	0	0	114
663	Q	57.9	Low	66.4	Low	135 Å²	135	98.2 Å²	98.2	63%	0.631	48%	0.483	S	S	*	.	S	Bend	trans	-133.6	121.2	178	-64.6	176.2	12.2	0	0	108	K661	K661-Q663 VanDerWaalsContact C-N 3.34Å
664	Y	55.7	Low	64.5	Low	67 Å²	67	101.3 Å²	101.3	26%	0.263	50%	0.498	S	S	.	.			trans	-62	126.8	154.9	-154.9	-87.9	0	0	0	105.3	L652 L656 H666 L683	L652-Y664 HydrophobicContact CD1-CD2 4.21Å; L652-Y664 HydrophobicContact CD1-CE2 3.97Å; L652-Y664 HydrophobicContact CD2-CD2 4.17Å; L652-Y664 HydrophobicContact CD2-CE2 4.1Å; L656-Y664 HydrophobicContact CD1-CD2 3.99Å; L656-Y664 HydrophobicContact CD2-CD2 4.06Å; Y664-H666 PolarHBondContact O-N 3.08Å; Y664-H666 VanDerWaalsContact O-N 3.07Å; Y664-L683 HydrophobicContact CD2-CD2 4.35Å; Y664-L683 HydrophobicContact CE2-CD2 3.48Å; Y664-L683 VanDerWaalsContact CE2-CD2 3.48Å
665	P	52.2	Low	62.9	Low	89 Å²	89	105 Å²	105	58%	0.578	52%	0.517	S	S	*	.			trans	-49.3	125.7	-180	16.6	-27.6	0	0	0	108.7	R667	P665-R667 PolarHBondContact O-N 2.98Å
666	H	44.7	Very low	61.5	Low	125 Å²	125	109.5 Å²	109.5	58%	0.579	54%	0.539	S	S	*	.	S	Bend	trans	-67.9	59.7	-168.9	-74.4	-68.9	0	0	0	112.9	Y664 H668	Y664-H666 PolarHBondContact O-N 3.08Å; Y664-H666 VanDerWaalsContact O-N 3.07Å; H666-H668 PolarHBondContact O-N 3.4Å
667	R	44.8	Very low	60.7	Low	134 Å²	134	110 Å²	110	51%	0.506	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-72.3	-14.2	165.5	-115.2	-178.8	-176.9	-163.4	-4.9	112.5	E219 D221 P665	E219-R667 IonicContact OE2-NE 2.76Å; E219-R667 IonicContact OE2-NH2 3.37Å; E219-R667 PolarHBondContact OE2-NH2 3.29Å; D221-R667 IonicContact OD1-CZ 3.66Å; D221-R667 IonicContact OD1-NH2 3.22Å; D221-R667 PolarHBondContact OD1-NH2 2.86Å; D221-R667 IonicContact OD2-NH2 3.52Å; P665-R667 PolarHBondContact O-N 2.98Å
668	H	44.4	Very low	60	Low	130 Å²	130	110.2 Å²	110.2	60%	0.602	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-96.9	24.9	-176.9	-64	-57.4	0	0	0	116.9	H666	H666-H668 PolarHBondContact O-N 3.4Å
669	R	42.5	Very low	59.8	Low	203 Å²	203	108.2 Å²	108.2	77%	0.766	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-107.9	-2	176	-122.9	-177.2	-167.9	177.9	4.6	116.4
670	H	38.2	Very low	59.7	Low	165 Å²	165	108.3 Å²	108.3	76%	0.764	54%	0.539	S	S	*	.	S	Bend	trans	-125.2	85.3	176.8	-75	-61.4	0	0	0	111.7	E672	H670-E672 PolarHBondContact O-N 3.13Å
671	H	43.5	Very low	60.1	Low	207 Å²	207	107.6 Å²	107.6	96%	0.958	52%	0.522	S	S	*	.	S	Bend	trans	56.7	4.7	158	-100.7	-67.8	0	0	0	119.7
672	E	42.5	Very low	60.7	Low	103 Å²	103	108.2 Å²	108.2	48%	0.481	53%	0.529	S	S	.	.			trans	-77.1	124.9	172.4	-73.1	164.4	-174.2	0	0	109.6	H670	H670-E672 PolarHBondContact O-N 3.13Å
673	S	50.8	Low	62.1	Low	80 Å²	80	100 Å²	100	56%	0.559	49%	0.491	S	S	*	.			trans	-50.7	139.1	-170.9	48.6	0	0	0	0	112.7	D675 E676	S673-D675 PolarHBondContact O-N 3.03Å; S673-E676 PolarHBondContact O-N 3.39Å
674	E	52	Low	63.9	Low	138 Å²	138	93.6 Å²	93.6	65%	0.645	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-11.3	172.8	-72.1	-167	156.7	0	0	114.2	R828 K831	E674-R828 PolarHBondContact O-NH1 3.25Å; E674-R828 PolarHBondContact O-NH2 3.41Å; E674-K831 IonicContact OE1-NZ 3.86Å; E674-K831 IonicContact OE2-NZ 3.72Å; E674-K831 PolarHBondContact OE2-NZ 2.67Å
675	D	61.6	Low	65.8	Low	121 Å²	121	90.7 Å²	90.7	65%	0.647	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	3	-176.2	-72.7	-33.6	0	0	0	115.8	S673 C677 R828	S673-D675 PolarHBondContact O-N 3.03Å; D675-C677 PolarHBondContact O-N 3.09Å; D675-C677 PolarHBondContact O-SG 3.24Å; D675-R828 IonicContact OD1-NH1 3.39Å
676	E	65.5	Low	67.9	Low	96 Å²	96	89.3 Å²	89.3	45%	0.449	44%	0.438	S	S	.	.			trans	-66.3	129.7	179.8	-162.6	172.7	-177.1	0	0	112.4	S673 A678	S673-E676 PolarHBondContact O-N 3.39Å; E676-A678 HydrophobicContact CG-CB 4.46Å; E676-A678 PolarHBondContact O-N 3.44Å
677	C	75.2	Confident	70.4	Confident	32 Å²	32	83.4 Å²	83.4	22%	0.216	41%	0.411	C	S	.	.			trans	-101.6	55.4	-175.9	-66.5	0	0	0	0	111.5	D675 L780 T797 W799	D675-C677 PolarHBondContact O-N 3.09Å; D675-C677 PolarHBondContact O-SG 3.24Å; C677-L780 HydrophobicContact CB-CD2 3.8Å; C677-T797 HydrophobicContact CB-CG2 4.03Å; C677-T797 WeakPolarHBondContact CB-O 3.48Å; C677-W799 PolarHBondContact SG-NE1 3.3Å; C677-W799 VanDerWaalsContact SG-NE1 3.37Å
678	A	77	Confident	72.8	Confident	71 Å²	71	77 Å²	77	59%	0.587	39%	0.387	S	S	*	.			trans	-92.9	133.6	177.9	0	0	0	0	0	111.4	E676	E676-A678 HydrophobicContact CG-CB 4.46Å; E676-A678 PolarHBondContact O-N 3.44Å
679	L	86.4	Confident	75.3	Confident	39 Å²	39	73 Å²	73	20%	0.204	37%	0.369	C	S	.	.			trans	-109	123	179.4	-178.7	62.9	0	0	0	111.1	L681 V684 L704 P705 E709 L780 L823	L679-L681 HydrophobicContact CD2-CD2 4.12Å; L679-L681 HydrophobicContact CG-CD2 4.27Å; L679-L681 PolarHBondContact O-N 3.25Å; L679-V684 HydrophobicContact CD1-CG2 3.92Å; L679-V684 HydrophobicContact CD2-CG2 4.3Å; L679-V684 HydrophobicContact CG-CG2 4.19Å; L679-L704 HydrophobicContact CD2-CD2 3.71Å; L679-P705 HydrophobicContact CD2-CG 3.98Å; L679-E709 HydrophobicContact CD2-CB 4.39Å; L679-E709 HydrophobicContact CD2-CG 4.36Å; L679-L780 HydrophobicContact CB-CD1 4.05Å; L679-L823 HydrophobicContact CD1-CD1 4.35Å
680	D	89.8	Confident	77.8	Confident	41 Å²	41	64.9 Å²	64.9	22%	0.219	34%	0.34	C	S	.	.			trans	-77.4	107	171.2	-178.3	-11.7	0	0	0	110.6	D682 L683 V684	D680-D682 VanDerWaalsContact C-N 3.35Å; D680-D682 WeakPolarHBondContact OD1-CA 3.4Å; D680-D682 WeakPolarHBondContact OD1-CB 3.42Å; D680-D682 PolarHBondContact OD1-N 3.45Å; D680-L683 HydrophobicContact CB-CB 3.87Å; D680-L683 VanDerWaalsContact CG-CB 3.48Å; D680-L683 PolarHBondContact OD1-N 3.47Å; D680-L683 WeakPolarHBondContact OD2-CB 3.39Å; D680-V684 VanDerWaalsContact O-CG2 3.31Å; D680-V684 WeakPolarHBondContact O-CG2 2.95Å; D680-V684 PolarHBondContact O-N 3.31Å
681	L	93	Very high	80.6	Confident	37 Å²	37	57 Å²	57	19%	0.194	30%	0.304	C	S	.	.	H	α-helix	trans	-71.6	-28.4	179.6	-55.5	-176.3	0	0	0	112.9	L679 T685 E709 V713	L679-L681 HydrophobicContact CD2-CD2 4.12Å; L679-L681 HydrophobicContact CG-CD2 4.27Å; L679-L681 PolarHBondContact O-N 3.25Å; L681-T685 WeakPolarHBondContact O-CB 3.18Å; L681-T685 PolarHBondContact O-N 3.2Å; L681-T685 PolarHBondContact O-OG1 3.22Å; L681-E709 HydrophobicContact CD2-CB 3.97Å; L681-E709 HydrophobicContact CD2-CG 4.21Å; L681-V713 HydrophobicContact CB-CG2 4.41Å; L681-V713 HydrophobicContact CD2-CG2 4.08Å
682	D	92.3	Very high	83	Confident	83 Å²	83	48.7 Å²	48.7	44%	0.444	27%	0.266	S	S	.	.	H	α-helix	trans	-70.9	-42.7	177.6	-63.6	-38.3	0	0	0	109.2	D680 V684 T685 D686 R716	D680-D682 VanDerWaalsContact C-N 3.35Å; D680-D682 WeakPolarHBondContact OD1-CA 3.4Å; D680-D682 WeakPolarHBondContact OD1-CB 3.42Å; D680-D682 PolarHBondContact OD1-N 3.45Å; D682-V684 PolarHBondContact O-N 3.47Å; D682-T685 WeakPolarHBondContact O-CB 3.34Å; D682-T685 PolarHBondContact O-N 3Å; D682-T685 VanDerWaalsContact O-N 3.17Å; D682-D686 WeakPolarHBondContact O-CB 3.36Å; D682-D686 VanDerWaalsContact O-CG 3.26Å; D682-D686 PolarHBondContact O-N 3.5Å; D682-R716 WeakPolarHBondContact OD1-CD 3.48Å; D682-R716 IonicContact OD1-CZ 3.09Å; D682-R716 IonicContact OD1-NE 2.73Å; D682-R716 PolarHBondContact OD1-NE 3.34Å; D682-R716 IonicContact OD1-NH2 2.74Å; D682-R716 PolarHBondContact OD1-NH2 2.92Å
683	L	93.3	Very high	85.3	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-60.6	-42.3	173.5	-179.9	63.6	0	0	0	112.9	L652 L656 L659 Y664 D680 T685 L687 L823	L652-L683 HydrophobicContact CD1-CD2 3.87Å; L656-L683 HydrophobicContact CD2-CD1 4.19Å; L659-L683 HydrophobicContact CD1-CD1 3.61Å; Y664-L683 HydrophobicContact CD2-CD2 4.35Å; Y664-L683 HydrophobicContact CE2-CD2 3.48Å; Y664-L683 VanDerWaalsContact CE2-CD2 3.48Å; D680-L683 HydrophobicContact CB-CB 3.87Å; D680-L683 VanDerWaalsContact CG-CB 3.48Å; D680-L683 PolarHBondContact OD1-N 3.47Å; D680-L683 WeakPolarHBondContact OD2-CB 3.39Å; L683-T685 VanDerWaalsContact C-N 3.31Å; L683-T685 PolarHBondContact O-N 3.02Å; L683-L687 WeakPolarHBondContact O-CB 3.24Å; L683-L687 PolarHBondContact O-N 2.89Å; L683-L823 HydrophobicContact CD2-CD2 3.97Å; L683-L823 HydrophobicContact CG-CD2 3.98Å
684	V	96.3	Very high	87.4	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-59	-47.1	174.5	176	0	0	0	0	110.1	L679 D680 D682 L687 V688 L704 V713 L823	L679-V684 HydrophobicContact CD1-CG2 3.92Å; L679-V684 HydrophobicContact CD2-CG2 4.3Å; L679-V684 HydrophobicContact CG-CG2 4.19Å; D680-V684 VanDerWaalsContact O-CG2 3.31Å; D680-V684 WeakPolarHBondContact O-CG2 2.95Å; D680-V684 PolarHBondContact O-N 3.31Å; D682-V684 PolarHBondContact O-N 3.47Å; V684-L687 PolarHBondContact O-N 3.04Å; V684-V688 WeakPolarHBondContact O-CG2 3.41Å; V684-V688 PolarHBondContact O-N 3.16Å; V684-L704 HydrophobicContact CG1-CD2 4.25Å; V684-L704 HydrophobicContact CG2-CD2 4.36Å; V684-V713 HydrophobicContact CB-CG2 4.07Å; V684-V713 HydrophobicContact CG1-CG1 3.97Å; V684-V713 HydrophobicContact CG1-CG2 3.77Å; V684-L823 HydrophobicContact CB-CD1 4.3Å; V684-L823 HydrophobicContact CG2-CD1 3.4Å; V684-L823 VanDerWaalsContact CG2-CD1 3.4Å
685	T	96.2	Very high	89.2	Confident	7 Å²	7	47.4 Å²	47.4	4%	0.043	26%	0.263	C	S	.	.	H	α-helix	trans	-62.1	-49.8	-178.6	-55.9	0	0	0	0	110.6	L681 D682 L683 L687 V688 L689 R716 L717	L681-T685 WeakPolarHBondContact O-CB 3.18Å; L681-T685 PolarHBondContact O-N 3.2Å; L681-T685 PolarHBondContact O-OG1 3.22Å; D682-T685 WeakPolarHBondContact O-CB 3.34Å; D682-T685 PolarHBondContact O-N 3Å; D682-T685 VanDerWaalsContact O-N 3.17Å; L683-T685 VanDerWaalsContact C-N 3.31Å; L683-T685 PolarHBondContact O-N 3.02Å; T685-L687 VanDerWaalsContact C-N 3.28Å; T685-L687 PolarHBondContact O-N 2.88Å; T685-V688 PolarHBondContact O-N 2.64Å; T685-V688 VanDerWaalsContact O-N 3.14Å; T685-L689 HydrophobicContact CG2-CD1 4.06Å; T685-L689 HydrophobicContact CG2-CG 4.45Å; T685-L689 WeakPolarHBondContact O-CG 3.33Å; T685-L689 PolarHBondContact O-N 3.21Å; T685-R716 HydrophobicContact CG2-CB 3.73Å; T685-R716 WeakPolarHBondContact OG1-CD 3.26Å; T685-L717 HydrophobicContact CG2-CD2 3.83Å; T685-L717 HydrophobicContact CG2-CG 4.21Å
686	D	95.1	Very high	90.7	Very high	59 Å²	59	47.1 Å²	47.1	32%	0.316	26%	0.257	S	S	.	.	H	α-helix	trans	-58.4	-40.5	178.4	-72.5	-17.4	0	0	0	112.1	L659 K661 D682 H690	L659-D686 HydrophobicContact CD1-CB 4.31Å; L659-D686 HydrophobicContact CD2-CB 4.47Å; K661-D686 WeakPolarHBondContact CE-OD2 3.48Å; K661-D686 IonicContact NZ-OD2 3.74Å; K661-D686 PolarHBondContact NZ-OD2 3.47Å; D682-D686 WeakPolarHBondContact O-CB 3.36Å; D682-D686 VanDerWaalsContact O-CG 3.26Å; D682-D686 PolarHBondContact O-N 3.5Å; D686-H690 VanDerWaalsContact O-CB 3.27Å; D686-H690 WeakPolarHBondContact O-CB 3.14Å; D686-H690 PolarHBondContact O-N 3.32Å
687	L	96.9	Very high	91.9	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-65	-45.4	176	174.3	59.8	0	0	0	111.7	I655 L683 V684 T685 L689 H690 I691 V776 Y821 L823	I655-L687 HydrophobicContact CD1-CD2 4.17Å; I655-L687 HydrophobicContact CG2-CD1 3.97Å; I655-L687 HydrophobicContact CG2-CD2 4.27Å; L683-L687 WeakPolarHBondContact O-CB 3.24Å; L683-L687 PolarHBondContact O-N 2.89Å; V684-L687 PolarHBondContact O-N 3.04Å; T685-L687 VanDerWaalsContact C-N 3.28Å; T685-L687 PolarHBondContact O-N 2.88Å; L687-L689 VanDerWaalsContact C-N 3.33Å; L687-L689 PolarHBondContact O-N 3.28Å; L687-H690 WeakPolarHBondContact O-CB 3.4Å; L687-H690 PolarHBondContact O-N 3.14Å; L687-I691 HydrophobicContact CD1-CD1 3.87Å; L687-I691 HydrophobicContact CD1-CG1 4.06Å; L687-I691 HydrophobicContact CG-CD1 3.91Å; L687-I691 VanDerWaalsContact O-CG1 3.27Å; L687-I691 WeakPolarHBondContact O-CG1 3.35Å; L687-I691 PolarHBondContact O-N 2.85Å; L687-V776 HydrophobicContact CD2-CG1 3.73Å; L687-V776 HydrophobicContact CD2-CG2 4.1Å; L687-V776 HydrophobicContact CG-CG2 4.34Å; L687-Y821 HydrophobicContact CD1-CD1 3.89Å; L687-Y821 HydrophobicContact CD1-CE1 4.41Å; L687-Y821 HydrophobicContact CD1-CG 4.21Å; L687-Y821 HydrophobicContact CD2-CG 4.44Å; L687-L823 HydrophobicContact CD2-CD2 3.71Å; L687-L823 HydrophobicContact CD2-CG 4.24Å
688	V	97	Very high	92.7	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.8	-43.5	177.8	171.2	0	0	0	0	110.7	V684 T685 H690 I691 D692 I700 L717 I756 V776	V684-V688 WeakPolarHBondContact O-CG2 3.41Å; V684-V688 PolarHBondContact O-N 3.16Å; T685-V688 PolarHBondContact O-N 2.64Å; T685-V688 VanDerWaalsContact O-N 3.14Å; V688-H690 VanDerWaalsContact C-N 3.34Å; V688-H690 PolarHBondContact O-N 2.95Å; V688-I691 PolarHBondContact O-N 3.27Å; V688-D692 WeakPolarHBondContact O-CB 3.36Å; V688-D692 PolarHBondContact O-N 2.93Å; V688-I700 HydrophobicContact CG1-CD1 4.22Å; V688-L717 HydrophobicContact CB-CD2 4.02Å; V688-L717 HydrophobicContact CG1-CD1 4Å; V688-L717 HydrophobicContact CG1-CD2 3.7Å; V688-I756 HydrophobicContact CG1-CD1 3.96Å; V688-I756 HydrophobicContact CG1-CG2 4.16Å; V688-V776 HydrophobicContact CG2-CG2 4.41Å
689	L	95.4	Very high	93.6	Very high	45 Å²	45	43.9 Å²	43.9	24%	0.236	24%	0.243	C	C	.	.	H	α-helix	trans	-64.2	-37.8	175.6	-66.8	174.5	0	0	0	112.1	T685 L687 D692 A693 L717 A720 L721	T685-L689 HydrophobicContact CG2-CD1 4.06Å; T685-L689 HydrophobicContact CG2-CG 4.45Å; T685-L689 WeakPolarHBondContact O-CG 3.33Å; T685-L689 PolarHBondContact O-N 3.21Å; L687-L689 VanDerWaalsContact C-N 3.33Å; L687-L689 PolarHBondContact O-N 3.28Å; L689-D692 PolarHBondContact O-N 3.25Å; L689-A693 WeakPolarHBondContact O-CB 3.38Å; L689-A693 PolarHBondContact O-N 3.34Å; L689-L717 HydrophobicContact CD2-CD2 3.98Å; L689-L717 HydrophobicContact CG-CD2 4.05Å; L689-A720 HydrophobicContact CD1-CB 3.78Å; L689-A720 HydrophobicContact CD2-CB 4.3Å; L689-L721 HydrophobicContact CD2-CD1 4.39Å; L689-L721 HydrophobicContact CD2-CD2 3.48Å; L689-L721 VanDerWaalsContact CD2-CD2 3.48Å; L689-L721 HydrophobicContact CD2-CG 3.91Å
690	H	95.8	Very high	94.1	Very high	32 Å²	32	42 Å²	42	15%	0.148	23%	0.233	C	C	.	.	H	α-helix	trans	-65.4	-44.5	175.3	-179.7	95.7	0	0	0	112.4	K658 L659 D686 L687 V688 D692 A693 R694	K658-H690 PolarHBondContact O-CE1 3.09Å; K658-H690 VanDerWaalsContact O-CE1 3.24Å; L659-H690 HydrophobicContact CD2-CB 3.53Å; D686-H690 VanDerWaalsContact O-CB 3.27Å; D686-H690 WeakPolarHBondContact O-CB 3.14Å; D686-H690 PolarHBondContact O-N 3.32Å; L687-H690 WeakPolarHBondContact O-CB 3.4Å; L687-H690 PolarHBondContact O-N 3.14Å; V688-H690 VanDerWaalsContact C-N 3.34Å; V688-H690 PolarHBondContact O-N 2.95Å; H690-D692 VanDerWaalsContact C-N 3.28Å; H690-D692 PolarHBondContact O-N 3.17Å; H690-A693 PolarHBondContact O-N 2.83Å; H690-R694 PolarHBondContact O-N 3.03Å
691	I	96.3	Very high	94.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.4	-41.3	175.3	-67	164.6	0	0	0	109.7	L687 V688 G695 I700 R754 H774 V776 Y821	L687-I691 HydrophobicContact CD1-CD1 3.87Å; L687-I691 HydrophobicContact CD1-CG1 4.06Å; L687-I691 HydrophobicContact CG-CD1 3.91Å; L687-I691 VanDerWaalsContact O-CG1 3.27Å; L687-I691 WeakPolarHBondContact O-CG1 3.35Å; L687-I691 PolarHBondContact O-N 2.85Å; V688-I691 PolarHBondContact O-N 3.27Å; I691-G695 WeakPolarHBondContact O-CA 3.3Å; I691-G695 PolarHBondContact O-N 3.18Å; I691-I700 HydrophobicContact CB-CD1 4.09Å; I691-I700 HydrophobicContact CG2-CD1 3.64Å; I691-I700 HydrophobicContact CG2-CG1 3.97Å; I691-R754 PolarHBondContact O-NH2 2.7Å; I691-R754 VanDerWaalsContact O-NH2 3.08Å; I691-H774 HydrophobicContact CG2-CB 3.84Å; I691-H774 VanDerWaalsContact CG2-CG 3.41Å; I691-V776 HydrophobicContact CD1-CG2 3.56Å; I691-Y821 HydrophobicContact CD1-CD1 4.44Å; I691-Y821 HydrophobicContact CD1-CD2 3.5Å; I691-Y821 HydrophobicContact CD1-CE1 4.43Å; I691-Y821 HydrophobicContact CD1-CE2 3.49Å; I691-Y821 VanDerWaalsContact CD1-CE2 3.49Å; I691-Y821 HydrophobicContact CD1-CG 4Å; I691-Y821 HydrophobicContact CG1-CD2 4.24Å; I691-Y821 HydrophobicContact CG1-CE1 4.27Å; I691-Y821 HydrophobicContact CG1-CE2 3.77Å
692	D	93.8	Very high	94.6	Very high	33 Å²	33	38.6 Å²	38.6	18%	0.176	22%	0.215	C	C	.	.	H	α-helix	trans	-60	-49.2	177.1	-177.5	58.7	0	0	0	112	V688 L689 H690 Y728 R754	V688-D692 WeakPolarHBondContact O-CB 3.36Å; V688-D692 PolarHBondContact O-N 2.93Å; L689-D692 PolarHBondContact O-N 3.25Å; H690-D692 VanDerWaalsContact C-N 3.28Å; H690-D692 PolarHBondContact O-N 3.17Å; D692-Y728 WeakPolarHBondContact OD2-CE1 3.15Å; D692-Y728 PolarHBondContact OD2-OH 3.07Å; D692-R754 PolarHBondContact O-NH2 2.8Å; D692-R754 VanDerWaalsContact OD1-CG 3.29Å; D692-R754 WeakPolarHBondContact OD1-CG 3.45Å; D692-R754 IonicContact OD1-CZ 2.72Å; D692-R754 IonicContact OD1-NE 3.12Å; D692-R754 PolarHBondContact OD1-NE 3.32Å; D692-R754 IonicContact OD1-NH2 3.62Å
693	A	92.4	Very high	94.9	Very high	80 Å²	80	34.6 Å²	34.6	66%	0.661	19%	0.194	S	C	*	.	H	α-helix	trans	-73.8	-30.5	-175.9	0	0	0	0	0	114.8	L689 H690	L689-A693 WeakPolarHBondContact O-CB 3.38Å; L689-A693 PolarHBondContact O-N 3.34Å; H690-A693 PolarHBondContact O-N 2.83Å
694	R	93.5	Very high	95	Very high	193 Å²	193	34.5 Å²	34.5	73%	0.728	19%	0.193	S	C	*	.	H	α-helix	trans	-129.3	-10.2	-170	-59.3	-172.9	-176.8	177.7	2.2	115.1	H690	H690-R694 PolarHBondContact O-N 3.03Å
695	G	91.1	Very high	94.9	Very high	21 Å²	21	34.7 Å²	34.7	22%	0.216	20%	0.195	C	C	.	.	S	Bend	trans	-88.2	156.4	-179	0	0	0	0	0	112.6	I691 R754	I691-G695 WeakPolarHBondContact O-CA 3.3Å; I691-G695 PolarHBondContact O-N 3.18Å; G695-R754 PolarHBondContact O-NH2 2.85Å
696	E	92.5	Very high	94.5	Very high	114 Å²	114	34.5 Å²	34.5	53%	0.533	19%	0.194	S	C	.	.	P	Polyproline II helix	trans	-50.7	152.1	177.8	-65.2	-59.5	140.5	0	0	113.1	R754 V773 H774 F819	E696-R754 PolarHBondContact O-NH1 3.28Å; E696-V773 HydrophobicContact CB-CG1 4.43Å; E696-H774 PolarHBondContact O-NE2 2.68Å; E696-F819 HydrophobicContact CB-CE2 4.06Å; E696-F819 HydrophobicContact CG-CE2 3.57Å; E696-F819 HydrophobicContact CG-CZ 3.85Å
697	P	91.4	Very high	94	Very high	104 Å²	104	34.9 Å²	34.9	68%	0.675	19%	0.191	S	C	*	.	S	Bend	trans	-56.8	140.9	173.8	-23.4	33.8	0	0	0	112.3
698	G	92.2	Very high	93.4	Very high	25 Å²	25	39.2 Å²	39.2	26%	0.258	21%	0.211	S	C	.	.	S	Bend	trans	140.3	169.7	-179.8	0	0	0	0	0	113.6	R754	G698-R754 WeakPolarHBondContact O-CD 3.3Å; G698-R754 PolarHBondContact O-NH1 3.41Å
699	G	94.5	Very high	93.2	Very high	2 Å²	2	40.6 Å²	40.6	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	151.2	178.8	0	0	0	0	0	113.1	K755 D771 V773 H774	G699-K755 CarbonylContact C-O 3.51Å; G699-K755 VanDerWaalsContact CA-O 3.29Å; G699-K755 WeakPolarHBondContact CA-O 3.45Å; G699-D771 WeakPolarHBondContact CA-O 3.13Å; G699-D771 PolarHBondContact N-O 3.38Å; G699-V773 PolarHBondContact O-N 3.24Å; G699-H774 PolarHBondContact O-N 2.74Å; G699-H774 VanDerWaalsContact O-N 3.11Å
700	I	97	Very high	93	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	128.7	176.1	-53.5	176.2	0	0	0	108.2	V688 I691 R754 K755 I756 V757 H774 V776	V688-I700 HydrophobicContact CG1-CD1 4.22Å; I691-I700 HydrophobicContact CB-CD1 4.09Å; I691-I700 HydrophobicContact CG2-CD1 3.64Å; I691-I700 HydrophobicContact CG2-CG1 3.97Å; I700-R754 HydrophobicContact CD1-CG 4.46Å; I700-K755 PolarHBondContact N-O 3.05Å; I700-I756 HydrophobicContact CB-CG1 4.49Å; I700-I756 HydrophobicContact CD1-CG1 4.33Å; I700-I756 CarbonylContact O-C 3.39Å; I700-I756 WeakPolarHBondContact O-CA 3.34Å; I700-V757 PolarHBondContact O-N 3.09Å; I700-H774 CarbonylContact C-O 3.32Å; I700-H774 WeakPolarHBondContact CA-O 3.3Å; I700-H774 HydrophobicContact CB-CB 4.46Å; I700-H774 HydrophobicContact CG1-CB 4.13Å; I700-H774 HydrophobicContact CG2-CB 4.37Å; I700-V776 HydrophobicContact CG2-CG2 4.18Å
701	L	96.5	Very high	92.7	Very high	6 Å²	6	40.9 Å²	40.9	3%	0.031	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	115.6	172.2	174.9	61.8	0	0	0	109.5	F703 V757 A759 A763 I772 H774 V775 V776 R811	L701-F703 HydrophobicContact CD2-CE2 3.71Å; L701-F703 HydrophobicContact CD2-CZ 3.72Å; L701-F703 HydrophobicContact CG-CD2 4.47Å; L701-F703 HydrophobicContact CG-CE2 3.98Å; L701-F703 HydrophobicContact CG-CZ 4.23Å; L701-V757 CarbonylContact C-O 3.54Å; L701-V757 WeakPolarHBondContact CA-O 3.49Å; L701-V757 HydrophobicContact CD1-CB 3.79Å; L701-V757 HydrophobicContact CD1-CG1 3.64Å; L701-A759 HydrophobicContact CD1-CB 3.88Å; L701-A763 HydrophobicContact CD1-CB 4.1Å; L701-A763 HydrophobicContact CD2-CB 4.42Å; L701-I772 HydrophobicContact CB-CD1 3.94Å; L701-I772 HydrophobicContact CB-CG1 4.15Å; L701-I772 HydrophobicContact CB-CG2 3.8Å; L701-H774 PolarHBondContact N-O 3.38Å; L701-V775 HydrophobicContact CB-CG2 4.48Å; L701-V775 CarbonylContact O-C 3.38Å; L701-V775 VanDerWaalsContact O-CA 3.29Å; L701-V775 WeakPolarHBondContact O-CA 3.49Å; L701-V776 PolarHBondContact O-N 3.4Å; L701-R811 HydrophobicContact CD2-CB 3.75Å; L701-R811 HydrophobicContact CD2-CG 4.03Å
702	C	97.7	Very high	92.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	118.2	-179.6	-174.3	0	0	0	0	110.8	V757 L758 A759 V776	C702-V757 PolarHBondContact N-O 2.89Å; C702-L758 HydrophobicContact CB-CD2 3.71Å; C702-A759 PolarHBondContact O-N 3.45Å; C702-V776 CarbonylContact C-O 3.6Å; C702-V776 WeakPolarHBondContact CA-O 3.09Å; C702-V776 HydrophobicContact CB-CB 4.12Å
703	F	97.7	Very high	92.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	116.8	174.8	-73.7	-77.7	0	0	0	111.2	L701 A759 A763 E764 V775 V776 S778 R808 R811	L701-F703 HydrophobicContact CD2-CE2 3.71Å; L701-F703 HydrophobicContact CD2-CZ 3.72Å; L701-F703 HydrophobicContact CG-CD2 4.47Å; L701-F703 HydrophobicContact CG-CE2 3.98Å; L701-F703 HydrophobicContact CG-CZ 4.23Å; F703-A759 CarbonylContact C-O 3.58Å; F703-A759 VanDerWaalsContact CA-O 3.32Å; F703-A759 WeakPolarHBondContact CA-O 3.19Å; F703-A763 HydrophobicContact CE1-CB 3.89Å; F703-A763 HydrophobicContact CZ-CB 4.23Å; F703-E764 HydrophobicContact CE1-CB 4Å; F703-E764 HydrophobicContact CZ-CB 4.45Å; F703-V775 HydrophobicContact CD2-CG1 3.94Å; F703-V775 HydrophobicContact CE2-CG1 3.98Å; F703-V776 PolarHBondContact N-O 3.49Å; F703-S778 VanDerWaalsContact O-CB 3.31Å; F703-S778 WeakPolarHBondContact O-CB 3.25Å; F703-S778 PolarHBondContact O-N 3.37Å; F703-S778 PolarHBondContact O-OG 3.03Å; F703-R808 HydrophobicContact CD1-CG 4.13Å; F703-R808 HydrophobicContact CD2-CB 3.79Å; F703-R808 HydrophobicContact CD2-CG 3.7Å; F703-R808 HydrophobicContact CE1-CG 4.08Å; F703-R808 HydrophobicContact CE2-CB 3.63Å; F703-R808 HydrophobicContact CE2-CG 3.65Å; F703-R808 HydrophobicContact CG-CB 4.5Å; F703-R808 HydrophobicContact CG-CG 3.94Å; F703-R808 HydrophobicContact CZ-CB 4.23Å; F703-R808 HydrophobicContact CZ-CG 3.85Å; F703-R811 HydrophobicContact CE2-CG 4.17Å; F703-R811 HydrophobicContact CZ-CG 3.96Å
704	L	96.5	Very high	92.5	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.186	C	C	.	.			trans	-121.6	151.9	-177.4	-66.1	170.8	0	0	0	111.2	L679 V684 G706 E709 I710 V713 L758 A759	L679-L704 HydrophobicContact CD2-CD2 3.71Å; V684-L704 HydrophobicContact CG1-CD2 4.25Å; V684-L704 HydrophobicContact CG2-CD2 4.36Å; L704-G706 PolarHBondContact O-N 2.7Å; L704-E709 HydrophobicContact CB-CB 4.22Å; L704-E709 HydrophobicContact CD2-CB 4.47Å; L704-I710 HydrophobicContact CB-CG1 3.91Å; L704-I710 HydrophobicContact CD1-CB 4.35Å; L704-I710 HydrophobicContact CD1-CG1 3.86Å; L704-I710 HydrophobicContact CG-CG1 4.5Å; L704-V713 HydrophobicContact CD1-CB 4.17Å; L704-V713 HydrophobicContact CD1-CG2 4.05Å; L704-V713 HydrophobicContact CD2-CG2 4.31Å; L704-L758 HydrophobicContact CD1-CB 4.33Å; L704-L758 HydrophobicContact CD1-CD2 4.44Å; L704-A759 PolarHBondContact N-O 3.05Å
705	P	92.7	Very high	92.4	Very high	5 Å²	5	31.1 Å²	31.1	3%	0.032	17%	0.167	C	C	.	.	S	Bend	trans	-59.8	-41.4	-174.8	-25.3	31.5	0	0	0	114.5	L679 E709 L780 K782 T797	L679-P705 HydrophobicContact CD2-CG 3.98Å; P705-E709 HydrophobicContact CB-CG 4.36Å; P705-E709 HydrophobicContact CG-CG 4.09Å; P705-L780 HydrophobicContact CB-CB 4.49Å; P705-L780 HydrophobicContact CG-CB 3.76Å; P705-L780 HydrophobicContact CG-CD1 4.35Å; P705-K782 HydrophobicContact CB-CG 4.3Å; P705-K782 WeakPolarHBondContact O-CG 3.12Å; P705-K782 PolarHBondContact O-N 2.78Å; P705-T797 HydrophobicContact CB-CG2 4.04Å; P705-T797 HydrophobicContact CG-CG2 4.26Å
706	G	89	Confident	92.5	Very high	2 Å²	2	33.9 Å²	33.9	2%	0.021	17%	0.171	C	C	.	.	S	Bend	trans	-165.6	-169.5	-174.1	0	0	0	0	0	113.6	L704 Q708 E709 I710	L704-G706 PolarHBondContact O-N 2.7Å; G706-Q708 PolarHBondContact O-N 2.94Å; G706-E709 WeakPolarHBondContact CA-OE2 3.43Å; G706-E709 PolarHBondContact N-OE2 3.18Å; G706-E709 PolarHBondContact O-N 3.4Å; G706-E709 VanDerWaalsContact O-OE2 3.1Å; G706-I710 WeakPolarHBondContact O-CG1 3.48Å; G706-I710 PolarHBondContact O-N 3.24Å; G706-I710 VanDerWaalsContact O-N 3.1Å
707	W	85.4	Confident	92.6	Very high	68 Å²	68	28.4 Å²	28.4	26%	0.258	15%	0.146	S	C	.	.	H	α-helix	trans	-63.6	-36.5	-174.3	-176.4	-118.9	0	0	0	114.3	I710 K711 P732 H734 I737	W707-I710 HydrophobicContact CE3-CB 4.49Å; W707-I710 HydrophobicContact CE3-CG2 4.29Å; W707-I710 HydrophobicContact CZ3-CG2 4.24Å; W707-I710 PolarHBondContact O-N 3.29Å; W707-K711 HydrophobicContact CD2-CG 4.17Å; W707-K711 HydrophobicContact CH2-CD 4.49Å; W707-K711 VanDerWaalsContact CH2-CE 3.42Å; W707-K711 HydrophobicContact CH2-CG 4.45Å; W707-K711 HydrophobicContact CZ2-CD 4.14Å; W707-K711 HydrophobicContact CZ2-CG 3.95Å; W707-K711 WeakPolarHBondContact O-CB 3.46Å; W707-K711 PolarHBondContact O-N 3.49Å; W707-P732 HydrophobicContact CZ3-CB 4.22Å; W707-H734 HydrophobicContact CE3-CB 3.77Å; W707-H734 AromaticContact CE3-CG 3.96Å; W707-H734 HydrophobicContact CZ3-CB 4.03Å; W707-I737 HydrophobicContact CH2-CD1 4.27Å; W707-I737 HydrophobicContact CH2-CG1 4.24Å; W707-I737 HydrophobicContact CZ3-CD1 3.87Å; W707-I737 HydrophobicContact CZ3-CG1 4.05Å
708	Q	84	Confident	92.6	Very high	93 Å²	93	27.6 Å²	27.6	44%	0.435	13%	0.133	S	C	.	.	H	α-helix	trans	-66.6	-42.8	-177.1	-65.1	173.6	-45.3	0	0	110.6	G706 K711 G712 L944	G706-Q708 PolarHBondContact O-N 2.94Å; Q708-K711 PolarHBondContact O-N 3.37Å; Q708-G712 PolarHBondContact O-N 2.93Å; Q708-L944 HydrophobicContact CB-CD1 3.96Å; Q708-L944 HydrophobicContact CG-CD1 3.6Å; Q708-L944 HydrophobicContact CG-CG 4.27Å
709	E	91.6	Very high	92.5	Very high	29 Å²	29	32.3 Å²	32.3	14%	0.136	15%	0.148	C	C	.	.	H	α-helix	trans	-69.6	-41.7	178.5	-56.8	77.4	-167.4	0	0	110.3	L679 L681 L704 P705 G706 K711 G712 V713 K782	L679-E709 HydrophobicContact CD2-CB 4.39Å; L679-E709 HydrophobicContact CD2-CG 4.36Å; L681-E709 HydrophobicContact CD2-CB 3.97Å; L681-E709 HydrophobicContact CD2-CG 4.21Å; L704-E709 HydrophobicContact CB-CB 4.22Å; L704-E709 HydrophobicContact CD2-CB 4.47Å; P705-E709 HydrophobicContact CB-CG 4.36Å; P705-E709 HydrophobicContact CG-CG 4.09Å; G706-E709 WeakPolarHBondContact CA-OE2 3.43Å; G706-E709 PolarHBondContact N-OE2 3.18Å; G706-E709 PolarHBondContact O-N 3.4Å; G706-E709 VanDerWaalsContact O-OE2 3.1Å; E709-K711 VanDerWaalsContact C-N 3.35Å; E709-K711 PolarHBondContact O-N 2.85Å; E709-G712 PolarHBondContact O-N 3.24Å; E709-V713 WeakPolarHBondContact O-CG2 3.45Å; E709-V713 PolarHBondContact O-N 2.84Å; E709-K782 IonicContact OE1-NZ 3.14Å; E709-K782 PolarHBondContact OE1-NZ 2.92Å; E709-K782 VanDerWaalsContact OE1-NZ 3.08Å; E709-K782 IonicContact OE2-NZ 3.16Å; E709-K782 PolarHBondContact OE2-NZ 3.46Å
710	I	92.3	Very high	92.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-55.8	-48.8	172.5	-72	169.4	0	0	0	111.1	L704 G706 W707 Q714 P732 H734 L758 T760	L704-I710 HydrophobicContact CB-CG1 3.91Å; L704-I710 HydrophobicContact CD1-CB 4.35Å; L704-I710 HydrophobicContact CD1-CG1 3.86Å; L704-I710 HydrophobicContact CG-CG1 4.5Å; G706-I710 WeakPolarHBondContact O-CG1 3.48Å; G706-I710 PolarHBondContact O-N 3.24Å; G706-I710 VanDerWaalsContact O-N 3.1Å; W707-I710 HydrophobicContact CE3-CB 4.49Å; W707-I710 HydrophobicContact CE3-CG2 4.29Å; W707-I710 HydrophobicContact CZ3-CG2 4.24Å; W707-I710 PolarHBondContact O-N 3.29Å; I710-Q714 VanDerWaalsContact O-CB 3.24Å; I710-Q714 WeakPolarHBondContact O-CB 3.44Å; I710-Q714 PolarHBondContact O-N 2.96Å; I710-P732 HydrophobicContact CG2-CB 3.61Å; I710-H734 HydrophobicContact CD1-CB 4.3Å; I710-L758 HydrophobicContact CG1-CB 4.47Å; I710-L758 HydrophobicContact CG2-CB 4.02Å; I710-T760 HydrophobicContact CD1-CG2 3.97Å
711	K	89.3	Confident	91.8	Very high	83 Å²	83	36 Å²	36	36%	0.361	18%	0.176	S	C	.	.	H	α-helix	trans	-69	-40.8	-179.5	-79.5	-70.4	176.5	-168.6	0	112.7	W707 Q708 E709 V713 Q714 Q715	W707-K711 HydrophobicContact CD2-CG 4.17Å; W707-K711 HydrophobicContact CH2-CD 4.49Å; W707-K711 VanDerWaalsContact CH2-CE 3.42Å; W707-K711 HydrophobicContact CH2-CG 4.45Å; W707-K711 HydrophobicContact CZ2-CD 4.14Å; W707-K711 HydrophobicContact CZ2-CG 3.95Å; W707-K711 WeakPolarHBondContact O-CB 3.46Å; W707-K711 PolarHBondContact O-N 3.49Å; Q708-K711 PolarHBondContact O-N 3.37Å; E709-K711 VanDerWaalsContact C-N 3.35Å; E709-K711 PolarHBondContact O-N 2.85Å; K711-V713 VanDerWaalsContact C-N 3.34Å; K711-V713 PolarHBondContact O-N 2.79Å; K711-Q714 PolarHBondContact O-N 2.91Å; K711-Q715 WeakPolarHBondContact O-CB 3.32Å; K711-Q715 PolarHBondContact O-N 2.79Å
712	G	90.7	Very high	90.7	Very high	11 Å²	11	38 Å²	38	11%	0.113	20%	0.198	C	C	.	.	H	α-helix	trans	-62.8	-38.9	178.5	0	0	0	0	0	113.1	Q708 E709 R716	Q708-G712 PolarHBondContact O-N 2.93Å; E709-G712 PolarHBondContact O-N 3.24Å; G712-R716 WeakPolarHBondContact O-CG 3.29Å; G712-R716 PolarHBondContact O-N 3.03Å; G712-R716 PolarHBondContact O-NH1 3.21Å
713	V	95.2	Very high	89.4	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-74.1	-42.5	174	175	0	0	0	0	110.9	L681 V684 L704 E709 K711 Q715 R716 L717 L758	L681-V713 HydrophobicContact CB-CG2 4.41Å; L681-V713 HydrophobicContact CD2-CG2 4.08Å; V684-V713 HydrophobicContact CB-CG2 4.07Å; V684-V713 HydrophobicContact CG1-CG1 3.97Å; V684-V713 HydrophobicContact CG1-CG2 3.77Å; L704-V713 HydrophobicContact CD1-CB 4.17Å; L704-V713 HydrophobicContact CD1-CG2 4.05Å; L704-V713 HydrophobicContact CD2-CG2 4.31Å; E709-V713 WeakPolarHBondContact O-CG2 3.45Å; E709-V713 PolarHBondContact O-N 2.84Å; K711-V713 VanDerWaalsContact C-N 3.34Å; K711-V713 PolarHBondContact O-N 2.79Å; V713-Q715 VanDerWaalsContact C-N 3.33Å; V713-Q715 PolarHBondContact O-N 2.59Å; V713-R716 PolarHBondContact O-N 3Å; V713-L717 HydrophobicContact CG1-CD1 3.78Å; V713-L717 HydrophobicContact CG1-CG 4.17Å; V713-L717 WeakPolarHBondContact O-CB 3.4Å; V713-L717 VanDerWaalsContact O-CG 3.3Å; V713-L717 WeakPolarHBondContact O-CG 3.44Å; V713-L717 PolarHBondContact O-N 2.75Å; V713-L758 HydrophobicContact CB-CD1 4.42Å; V713-L758 HydrophobicContact CG1-CD1 4.18Å; V713-L758 HydrophobicContact CG1-CD2 4.02Å
714	Q	92.7	Very high	88.3	Confident	18 Å²	18	50.7 Å²	50.7	8%	0.084	26%	0.259	C	S	.	.	H	α-helix	trans	-55.1	-48.9	176.9	-179.3	172.6	36.1	0	0	111.6	I710 K711 L717 Q718 I730 L758	I710-Q714 VanDerWaalsContact O-CB 3.24Å; I710-Q714 WeakPolarHBondContact O-CB 3.44Å; I710-Q714 PolarHBondContact O-N 2.96Å; K711-Q714 PolarHBondContact O-N 2.91Å; Q714-L717 PolarHBondContact O-N 2.97Å; Q714-Q718 VanDerWaalsContact O-CG 3.31Å; Q714-Q718 WeakPolarHBondContact O-CG 3.42Å; Q714-Q718 PolarHBondContact O-N 2.85Å; Q714-I730 HydrophobicContact CG-CG2 4.12Å; Q714-L758 HydrophobicContact CB-CD1 3.77Å
715	Q	90.5	Very high	87.2	Confident	71 Å²	71	57.2 Å²	57.2	33%	0.332	29%	0.289	S	S	.	.	H	α-helix	trans	-60.7	-50.8	-180	177.8	178.8	-4.3	0	0	111.5	K711 V713 L717 Q718 E719	K711-Q715 WeakPolarHBondContact O-CB 3.32Å; K711-Q715 PolarHBondContact O-N 2.79Å; V713-Q715 VanDerWaalsContact C-N 3.33Å; V713-Q715 PolarHBondContact O-N 2.59Å; Q715-L717 VanDerWaalsContact C-N 3.31Å; Q715-L717 PolarHBondContact O-N 3.43Å; Q715-Q718 PolarHBondContact O-N 2.87Å; Q715-Q718 VanDerWaalsContact O-N 3.11Å; Q715-E719 HydrophobicContact CG-CG 4.46Å; Q715-E719 WeakPolarHBondContact CG-OE1 3.31Å; Q715-E719 PolarHBondContact NE2-OE1 2.84Å; Q715-E719 WeakPolarHBondContact O-CG 3.26Å; Q715-E719 PolarHBondContact O-N 3.09Å
716	R	93.7	Very high	86.7	Confident	79 Å²	79	62.1 Å²	62.1	30%	0.298	32%	0.324	S	S	.	.	H	α-helix	trans	-60.5	-39.4	179.6	-73.4	171.3	169.6	74.7	-2.2	112.7	D682 T685 G712 V713 E719 A720	D682-R716 WeakPolarHBondContact OD1-CD 3.48Å; D682-R716 IonicContact OD1-CZ 3.09Å; D682-R716 IonicContact OD1-NE 2.73Å; D682-R716 PolarHBondContact OD1-NE 3.34Å; D682-R716 IonicContact OD1-NH2 2.74Å; D682-R716 PolarHBondContact OD1-NH2 2.92Å; T685-R716 HydrophobicContact CG2-CB 3.73Å; T685-R716 WeakPolarHBondContact OG1-CD 3.26Å; G712-R716 WeakPolarHBondContact O-CG 3.29Å; G712-R716 PolarHBondContact O-N 3.03Å; G712-R716 PolarHBondContact O-NH1 3.21Å; V713-R716 PolarHBondContact O-N 3Å; R716-E719 PolarHBondContact O-N 2.75Å; R716-A720 VanDerWaalsContact O-CB 3.29Å; R716-A720 WeakPolarHBondContact O-CB 3.35Å; R716-A720 PolarHBondContact O-N 3.05Å
717	L	93.9	Very high	86.7	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-64.3	-44.1	174.1	-71.3	173.4	0	0	0	111.3	T685 V688 L689 V713 Q714 Q715 E719 A720 L721 I730 I756 L758	T685-L717 HydrophobicContact CG2-CD2 3.83Å; T685-L717 HydrophobicContact CG2-CG 4.21Å; V688-L717 HydrophobicContact CB-CD2 4.02Å; V688-L717 HydrophobicContact CG1-CD1 4Å; V688-L717 HydrophobicContact CG1-CD2 3.7Å; L689-L717 HydrophobicContact CD2-CD2 3.98Å; L689-L717 HydrophobicContact CG-CD2 4.05Å; V713-L717 HydrophobicContact CG1-CD1 3.78Å; V713-L717 HydrophobicContact CG1-CG 4.17Å; V713-L717 WeakPolarHBondContact O-CB 3.4Å; V713-L717 VanDerWaalsContact O-CG 3.3Å; V713-L717 WeakPolarHBondContact O-CG 3.44Å; V713-L717 PolarHBondContact O-N 2.75Å; Q714-L717 PolarHBondContact O-N 2.97Å; Q715-L717 VanDerWaalsContact C-N 3.31Å; Q715-L717 PolarHBondContact O-N 3.43Å; L717-E719 VanDerWaalsContact C-N 3.34Å; L717-E719 PolarHBondContact O-N 3.29Å; L717-A720 PolarHBondContact O-N 2.82Å; L717-L721 HydrophobicContact CB-CD1 4.33Å; L717-L721 WeakPolarHBondContact O-CB 3.12Å; L717-L721 WeakPolarHBondContact O-CD1 3.21Å; L717-L721 WeakPolarHBondContact O-CG 3.4Å; L717-L721 PolarHBondContact O-N 3.02Å; L717-I730 HydrophobicContact CB-CD1 4.04Å; L717-I756 HydrophobicContact CD1-CG2 4.19Å; L717-L758 HydrophobicContact CD1-CD1 4.46Å; L717-L758 HydrophobicContact CD1-CD2 4.39Å
718	Q	91.1	Very high	87	Confident	86 Å²	86	65.7 Å²	65.7	40%	0.402	34%	0.34	S	S	.	.	H	α-helix	trans	-63.3	-40.1	177.5	-73.1	175.1	-51.3	0	0	112.1	Q714 Q715 G722 I730	Q714-Q718 VanDerWaalsContact O-CG 3.31Å; Q714-Q718 WeakPolarHBondContact O-CG 3.42Å; Q714-Q718 PolarHBondContact O-N 2.85Å; Q715-Q718 PolarHBondContact O-N 2.87Å; Q715-Q718 VanDerWaalsContact O-N 3.11Å; Q718-G722 VanDerWaalsContact O-CA 3.28Å; Q718-G722 WeakPolarHBondContact O-CA 3.41Å; Q718-G722 PolarHBondContact O-N 2.92Å; Q718-I730 HydrophobicContact CG-CD1 4.04Å
719	E	90.4	Very high	87.4	Confident	124 Å²	124	64 Å²	64	58%	0.579	33%	0.334	S	S	*	.	H	α-helix	trans	-64.5	-46.8	175.4	-72.1	168.9	-173.9	0	0	111.6	Q715 R716 L717	Q715-E719 HydrophobicContact CG-CG 4.46Å; Q715-E719 WeakPolarHBondContact CG-OE1 3.31Å; Q715-E719 PolarHBondContact NE2-OE1 2.84Å; Q715-E719 WeakPolarHBondContact O-CG 3.26Å; Q715-E719 PolarHBondContact O-N 3.09Å; R716-E719 PolarHBondContact O-N 2.75Å; L717-E719 VanDerWaalsContact C-N 3.34Å; L717-E719 PolarHBondContact O-N 3.29Å
720	A	89.1	Confident	87.5	Confident	62 Å²	62	64.1 Å²	64.1	51%	0.512	34%	0.335	S	S	.	.	H	α-helix	trans	-69	-32.8	179.4	0	0	0	0	0	113.3	L689 R716 L717	L689-A720 HydrophobicContact CD1-CB 3.78Å; L689-A720 HydrophobicContact CD2-CB 4.3Å; R716-A720 VanDerWaalsContact O-CB 3.29Å; R716-A720 WeakPolarHBondContact O-CB 3.35Å; R716-A720 PolarHBondContact O-N 3.05Å; L717-A720 PolarHBondContact O-N 2.82Å
721	L	87.7	Confident	87.5	Confident	19 Å²	19	65.3 Å²	65.3	10%	0.099	34%	0.341	C	S	.	.	H	α-helix	trans	-95.8	-2.2	-175.7	-60.9	173.7	0	0	0	113.6	L689 L717 M723 H724 Y728 I730 I756	L689-L721 HydrophobicContact CD2-CD1 4.39Å; L689-L721 HydrophobicContact CD2-CD2 3.48Å; L689-L721 VanDerWaalsContact CD2-CD2 3.48Å; L689-L721 HydrophobicContact CD2-CG 3.91Å; L717-L721 HydrophobicContact CB-CD1 4.33Å; L717-L721 WeakPolarHBondContact O-CB 3.12Å; L717-L721 WeakPolarHBondContact O-CD1 3.21Å; L717-L721 WeakPolarHBondContact O-CG 3.4Å; L717-L721 PolarHBondContact O-N 3.02Å; L721-M723 PolarHBondContact O-N 2.89Å; L721-H724 PolarHBondContact O-N 3.47Å; L721-Y728 HydrophobicContact CB-CD2 3.95Å; L721-Y728 HydrophobicContact CB-CE2 3.87Å; L721-Y728 HydrophobicContact CD1-CD1 3.97Å; L721-Y728 HydrophobicContact CD1-CD2 3.85Å; L721-Y728 HydrophobicContact CD1-CE1 4.19Å; L721-Y728 HydrophobicContact CD1-CE2 4.04Å; L721-Y728 HydrophobicContact CD1-CG 3.82Å; L721-Y728 HydrophobicContact CD2-CD2 4.33Å; L721-Y728 HydrophobicContact CD2-CE1 4.15Å; L721-Y728 HydrophobicContact CD2-CE2 3.67Å; L721-Y728 HydrophobicContact CG-CD2 4.26Å; L721-Y728 HydrophobicContact CG-CE2 4.06Å; L721-I730 HydrophobicContact CD1-CD1 4.34Å; L721-I756 HydrophobicContact CD1-CD1 4.49Å
722	G	72.9	Confident	87.5	Confident	47 Å²	47	62.8 Å²	62.8	49%	0.485	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-52	-26.8	-162.2	0	0	0	0	0	117.4	Q718 H724	Q718-G722 VanDerWaalsContact O-CA 3.28Å; Q718-G722 WeakPolarHBondContact O-CA 3.41Å; Q718-G722 PolarHBondContact O-N 2.92Å; G722-H724 PolarHBondContact O-N 3.11Å
723	M	71.3	Confident	87.4	Confident	177 Å²	177	62.2 Å²	62.2	87%	0.872	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-75	-10.1	175.6	-64.1	-62.7	-70.9	0	0	113.9	L721	L721-M723 PolarHBondContact O-N 2.89Å
724	H	75.1	Confident	86.9	Confident	90 Å²	90	63.3 Å²	63.3	42%	0.417	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-135.8	27.7	-169.9	-69.4	-34	0	0	0	112.8	L721 G722 S726 K727 Y728	L721-H724 PolarHBondContact O-N 3.47Å; G722-H724 PolarHBondContact O-N 3.11Å; H724-S726 PolarHBondContact O-N 2.97Å; H724-K727 HydrophobicContact CB-CD 4.19Å; H724-K727 HydrophobicContact CB-CG 4.46Å; H724-K727 WeakPolarHBondContact O-CB 3.44Å; H724-K727 PolarHBondContact O-N 3.01Å; H724-Y728 HydrophobicContact CB-CD2 4.46Å; H724-Y728 HydrophobicContact CB-CE2 3.75Å; H724-Y728 WeakPolarHBondContact O-CD2 3.47Å; H724-Y728 WeakPolarHBondContact O-CE2 3.37Å
725	E	72.8	Confident	86.1	Confident	137 Å²	137	65.8 Å²	65.8	64%	0.64	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-51.3	-35.9	-175.9	-169.1	174.8	-167.9	0	0	113.4	K727 Y728	E725-K727 PolarHBondContact O-N 2.82Å; E725-K727 VanDerWaalsContact O-N 3.16Å; E725-Y728 PolarHBondContact O-N 3.36Å; E725-Y728 VanDerWaalsContact O-N 3.11Å
726	S	81.8	Confident	85.1	Confident	108 Å²	108	66 Å²	66	76%	0.755	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-65.1	-16.5	177.5	59.2	0	0	0	0	115.1	H724	H724-S726 PolarHBondContact O-N 2.97Å
727	K	89.4	Confident	84.2	Confident	104 Å²	104	63 Å²	63	45%	0.452	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-87.8	-6.1	176.3	-63	-174.8	-179	173.2	0	113.2	H724 E725 V753 R754	H724-K727 HydrophobicContact CB-CD 4.19Å; H724-K727 HydrophobicContact CB-CG 4.46Å; H724-K727 WeakPolarHBondContact O-CB 3.44Å; H724-K727 PolarHBondContact O-N 3.01Å; E725-K727 PolarHBondContact O-N 2.82Å; E725-K727 VanDerWaalsContact O-N 3.16Å; K727-V753 CarbonylContact O-C 3.6Å; K727-V753 VanDerWaalsContact O-CA 3.28Å; K727-V753 WeakPolarHBondContact O-CA 3.41Å; K727-R754 PolarHBondContact O-N 3.14Å
728	Y	92.2	Very high	83.1	Confident	41 Å²	41	64.3 Å²	64.3	16%	0.161	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	138.5	-173.8	-55.5	-76	0	0	0	112	D692 L721 H724 E725 R754 I756	D692-Y728 WeakPolarHBondContact OD2-CE1 3.15Å; D692-Y728 PolarHBondContact OD2-OH 3.07Å; L721-Y728 HydrophobicContact CB-CD2 3.95Å; L721-Y728 HydrophobicContact CB-CE2 3.87Å; L721-Y728 HydrophobicContact CD1-CD1 3.97Å; L721-Y728 HydrophobicContact CD1-CD2 3.85Å; L721-Y728 HydrophobicContact CD1-CE1 4.19Å; L721-Y728 HydrophobicContact CD1-CE2 4.04Å; L721-Y728 HydrophobicContact CD1-CG 3.82Å; L721-Y728 HydrophobicContact CD2-CD2 4.33Å; L721-Y728 HydrophobicContact CD2-CE1 4.15Å; L721-Y728 HydrophobicContact CD2-CE2 3.67Å; L721-Y728 HydrophobicContact CG-CD2 4.26Å; L721-Y728 HydrophobicContact CG-CE2 4.06Å; H724-Y728 HydrophobicContact CB-CD2 4.46Å; H724-Y728 HydrophobicContact CB-CE2 3.75Å; H724-Y728 WeakPolarHBondContact O-CD2 3.47Å; H724-Y728 WeakPolarHBondContact O-CE2 3.37Å; E725-Y728 PolarHBondContact O-N 3.36Å; E725-Y728 VanDerWaalsContact O-N 3.11Å; Y728-R754 WeakPolarHBondContact CA-O 3.3Å; Y728-R754 HydrophobicContact CD1-CB 3.94Å; Y728-R754 HydrophobicContact CE1-CB 4.2Å; Y728-I756 HydrophobicContact CD1-CD1 4.36Å
729	L	92.1	Very high	82.2	Confident	59 Å²	59	61.6 Å²	61.6	31%	0.309	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	91.8	171.4	-179.2	61.7	0	0	0	108.8	L731 V753 R754 K755 I756	L729-L731 HydrophobicContact CD1-CD2 3.84Å; L729-L731 HydrophobicContact CD1-CG 4.28Å; L729-L731 HydrophobicContact CD2-CD1 4.14Å; L729-L731 HydrophobicContact CG-CD1 4.1Å; L729-L731 HydrophobicContact CG-CD2 4.06Å; L729-L731 HydrophobicContact CG-CG 3.93Å; L729-V753 HydrophobicContact CB-CG1 3.85Å; L729-R754 PolarHBondContact N-O 3.45Å; L729-K755 HydrophobicContact CD2-CG 4.26Å; L729-K755 HydrophobicContact CG-CG 4.47Å; L729-K755 WeakPolarHBondContact O-CA 3.41Å; L729-I756 PolarHBondContact O-N 2.92Å
730	I	92.8	Very high	81.4	Confident	31 Å²	31	62.5 Å²	62.5	16%	0.159	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	110.9	-178.5	-53.4	174.8	0	0	0	109.8	Q714 L717 Q718 L721 I756 L758	Q714-I730 HydrophobicContact CG-CG2 4.12Å; L717-I730 HydrophobicContact CB-CD1 4.04Å; Q718-I730 HydrophobicContact CG-CD1 4.04Å; L721-I730 HydrophobicContact CD1-CD1 4.34Å; I730-I756 CarbonylContact C-O 3.54Å; I730-I756 WeakPolarHBondContact CA-O 3.5Å; I730-I756 HydrophobicContact CG1-CB 4.37Å; I730-I756 HydrophobicContact CG1-CD1 4.42Å; I730-L758 HydrophobicContact CG2-CD1 4.03Å; I730-L758 HydrophobicContact CG2-CG 4.42Å
731	L	92.1	Very high	80.7	Confident	25 Å²	25	63.3 Å²	63.3	13%	0.131	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	104.3	-173.8	-60.9	178	0	0	0	111	L729 A744 I745 K755 I756 V757 L758	L729-L731 HydrophobicContact CD1-CD2 3.84Å; L729-L731 HydrophobicContact CD1-CG 4.28Å; L729-L731 HydrophobicContact CD2-CD1 4.14Å; L729-L731 HydrophobicContact CG-CD1 4.1Å; L729-L731 HydrophobicContact CG-CD2 4.06Å; L729-L731 HydrophobicContact CG-CG 3.93Å; L731-A744 HydrophobicContact CD2-CB 4.49Å; L731-I745 HydrophobicContact CB-CG2 4.5Å; L731-I745 HydrophobicContact CD1-CG2 4.31Å; L731-K755 HydrophobicContact CD1-CG 4.34Å; L731-I756 PolarHBondContact N-O 3.49Å; L731-V757 CarbonylContact O-C 3.58Å; L731-V757 WeakPolarHBondContact O-CA 3.45Å; L731-L758 PolarHBondContact O-N 2.91Å
732	P	91.1	Very high	80.2	Confident	29 Å²	29	62.8 Å²	62.8	19%	0.188	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	143.7	169.5	29.9	-33.1	0	0	0	110.5	W707 I710 I737 L758	W707-P732 HydrophobicContact CZ3-CB 4.22Å; I710-P732 HydrophobicContact CG2-CB 3.61Å; P732-I737 HydrophobicContact CB-CD1 3.87Å; P732-I737 HydrophobicContact CG-CD1 4.01Å; P732-I737 WeakPolarHBondContact O-CD1 3.43Å; P732-L758 CarbonylContact C-O 3.56Å; P732-L758 WeakPolarHBondContact CA-O 3.41Å
733	V	87.7	Confident	80.6	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	110.7	178.4	-166.1	0	0	0	0	109.8	Q742 I745 V757 L758 A759 T760 I762	V733-Q742 HydrophobicContact CG1-CG 4.42Å; V733-I745 HydrophobicContact CG2-CG2 3.52Å; V733-V757 HydrophobicContact CG2-CG1 3.43Å; V733-V757 VanDerWaalsContact CG2-CG1 3.43Å; V733-L758 PolarHBondContact N-O 2.92Å; V733-A759 HydrophobicContact CB-CB 3.83Å; V733-A759 HydrophobicContact CG2-CB 4.34Å; V733-A759 WeakPolarHBondContact O-CA 3.13Å; V733-T760 PolarHBondContact O-N 2.63Å; V733-I762 HydrophobicContact CB-CG2 4.37Å; V733-I762 HydrophobicContact CG1-CG2 3.66Å
734	H	85.6	Confident	81.1	Confident	23 Å²	23	55.9 Å²	55.9	11%	0.106	30%	0.297	C	S	.	.			trans	-147	156	-178.3	-173.2	-94	0	0	0	109.3	W707 I710 N736 I737 Q742	W707-H734 HydrophobicContact CE3-CB 3.77Å; W707-H734 AromaticContact CE3-CG 3.96Å; W707-H734 HydrophobicContact CZ3-CB 4.03Å; I710-H734 HydrophobicContact CD1-CB 4.3Å; H734-N736 WeakPolarHBondContact ND1-CB 3.34Å; H734-N736 PolarHBondContact ND1-N 3.05Å; H734-N736 PolarHBondContact O-N 2.98Å; H734-I737 HydrophobicContact CB-CD1 4.24Å; H734-I737 HydrophobicContact CB-CG1 4.19Å; H734-I737 WeakPolarHBondContact O-CB 3.47Å; H734-I737 PolarHBondContact O-N 2.74Å; H734-Q742 PolarHBondContact O-NE2 3.46Å; H734-Q742 VanDerWaalsContact O-NE2 3.12Å
735	S	75.4	Confident	81.5	Confident	69 Å²	69	51.8 Å²	51.8	48%	0.483	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-22.1	175.8	55.8	0	0	0	0	113.8	R937	S735-R937 PolarHBondContact O-NH2 2.74Å; S735-R937 VanDerWaalsContact O-NH2 3.11Å
736	N	69.9	Low	82.1	Confident	77 Å²	77	48.2 Å²	48.2	41%	0.412	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-17.9	176.3	-68.3	-7.9	0	0	0	113.6	H734 R937	H734-N736 WeakPolarHBondContact ND1-CB 3.34Å; H734-N736 PolarHBondContact ND1-N 3.05Å; H734-N736 PolarHBondContact O-N 2.98Å; N736-R937 VanDerWaalsContact CA-NH1 3.31Å; N736-R937 PolarHBondContact O-NH1 3.28Å
737	I	74.2	Confident	82.2	Confident	16 Å²	16	49.5 Å²	49.5	8%	0.082	25%	0.254	C	S	.	.	S	Bend	trans	-81.1	137.5	-178.6	-61.1	179	0	0	0	109.7	W707 P732 H734 D741 Q742	W707-I737 HydrophobicContact CH2-CD1 4.27Å; W707-I737 HydrophobicContact CH2-CG1 4.24Å; W707-I737 HydrophobicContact CZ3-CD1 3.87Å; W707-I737 HydrophobicContact CZ3-CG1 4.05Å; P732-I737 HydrophobicContact CB-CD1 3.87Å; P732-I737 HydrophobicContact CG-CD1 4.01Å; P732-I737 WeakPolarHBondContact O-CD1 3.43Å; H734-I737 HydrophobicContact CB-CD1 4.24Å; H734-I737 HydrophobicContact CB-CG1 4.19Å; H734-I737 WeakPolarHBondContact O-CB 3.47Å; H734-I737 PolarHBondContact O-N 2.74Å; I737-D741 HydrophobicContact CG2-CB 3.73Å; I737-Q742 HydrophobicContact CB-CG 4.13Å; I737-Q742 HydrophobicContact CG2-CG 3.97Å; I737-Q742 PolarHBondContact O-NE2 3.35Å
738	P	70.1	Confident	82	Confident	27 Å²	27	52.1 Å²	52.1	18%	0.175	27%	0.268	C	S	.	.			trans	-57.4	146.7	178.2	-25.8	35.9	0	0	0	113.4	M740 D741 Q742 Y997 P999	P738-M740 PolarHBondContact O-N 3.03Å; P738-M740 VanDerWaalsContact O-N 3.16Å; P738-D741 WeakPolarHBondContact CD-OD2 3.45Å; P738-D741 WeakPolarHBondContact CG-OD2 3.48Å; P738-D741 PolarHBondContact O-N 3.05Å; P738-Q742 WeakPolarHBondContact O-CG 3.29Å; P738-Q742 PolarHBondContact O-N 3.02Å; P738-Y997 WeakPolarHBondContact CD-OH 3.43Å; P738-Y997 HydrophobicContact CG-CE1 4.27Å; P738-P999 HydrophobicContact CB-CB 4.08Å; P738-P999 HydrophobicContact CG-CB 3.14Å; P738-P999 HydrophobicContact CG-CG 3.74Å
739	M	73.6	Confident	81.9	Confident	28 Å²	28	51.8 Å²	51.8	14%	0.138	27%	0.271	C	S	.	.	H	α-helix	trans	-55.9	-32.6	177.5	-83.7	-56.5	-55.4	0	0	113.9	I523 K743	I523-M739 VanDerWaalsContact CA-CE 3.41Å; I523-M739 HydrophobicContact CB-CE 3.56Å; I523-M739 HydrophobicContact CB-SD 3.83Å; I523-M739 HydrophobicContact CD1-CE 4.26Å; I523-M739 HydrophobicContact CG1-CE 3.84Å; M739-K743 VanDerWaalsContact O-CG 3.29Å; M739-K743 WeakPolarHBondContact O-CG 3.28Å; M739-K743 PolarHBondContact O-N 3.31Å
740	M	71.9	Confident	81.7	Confident	144 Å²	144	53.1 Å²	53.1	71%	0.709	28%	0.283	S	S	*	.	H	α-helix	trans	-66.6	-40.5	177.3	-163.8	73.1	106.2	0	0	111.5	P738 K743	P738-M740 PolarHBondContact O-N 3.03Å; P738-M740 VanDerWaalsContact O-N 3.16Å; M740-K743 WeakPolarHBondContact O-CB 3.32Å; M740-K743 PolarHBondContact O-N 3.14Å
741	D	74.5	Confident	81.5	Confident	78 Å²	78	60.3 Å²	60.3	42%	0.417	32%	0.321	S	S	.	.	H	α-helix	trans	-78.6	-36.8	-177.6	-54.2	-22.1	0	0	0	110.4	I737 P738 K743 A744	I737-D741 HydrophobicContact CG2-CB 3.73Å; P738-D741 WeakPolarHBondContact CD-OD2 3.45Å; P738-D741 WeakPolarHBondContact CG-OD2 3.48Å; P738-D741 PolarHBondContact O-N 3.05Å; D741-K743 PolarHBondContact O-N 2.78Å; D741-A744 WeakPolarHBondContact O-CB 3.4Å; D741-A744 PolarHBondContact O-N 3.31Å
742	Q	78.2	Confident	81.3	Confident	8 Å²	8	62.9 Å²	62.9	4%	0.037	35%	0.353	C	S	.	.	H	α-helix	trans	-59.6	-28.7	170.3	-65.5	-175.6	24.8	0	0	111.9	I523 V733 H734 I737 P738 A744 I745	I523-Q742 HydrophobicContact CD1-CB 3.63Å; I523-Q742 VanDerWaalsContact CD1-OE1 3.3Å; V733-Q742 HydrophobicContact CG1-CG 4.42Å; H734-Q742 PolarHBondContact O-NE2 3.46Å; H734-Q742 VanDerWaalsContact O-NE2 3.12Å; I737-Q742 HydrophobicContact CB-CG 4.13Å; I737-Q742 HydrophobicContact CG2-CG 3.97Å; I737-Q742 PolarHBondContact O-NE2 3.35Å; P738-Q742 WeakPolarHBondContact O-CG 3.29Å; P738-Q742 PolarHBondContact O-N 3.02Å; Q742-A744 PolarHBondContact O-N 3.46Å; Q742-I745 WeakPolarHBondContact O-CD1 3.42Å; Q742-I745 WeakPolarHBondContact O-CG1 3.48Å; Q742-I745 WeakPolarHBondContact O-CG2 3.47Å; Q742-I745 PolarHBondContact O-N 2.93Å
743	K	80.3	Confident	81.3	Confident	52 Å²	52	63 Å²	63	23%	0.226	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-68.3	-19.7	175.9	-75.5	169	-174.6	175.6	0	113.3	M739 M740 D741 I745 F746	M739-K743 VanDerWaalsContact O-CG 3.29Å; M739-K743 WeakPolarHBondContact O-CG 3.28Å; M739-K743 PolarHBondContact O-N 3.31Å; M740-K743 WeakPolarHBondContact O-CB 3.32Å; M740-K743 PolarHBondContact O-N 3.14Å; D741-K743 PolarHBondContact O-N 2.78Å; K743-I745 PolarHBondContact O-N 3.36Å; K743-I745 VanDerWaalsContact O-N 3.17Å; K743-F746 HydrophobicContact CB-CD2 4.34Å; K743-F746 HydrophobicContact CG-CD2 4.45Å; K743-F746 HydrophobicContact CG-CE2 4.47Å; K743-F746 WeakPolarHBondContact O-CD2 3.33Å; K743-F746 PolarHBondContact O-N 3.35Å; K743-F746 VanDerWaalsContact O-N 3.09Å
744	A	82.4	Confident	81.6	Confident	28 Å²	28	64.3 Å²	64.3	23%	0.231	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-59.8	-26.1	176.2	0	0	0	0	0	111.9	L731 D741 Q742 F746 Q747	L731-A744 HydrophobicContact CD2-CB 4.49Å; D741-A744 WeakPolarHBondContact O-CB 3.4Å; D741-A744 PolarHBondContact O-N 3.31Å; Q742-A744 PolarHBondContact O-N 3.46Å; A744-F746 PolarHBondContact O-N 3.16Å; A744-F746 VanDerWaalsContact O-N 3.14Å; A744-Q747 PolarHBondContact O-N 3.12Å; A744-Q747 VanDerWaalsContact O-N 3.13Å
745	I	84.4	Confident	82.1	Confident	3 Å²	3	63.3 Å²	63.3	2%	0.015	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-63.6	-19.8	177.5	78.6	-168.9	0	0	0	113.3	I523 L731 V733 Q742 K743 K755 V757 I767 V769	I523-I745 HydrophobicContact CD1-CD1 4.38Å; L731-I745 HydrophobicContact CB-CG2 4.5Å; L731-I745 HydrophobicContact CD1-CG2 4.31Å; V733-I745 HydrophobicContact CG2-CG2 3.52Å; Q742-I745 WeakPolarHBondContact O-CD1 3.42Å; Q742-I745 WeakPolarHBondContact O-CG1 3.48Å; Q742-I745 WeakPolarHBondContact O-CG2 3.47Å; Q742-I745 PolarHBondContact O-N 2.93Å; K743-I745 PolarHBondContact O-N 3.36Å; K743-I745 VanDerWaalsContact O-N 3.17Å; I745-K755 WeakPolarHBondContact O-CE 3.45Å; I745-K755 PolarHBondContact O-NZ 3.23Å; I745-V757 HydrophobicContact CG2-CG1 4.35Å; I745-I767 HydrophobicContact CD1-CD1 4.48Å; I745-I767 HydrophobicContact CD1-CG2 3.7Å; I745-V769 HydrophobicContact CD1-CG2 4.46Å; I745-V769 HydrophobicContact CG1-CG2 4.17Å; I745-V769 WeakPolarHBondContact O-CG1 3.37Å
746	F	84	Confident	83.1	Confident	62 Å²	62	60 Å²	60	27%	0.272	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-87.8	-14.6	179.5	-58.4	-67	0	0	0	113.1	I523 K743 A744 I767 T768	I523-F746 HydrophobicContact CD1-CE2 4.04Å; I523-F746 HydrophobicContact CD1-CZ 4.19Å; I523-F746 HydrophobicContact CG1-CE2 4.2Å; I523-F746 HydrophobicContact CG1-CZ 4.16Å; K743-F746 HydrophobicContact CB-CD2 4.34Å; K743-F746 HydrophobicContact CG-CD2 4.45Å; K743-F746 HydrophobicContact CG-CE2 4.47Å; K743-F746 WeakPolarHBondContact O-CD2 3.33Å; K743-F746 PolarHBondContact O-N 3.35Å; K743-F746 VanDerWaalsContact O-N 3.09Å; A744-F746 PolarHBondContact O-N 3.16Å; A744-F746 VanDerWaalsContact O-N 3.14Å; F746-I767 HydrophobicContact CE1-CB 4.41Å; F746-I767 HydrophobicContact CE1-CG2 3.46Å; F746-I767 VanDerWaalsContact CE1-CG2 3.46Å; F746-I767 HydrophobicContact CZ-CG1 4.49Å; F746-I767 HydrophobicContact CZ-CG2 3.71Å; F746-T768 WeakPolarHBondContact CD1-O 3.26Å
747	Q	85	Confident	84.3	Confident	136 Å²	136	56.5 Å²	56.5	64%	0.636	31%	0.312	S	S	*	.	S	Bend	trans	-75	138.3	178.9	-62.1	179.8	4.1	0	0	109.6	A744 K755	A744-Q747 PolarHBondContact O-N 3.12Å; A744-Q747 VanDerWaalsContact O-N 3.13Å; Q747-K755 PolarHBondContact O-NZ 2.97Å
748	Q	85.3	Confident	85.3	Confident	159 Å²	159	55.7 Å²	55.7	74%	0.743	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-68.4	137.3	170.9	-74.2	-173.5	-25.5	0	0	109.2
749	P	88.5	Confident	86.4	Confident	34 Å²	34	54.4 Å²	54.4	22%	0.221	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-66.2	152.2	175.7	28.3	-33.4	0	0	0	110.4	V753 K755 D771	P749-V753 HydrophobicContact CB-CB 4.37Å; P749-V753 HydrophobicContact CB-CG1 4.45Å; P749-K755 HydrophobicContact CB-CB 4.15Å; P749-K755 HydrophobicContact CG-CB 4.13Å; P749-D771 VanDerWaalsContact CD-OD2 3.27Å; P749-D771 WeakPolarHBondContact CD-OD2 3.38Å
750	P	89	Confident	87.3	Confident	86 Å²	86	53.5 Å²	53.5	56%	0.558	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-54.9	154.6	168.9	-22.3	32.6	0	0	0	111.8	G752 V753	P750-G752 PolarHBondContact O-N 3.44Å; P750-V753 HydrophobicContact CB-CB 4.41Å; P750-V753 HydrophobicContact CB-CG2 3.89Å; P750-V753 HydrophobicContact CG-CG2 4.23Å; P750-V753 WeakPolarHBondContact O-CB 3.5Å; P750-V753 PolarHBondContact O-N 3.28Å
751	L	87.8	Confident	88.2	Confident	183 Å²	183	48.9 Å²	48.9	96%	0.958	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	130.8	177.8	-67.2	173.8	0	0	0	110.7	V753	L751-V753 VanDerWaalsContact C-N 3.3Å; L751-V753 PolarHBondContact O-N 3.16Å
752	G	87.8	Confident	88.7	Confident	79 Å²	79	45.8 Å²	45.8	81%	0.814	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	0	-178.4	0	0	0	0	0	115.4	P750	P750-G752 PolarHBondContact O-N 3.44Å
753	V	92.5	Very high	89.1	Confident	31 Å²	31	45.7 Å²	45.7	19%	0.188	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-97.2	124.2	177.1	177.2	0	0	0	0	110.5	K727 L729 P749 P750 L751	K727-V753 CarbonylContact O-C 3.6Å; K727-V753 VanDerWaalsContact O-CA 3.28Å; K727-V753 WeakPolarHBondContact O-CA 3.41Å; L729-V753 HydrophobicContact CB-CG1 3.85Å; P749-V753 HydrophobicContact CB-CB 4.37Å; P749-V753 HydrophobicContact CB-CG1 4.45Å; P750-V753 HydrophobicContact CB-CB 4.41Å; P750-V753 HydrophobicContact CB-CG2 3.89Å; P750-V753 HydrophobicContact CG-CG2 4.23Å; P750-V753 WeakPolarHBondContact O-CB 3.5Å; P750-V753 PolarHBondContact O-N 3.28Å; L751-V753 VanDerWaalsContact C-N 3.3Å; L751-V753 PolarHBondContact O-N 3.16Å
754	R	94.3	Very high	89.3	Confident	28 Å²	28	43.4 Å²	43.4	11%	0.106	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	122.2	172.7	-180	80.2	91.3	178.1	2.2	109.3	I691 D692 G695 E696 G698 I700 K727 Y728 L729 I756	I691-R754 PolarHBondContact O-NH2 2.7Å; I691-R754 VanDerWaalsContact O-NH2 3.08Å; D692-R754 PolarHBondContact O-NH2 2.8Å; D692-R754 VanDerWaalsContact OD1-CG 3.29Å; D692-R754 WeakPolarHBondContact OD1-CG 3.45Å; D692-R754 IonicContact OD1-CZ 2.72Å; D692-R754 IonicContact OD1-NE 3.12Å; D692-R754 PolarHBondContact OD1-NE 3.32Å; D692-R754 IonicContact OD1-NH2 3.62Å; G695-R754 PolarHBondContact O-NH2 2.85Å; E696-R754 PolarHBondContact O-NH1 3.28Å; G698-R754 WeakPolarHBondContact O-CD 3.3Å; G698-R754 PolarHBondContact O-NH1 3.41Å; I700-R754 HydrophobicContact CD1-CG 4.46Å; K727-R754 PolarHBondContact O-N 3.14Å; Y728-R754 WeakPolarHBondContact CA-O 3.3Å; Y728-R754 HydrophobicContact CD1-CB 3.94Å; Y728-R754 HydrophobicContact CE1-CB 4.2Å; L729-R754 PolarHBondContact N-O 3.45Å; R754-I756 HydrophobicContact CG-CG1 4.19Å
755	K	94.8	Very high	89	Confident	1 Å²	1	42.3 Å²	42.3	0%	0.004	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	129.3	174.3	-172.9	-173.3	-177.1	174.9	0	110.9	G699 I700 L729 L731 I745 Q747 P749 V757 D771	G699-K755 CarbonylContact C-O 3.51Å; G699-K755 VanDerWaalsContact CA-O 3.29Å; G699-K755 WeakPolarHBondContact CA-O 3.45Å; I700-K755 PolarHBondContact N-O 3.05Å; L729-K755 HydrophobicContact CD2-CG 4.26Å; L729-K755 HydrophobicContact CG-CG 4.47Å; L729-K755 WeakPolarHBondContact O-CA 3.41Å; L731-K755 HydrophobicContact CD1-CG 4.34Å; I745-K755 WeakPolarHBondContact O-CE 3.45Å; I745-K755 PolarHBondContact O-NZ 3.23Å; Q747-K755 PolarHBondContact O-NZ 2.97Å; P749-K755 HydrophobicContact CB-CB 4.15Å; P749-K755 HydrophobicContact CG-CB 4.13Å; K755-V757 HydrophobicContact CD-CG2 4.32Å; K755-V757 HydrophobicContact CG-CG2 4.13Å; K755-D771 WeakPolarHBondContact CD-OD2 3.44Å; K755-D771 IonicContact NZ-OD1 3.08Å; K755-D771 PolarHBondContact NZ-OD1 3.24Å; K755-D771 VanDerWaalsContact NZ-OD1 3.11Å; K755-D771 IonicContact NZ-OD2 3.16Å; K755-D771 PolarHBondContact NZ-OD2 3.18Å
756	I	95.7	Very high	88.3	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	110.4	179	-56.9	173.3	0	0	0	107.9	V688 I700 L717 L721 Y728 L729 I730 L731 R754 L758	V688-I756 HydrophobicContact CG1-CD1 3.96Å; V688-I756 HydrophobicContact CG1-CG2 4.16Å; I700-I756 HydrophobicContact CB-CG1 4.49Å; I700-I756 HydrophobicContact CD1-CG1 4.33Å; I700-I756 CarbonylContact O-C 3.39Å; I700-I756 WeakPolarHBondContact O-CA 3.34Å; L717-I756 HydrophobicContact CD1-CG2 4.19Å; L721-I756 HydrophobicContact CD1-CD1 4.49Å; Y728-I756 HydrophobicContact CD1-CD1 4.36Å; L729-I756 PolarHBondContact O-N 2.92Å; I730-I756 CarbonylContact C-O 3.54Å; I730-I756 WeakPolarHBondContact CA-O 3.5Å; I730-I756 HydrophobicContact CG1-CB 4.37Å; I730-I756 HydrophobicContact CG1-CD1 4.42Å; L731-I756 PolarHBondContact N-O 3.49Å; R754-I756 HydrophobicContact CG-CG1 4.19Å; I756-L758 HydrophobicContact CG2-CD2 3.91Å; I756-L758 HydrophobicContact CG2-CG 4.4Å
757	V	95.2	Very high	87.9	Confident	2 Å²	2	40 Å²	40	1%	0.012	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	117.7	-179.8	-174.7	0	0	0	0	108.7	I700 L701 C702 L731 V733 I745 K755 A759 I772	I700-V757 PolarHBondContact O-N 3.09Å; L701-V757 CarbonylContact C-O 3.54Å; L701-V757 WeakPolarHBondContact CA-O 3.49Å; L701-V757 HydrophobicContact CD1-CB 3.79Å; L701-V757 HydrophobicContact CD1-CG1 3.64Å; C702-V757 PolarHBondContact N-O 2.89Å; L731-V757 CarbonylContact O-C 3.58Å; L731-V757 WeakPolarHBondContact O-CA 3.45Å; V733-V757 HydrophobicContact CG2-CG1 3.43Å; V733-V757 VanDerWaalsContact CG2-CG1 3.43Å; I745-V757 HydrophobicContact CG2-CG1 4.35Å; K755-V757 HydrophobicContact CD-CG2 4.32Å; K755-V757 HydrophobicContact CG-CG2 4.13Å; V757-A759 HydrophobicContact CG1-CB 4.44Å; V757-I772 HydrophobicContact CG2-CD1 4.26Å
758	L	95.9	Very high	87.3	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	106.2	178.5	-56.4	179.2	0	0	0	108.8	C702 L704 I710 V713 Q714 L717 I730 L731 P732 V733 I756	C702-L758 HydrophobicContact CB-CD2 3.71Å; L704-L758 HydrophobicContact CD1-CB 4.33Å; L704-L758 HydrophobicContact CD1-CD2 4.44Å; I710-L758 HydrophobicContact CG1-CB 4.47Å; I710-L758 HydrophobicContact CG2-CB 4.02Å; V713-L758 HydrophobicContact CB-CD1 4.42Å; V713-L758 HydrophobicContact CG1-CD1 4.18Å; V713-L758 HydrophobicContact CG1-CD2 4.02Å; Q714-L758 HydrophobicContact CB-CD1 3.77Å; L717-L758 HydrophobicContact CD1-CD1 4.46Å; L717-L758 HydrophobicContact CD1-CD2 4.39Å; I730-L758 HydrophobicContact CG2-CD1 4.03Å; I730-L758 HydrophobicContact CG2-CG 4.42Å; L731-L758 PolarHBondContact O-N 2.91Å; P732-L758 CarbonylContact C-O 3.56Å; P732-L758 WeakPolarHBondContact CA-O 3.41Å; V733-L758 PolarHBondContact N-O 2.92Å; I756-L758 HydrophobicContact CG2-CD2 3.91Å; I756-L758 HydrophobicContact CG2-CG 4.4Å
759	A	94.2	Very high	87.1	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	153.2	-166.2	0	0	0	0	0	114	L701 C702 F703 L704 V733 V757 A763	L701-A759 HydrophobicContact CD1-CB 3.88Å; C702-A759 PolarHBondContact O-N 3.45Å; F703-A759 CarbonylContact C-O 3.58Å; F703-A759 VanDerWaalsContact CA-O 3.32Å; F703-A759 WeakPolarHBondContact CA-O 3.19Å; L704-A759 PolarHBondContact N-O 3.05Å; V733-A759 HydrophobicContact CB-CB 3.83Å; V733-A759 HydrophobicContact CG2-CB 4.34Å; V733-A759 WeakPolarHBondContact O-CA 3.13Å; V757-A759 HydrophobicContact CG1-CB 4.44Å; A759-A763 HydrophobicContact CB-CB 3.53Å
760	T	92.4	Very high	86.8	Confident	9 Å²	9	31.5 Å²	31.5	6%	0.055	20%	0.195	C	C	.	.			trans	-82.9	-173.5	161.4	44.1	0	0	0	0	110.8	I710 V733 I762 A763	I710-T760 HydrophobicContact CD1-CG2 3.97Å; V733-T760 PolarHBondContact O-N 2.63Å; T760-I762 PolarHBondContact O-N 3.48Å; T760-I762 WeakPolarHBondContact OG1-CG2 3.4Å; T760-A763 PolarHBondContact O-N 3.39Å; T760-A763 VanDerWaalsContact O-N 3.13Å
761	N	89.6	Confident	86.9	Confident	47 Å²	47	28.3 Å²	28.3	25%	0.251	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-53.4	-9.8	170.4	67.2	-16.2	0	0	0	114.5	A763 E764	N761-A763 PolarHBondContact O-N 2.82Å; N761-E764 HydrophobicContact CB-CB 4.42Å; N761-E764 WeakPolarHBondContact O-CB 3.31Å; N761-E764 PolarHBondContact O-N 3.4Å
762	I	84.4	Confident	87.1	Confident	13 Å²	13	20 Å²	20	7%	0.067	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-56.1	-33.9	170.1	-167.2	170.1	0	0	0	113.3	I523 V733 T760 E764 I767	I523-I762 HydrophobicContact CG2-CG1 4.42Å; V733-I762 HydrophobicContact CB-CG2 4.37Å; V733-I762 HydrophobicContact CG1-CG2 3.66Å; T760-I762 PolarHBondContact O-N 3.48Å; T760-I762 WeakPolarHBondContact OG1-CG2 3.4Å; I762-E764 VanDerWaalsContact C-N 3.27Å; I762-I767 WeakPolarHBondContact O-CD1 3.26Å
763	A	86.8	Confident	87.5	Confident	6 Å²	6	16.4 Å²	16.4	5%	0.05	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-83.2	-5.1	177.4	0	0	0	0	0	113.1	L701 F703 A759 T760 N761 T765 R811	L701-A763 HydrophobicContact CD1-CB 4.1Å; L701-A763 HydrophobicContact CD2-CB 4.42Å; F703-A763 HydrophobicContact CE1-CB 3.89Å; F703-A763 HydrophobicContact CZ-CB 4.23Å; A759-A763 HydrophobicContact CB-CB 3.53Å; T760-A763 PolarHBondContact O-N 3.39Å; T760-A763 VanDerWaalsContact O-N 3.13Å; N761-A763 PolarHBondContact O-N 2.82Å; A763-T765 VanDerWaalsContact C-N 3.28Å; A763-T765 PolarHBondContact O-N 3.24Å; A763-R811 WeakPolarHBondContact O-CD 3.41Å; A763-R811 PolarHBondContact O-NE 3.45Å
764	E	85.9	Confident	87.7	Confident	4 Å²	4	15 Å²	15	2%	0.019	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-76.6	-14.5	-175.5	-167	176.5	141.4	0	0	113	F703 N761 I762 N804 Q807 R808 R811	F703-E764 HydrophobicContact CE1-CB 4Å; F703-E764 HydrophobicContact CZ-CB 4.45Å; N761-E764 HydrophobicContact CB-CB 4.42Å; N761-E764 WeakPolarHBondContact O-CB 3.31Å; N761-E764 PolarHBondContact O-N 3.4Å; I762-E764 VanDerWaalsContact C-N 3.27Å; E764-N804 VanDerWaalsContact OE1-CA 3.28Å; E764-N804 WeakPolarHBondContact OE1-CA 3.43Å; E764-N804 WeakPolarHBondContact OE1-CB 3.24Å; E764-N804 VanDerWaalsContact OE1-CG 3.3Å; E764-N804 PolarHBondContact OE1-ND2 2.91Å; E764-Q807 HydrophobicContact CG-CB 3.99Å; E764-R808 HydrophobicContact CG-CG 3.87Å; E764-R808 IonicContact OE2-CZ 2.74Å; E764-R808 IonicContact OE2-NE 3.67Å; E764-R808 PolarHBondContact OE2-NE 3.43Å; E764-R808 IonicContact OE2-NH2 3.68Å; E764-R808 PolarHBondContact OE2-NH2 2.9Å; E764-R811 PolarHBondContact O-NE 2.93Å; E764-R811 VanDerWaalsContact O-NE 3.16Å; E764-R811 PolarHBondContact O-NH2 2.73Å
765	T	75.1	Confident	87.8	Confident	4 Å²	4	13.6 Å²	13.6	3%	0.025	8%	0.078	C	C	.	.	S	Bend	trans	-130.4	143.4	-166.4	58.4	0	0	0	0	109.8	R521 E592 A763 I767	R521-T765 WeakPolarHBondContact CD-OG1 3.15Å; R521-T765 PolarHBondContact NE-OG1 3.35Å; E592-T765 HydrophobicContact CG-CG2 3.73Å; E592-T765 WeakPolarHBondContact OE1-CB 3.2Å; E592-T765 WeakPolarHBondContact OE1-CG2 3.39Å; A763-T765 VanDerWaalsContact C-N 3.28Å; A763-T765 PolarHBondContact O-N 3.24Å; T765-I767 WeakPolarHBondContact O-CG1 3.16Å; T765-I767 PolarHBondContact O-N 3.1Å
766	S	70.6	Confident	88	Confident	13 Å²	13	13.6 Å²	13.6	9%	0.091	8%	0.077	C	C	.	.	S	Bend	trans	31.2	-1.7	175.4	-88.5	0	0	0	0	123.1	Q519 E589	Q519-S766 PolarHBondContact OE1-OG 3.14Å; E589-S766 VanDerWaalsContact CD-OG 3.3Å; E589-S766 WeakPolarHBondContact OE1-CA 3.29Å; E589-S766 WeakPolarHBondContact OE1-CB 3.48Å; E589-S766 PolarHBondContact OE1-N 3.43Å; E589-S766 PolarHBondContact OE1-OG 3.02Å
767	I	74.8	Confident	88.1	Confident	3 Å²	3	13.5 Å²	13.5	2%	0.015	8%	0.077	C	C	.	.			trans	-87.4	116.5	179.7	-64.8	-179.5	0	0	0	107.3	I523 I745 F746 I762 T765 V769 R811 R814	I523-I767 HydrophobicContact CD1-CD1 4.01Å; I523-I767 HydrophobicContact CG1-CD1 4.1Å; I523-I767 HydrophobicContact CG1-CG1 4.43Å; I523-I767 HydrophobicContact CG2-CD1 3.64Å; I523-I767 HydrophobicContact CG2-CG1 4.2Å; I745-I767 HydrophobicContact CD1-CD1 4.48Å; I745-I767 HydrophobicContact CD1-CG2 3.7Å; F746-I767 HydrophobicContact CE1-CB 4.41Å; F746-I767 HydrophobicContact CE1-CG2 3.46Å; F746-I767 VanDerWaalsContact CE1-CG2 3.46Å; F746-I767 HydrophobicContact CZ-CG1 4.49Å; F746-I767 HydrophobicContact CZ-CG2 3.71Å; I762-I767 WeakPolarHBondContact O-CD1 3.26Å; T765-I767 WeakPolarHBondContact O-CG1 3.16Å; T765-I767 PolarHBondContact O-N 3.1Å; I767-V769 HydrophobicContact CG2-CG2 3.98Å; I767-R811 PolarHBondContact O-NH1 3.39Å; I767-R814 PolarHBondContact O-NH1 2.8Å
768	T	71.8	Confident	88.1	Confident	62 Å²	62	13.5 Å²	13.5	38%	0.38	8%	0.077	S	C	.	.			trans	-98.9	105.1	175.8	52.6	0	0	0	0	110.7	F746	F746-T768 WeakPolarHBondContact CD1-O 3.26Å
769	V	81.6	Confident	88.1	Confident	14 Å²	14	13.5 Å²	13.5	9%	0.085	8%	0.077	C	C	.	.			trans	-102.7	106.6	169.5	-173	0	0	0	0	107.5	I745 I767 D771 I772	I745-V769 HydrophobicContact CD1-CG2 4.46Å; I745-V769 HydrophobicContact CG1-CG2 4.17Å; I745-V769 WeakPolarHBondContact O-CG1 3.37Å; I767-V769 HydrophobicContact CG2-CG2 3.98Å; V769-D771 VanDerWaalsContact C-N 3.27Å; V769-D771 WeakPolarHBondContact CG1-OD1 3.44Å; V769-D771 PolarHBondContact O-N 3.46Å; V769-I772 HydrophobicContact CB-CG1 3.74Å; V769-I772 HydrophobicContact CG1-CD1 3.96Å; V769-I772 HydrophobicContact CG1-CG1 3.57Å
770	N	82.5	Confident	88.2	Confident	75 Å²	75	13.6 Å²	13.6	40%	0.401	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-22.1	-167.6	-65.5	-20.1	0	0	0	113.5	C815	N770-C815 PolarHBondContact O-SG 3.4Å
771	D	90.1	Very high	88.2	Confident	20 Å²	20	13.4 Å²	13.4	11%	0.107	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-0.6	-173.9	56.2	-53.3	0	0	0	113.8	G699 P749 K755 V769 V773	G699-D771 WeakPolarHBondContact CA-O 3.13Å; G699-D771 PolarHBondContact N-O 3.38Å; P749-D771 VanDerWaalsContact CD-OD2 3.27Å; P749-D771 WeakPolarHBondContact CD-OD2 3.38Å; K755-D771 WeakPolarHBondContact CD-OD2 3.44Å; K755-D771 IonicContact NZ-OD1 3.08Å; K755-D771 PolarHBondContact NZ-OD1 3.24Å; K755-D771 VanDerWaalsContact NZ-OD1 3.11Å; K755-D771 IonicContact NZ-OD2 3.16Å; K755-D771 PolarHBondContact NZ-OD2 3.18Å; V769-D771 VanDerWaalsContact C-N 3.27Å; V769-D771 WeakPolarHBondContact CG1-OD1 3.44Å; V769-D771 PolarHBondContact O-N 3.46Å; D771-V773 PolarHBondContact O-N 3.2Å
772	I	92.8	Very high	88.2	Confident	9 Å²	9	13.6 Å²	13.6	5%	0.046	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	124.2	176.1	-60.4	-55.4	0	0	0	110.8	L701 V757 V769 V775	L701-I772 HydrophobicContact CB-CD1 3.94Å; L701-I772 HydrophobicContact CB-CG1 4.15Å; L701-I772 HydrophobicContact CB-CG2 3.8Å; V757-I772 HydrophobicContact CG2-CD1 4.26Å; V769-I772 HydrophobicContact CB-CG1 3.74Å; V769-I772 HydrophobicContact CG1-CD1 3.96Å; V769-I772 HydrophobicContact CG1-CG1 3.57Å; I772-V775 HydrophobicContact CG2-CG2 4.11Å
773	V	95.3	Very high	88.3	Confident	3 Å²	3	13.5 Å²	13.5	2%	0.018	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	-32	175	175.4	0	0	0	0	110.8	E696 G699 D771 Q816 G818 F819	E696-V773 HydrophobicContact CB-CG1 4.43Å; G699-V773 PolarHBondContact O-N 3.24Å; D771-V773 PolarHBondContact O-N 3.2Å; V773-Q816 HydrophobicContact CG2-CG 4.18Å; V773-Q816 VanDerWaalsContact CG2-NE2 3.25Å; V773-G818 CarbonylContact O-C 3.46Å; V773-G818 WeakPolarHBondContact O-CA 3.49Å; V773-F819 HydrophobicContact CG1-CD2 4.26Å; V773-F819 PolarHBondContact O-N 3.32Å
774	H	97.6	Very high	88.3	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	129.1	-177.4	-55.8	-77.4	0	0	0	110.6	I691 E696 G699 I700 L701 F819 Y821	I691-H774 HydrophobicContact CG2-CB 3.84Å; I691-H774 VanDerWaalsContact CG2-CG 3.41Å; E696-H774 PolarHBondContact O-NE2 2.68Å; G699-H774 PolarHBondContact O-N 2.74Å; G699-H774 VanDerWaalsContact O-N 3.11Å; I700-H774 CarbonylContact C-O 3.32Å; I700-H774 WeakPolarHBondContact CA-O 3.3Å; I700-H774 HydrophobicContact CB-CB 4.46Å; I700-H774 HydrophobicContact CG1-CB 4.13Å; I700-H774 HydrophobicContact CG2-CB 4.37Å; L701-H774 PolarHBondContact N-O 3.38Å; H774-F819 CarbonylContact C-O 3.47Å; H774-F819 WeakPolarHBondContact CA-O 3.2Å; H774-F819 AromaticContact CE1-CD2 3.46Å; H774-F819 VanDerWaalsContact CE1-CD2 3.46Å; H774-F819 WeakPolarHBondContact CE1-CD2 3.31Å; H774-F819 AromaticContact ND1-CD2 3.54Å; H774-F819 AromaticContact ND1-CG 3.9Å; H774-Y821 HydrophobicContact CB-CE2 4.34Å; H774-Y821 AromaticContact ND1-CE2 3.81Å
775	V	97	Very high	88.3	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	127.9	170.8	171.2	0	0	0	0	108.9	L701 F703 I772 R811 A812 F819 A820 Y821	L701-V775 HydrophobicContact CB-CG2 4.48Å; L701-V775 CarbonylContact O-C 3.38Å; L701-V775 VanDerWaalsContact O-CA 3.29Å; L701-V775 WeakPolarHBondContact O-CA 3.49Å; F703-V775 HydrophobicContact CD2-CG1 3.94Å; F703-V775 HydrophobicContact CE2-CG1 3.98Å; I772-V775 HydrophobicContact CG2-CG2 4.11Å; V775-R811 HydrophobicContact CG2-CB 3.9Å; V775-A812 HydrophobicContact CG2-CB 3.84Å; V775-F819 PolarHBondContact N-O 3.21Å; V775-A820 CarbonylContact O-C 3.59Å; V775-A820 WeakPolarHBondContact O-CA 3.41Å; V775-Y821 WeakPolarHBondContact O-CD2 3.43Å; V775-Y821 PolarHBondContact O-N 3.2Å
776	V	98.1	Very high	88.7	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	123.6	169.1	177.5	0	0	0	0	107.5	L687 V688 I691 I700 L701 C702 F703 Y821 L823	L687-V776 HydrophobicContact CD2-CG1 3.73Å; L687-V776 HydrophobicContact CD2-CG2 4.1Å; L687-V776 HydrophobicContact CG-CG2 4.34Å; V688-V776 HydrophobicContact CG2-CG2 4.41Å; I691-V776 HydrophobicContact CD1-CG2 3.56Å; I700-V776 HydrophobicContact CG2-CG2 4.18Å; L701-V776 PolarHBondContact O-N 3.4Å; C702-V776 CarbonylContact C-O 3.6Å; C702-V776 WeakPolarHBondContact CA-O 3.09Å; C702-V776 HydrophobicContact CB-CB 4.12Å; F703-V776 PolarHBondContact N-O 3.49Å; V776-Y821 CarbonylContact C-O 3.59Å; V776-Y821 WeakPolarHBondContact CA-O 3.31Å; V776-L823 HydrophobicContact CG1-CD1 4.1Å; V776-L823 HydrophobicContact CG1-CG 4.49Å
777	D	97.7	Very high	89.1	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	116.4	-178.3	-170.5	5.2	0	0	0	110.6	G779 R808 Y821 H822 L823	D777-G779 PolarHBondContact O-N 3.22Å; D777-G779 PolarHBondContact OD1-N 3.36Å; D777-R808 VanDerWaalsContact CG-CD 3.46Å; D777-R808 VanDerWaalsContact OD1-CD 3.29Å; D777-R808 WeakPolarHBondContact OD1-CD 3.3Å; D777-R808 IonicContact OD1-CZ 3.66Å; D777-R808 IonicContact OD1-NE 3.37Å; D777-R808 IonicContact OD1-NH1 3.58Å; D777-R808 PolarHBondContact OD1-NH1 2.97Å; D777-R808 VanDerWaalsContact OD2-CD 3.26Å; D777-R808 WeakPolarHBondContact OD2-CD 3.31Å; D777-Y821 PolarHBondContact N-O 3.46Å; D777-H822 IonicContact OD2-ND1 2.81Å; D777-L823 PolarHBondContact O-N 2.97Å
778	S	96.6	Very high	89.3	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.014	14%	0.137	C	C	.	.			trans	-66.8	-18.1	171.7	55.2	0	0	0	0	113.2	F703 L780	F703-S778 VanDerWaalsContact O-CB 3.31Å; F703-S778 WeakPolarHBondContact O-CB 3.25Å; F703-S778 PolarHBondContact O-N 3.37Å; F703-S778 PolarHBondContact O-OG 3.03Å; S778-L780 PolarHBondContact O-N 3.23Å; S778-L780 PolarHBondContact OG-N 3.29Å
779	G	95.7	Very high	89.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.159	C	C	.	.	S	Bend	trans	72.9	6.7	-172.3	0	0	0	0	0	113.9	D777 W799 V800 F824	D777-G779 PolarHBondContact O-N 3.22Å; D777-G779 PolarHBondContact OD1-N 3.36Å; G779-W799 WeakPolarHBondContact O-CA 3.46Å; G779-W799 VanDerWaalsContact O-CE3 3.24Å; G779-V800 PolarHBondContact O-N 3.01Å; G779-F824 VanDerWaalsContact CA-CD1 3.49Å
780	L	95.2	Very high	89.2	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	153.4	-173.3	-64	174.3	0	0	0	110.9	C677 L679 P705 S778 T797 V798 W799 R808	C677-L780 HydrophobicContact CB-CD2 3.8Å; L679-L780 HydrophobicContact CB-CD1 4.05Å; P705-L780 HydrophobicContact CB-CB 4.49Å; P705-L780 HydrophobicContact CG-CB 3.76Å; P705-L780 HydrophobicContact CG-CD1 4.35Å; S778-L780 PolarHBondContact O-N 3.23Å; S778-L780 PolarHBondContact OG-N 3.29Å; L780-T797 HydrophobicContact CB-CG2 4.09Å; L780-T797 HydrophobicContact CD1-CG2 4.22Å; L780-T797 HydrophobicContact CD2-CG2 4.34Å; L780-T797 HydrophobicContact CG-CG2 4.45Å; L780-V798 WeakPolarHBondContact CA-O 3.39Å; L780-W799 HydrophobicContact CD2-CD2 3.66Å; L780-W799 HydrophobicContact CD2-CE3 3.67Å; L780-W799 HydrophobicContact CD2-CG 4.16Å; L780-W799 HydrophobicContact CD2-CH2 4.23Å; L780-W799 HydrophobicContact CD2-CZ2 4.22Å; L780-W799 HydrophobicContact CD2-CZ3 3.96Å; L780-W799 HydrophobicContact CG-CE3 4.33Å; L780-W799 HydrophobicContact CG-CZ3 4.25Å; L780-R808 PolarHBondContact O-NH1 3.45Å; L780-R808 VanDerWaalsContact O-NH1 3.1Å; L780-R808 PolarHBondContact O-NH2 3.31Å
781	H	93.2	Very high	89	Confident	5 Å²	5	36.4 Å²	36.4	2%	0.023	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	166.3	163.4	66.5	-148.6	0	0	0	110.9	T797 V798 V800 Q836	H781-T797 CarbonylContact O-C 3.55Å; H781-T797 WeakPolarHBondContact O-CA 3.2Å; H781-V798 VanDerWaalsContact CD2-CG2 3.42Å; H781-V798 WeakPolarHBondContact CD2-CG2 3.3Å; H781-V798 PolarHBondContact N-O 2.95Å; H781-V798 WeakPolarHBondContact NE2-CG2 3.39Å; H781-V798 PolarHBondContact O-N 3.42Å; H781-V800 HydrophobicContact CB-CG1 4.01Å; H781-V800 WeakPolarHBondContact ND1-CG1 3.42Å; H781-Q836 PolarHBondContact CE1-NE2 3.45Å
782	K	88.7	Confident	88.4	Confident	50 Å²	50	36.2 Å²	36.2	22%	0.217	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	124.8	166.7	-71.4	-177.7	-174.4	179.6	0	110	P705 E709 L795 E796	P705-K782 HydrophobicContact CB-CG 4.3Å; P705-K782 WeakPolarHBondContact O-CG 3.12Å; P705-K782 PolarHBondContact O-N 2.78Å; E709-K782 IonicContact OE1-NZ 3.14Å; E709-K782 PolarHBondContact OE1-NZ 2.92Å; E709-K782 VanDerWaalsContact OE1-NZ 3.08Å; E709-K782 IonicContact OE2-NZ 3.16Å; E709-K782 PolarHBondContact OE2-NZ 3.46Å; K782-L795 HydrophobicContact CB-CD1 3.86Å; K782-L795 HydrophobicContact CB-CD2 4.22Å; K782-L795 HydrophobicContact CB-CG 3.92Å; K782-L795 HydrophobicContact CD-CD2 4.12Å; K782-L795 HydrophobicContact CD-CG 4.44Å; K782-L795 HydrophobicContact CG-CG 4.5Å; K782-E796 CarbonylContact C-O 3.53Å; K782-E796 WeakPolarHBondContact CA-O 3.28Å
783	E	88	Confident	87.8	Confident	12 Å²	12	37 Å²	37	6%	0.056	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	132.7	179.6	-174.2	173.6	-123	0	0	110.3	R785 E796 V798 Q836 R842	E783-R785 IonicContact OE2-CZ 3.86Å; E783-R785 IonicContact OE2-NE 3.9Å; E783-R785 PolarHBondContact OE2-NE 3.32Å; E783-R785 IonicContact OE2-NH2 2.73Å; E783-R785 PolarHBondContact OE2-NH2 2.93Å; E783-E796 PolarHBondContact N-O 3.11Å; E783-E796 PolarHBondContact O-N 3.48Å; E783-V798 HydrophobicContact CB-CG2 3.66Å; E783-Q836 PolarHBondContact OE1-NE2 2.99Å; E783-R842 WeakPolarHBondContact OE1-CD 3.4Å; E783-R842 IonicContact OE1-CZ 2.77Å; E783-R842 IonicContact OE1-NE 2.95Å; E783-R842 PolarHBondContact OE1-NE 3.01Å; E783-R842 VanDerWaalsContact OE1-NE 3.14Å
784	E	85.3	Confident	86.9	Confident	82 Å²	82	37.5 Å²	37.5	38%	0.383	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	129.5	172.7	-172.2	177.8	-177.4	0	0	110.3	S793 C794 L795 R842	E784-S793 WeakPolarHBondContact OE1-CB 3.36Å; E784-S793 PolarHBondContact OE1-OG 2.86Å; E784-C794 CarbonylContact C-O 3.5Å; E784-C794 WeakPolarHBondContact CA-O 3.28Å; E784-L795 HydrophobicContact CB-CD1 4.42Å; E784-R842 PolarHBondContact O-NH1 2.69Å
785	R	85.6	Confident	86.1	Confident	100 Å²	100	42.6 Å²	42.6	38%	0.377	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	143.6	176.6	-68	176.7	174.7	-176.3	-7.8	110.3	E783 S793 C794 E796 R842	E783-R785 IonicContact OE2-CZ 3.86Å; E783-R785 IonicContact OE2-NE 3.9Å; E783-R785 PolarHBondContact OE2-NE 3.32Å; E783-R785 IonicContact OE2-NH2 2.73Å; E783-R785 PolarHBondContact OE2-NH2 2.93Å; R785-S793 CarbonylContact O-C 3.43Å; R785-S793 VanDerWaalsContact O-CA 3.29Å; R785-S793 WeakPolarHBondContact O-CA 3.35Å; R785-C794 PolarHBondContact N-O 3.18Å; R785-C794 PolarHBondContact O-N 3.1Å; R785-C794 PolarHBondContact O-SG 3.03Å; R785-E796 WeakPolarHBondContact CD-OE2 3.39Å; R785-E796 IonicContact CZ-OE2 3.91Å; R785-E796 IonicContact NE-OE2 3.81Å; R785-E796 IonicContact NH1-OE2 3.73Å; R785-E796 PolarHBondContact NH1-OE2 3.25Å; R785-R842 CarbonylContact C-O 3.57Å; R785-R842 WeakPolarHBondContact CA-O 3.27Å
786	Y	84.1	Confident	85.4	Confident	50 Å²	50	46.5 Å²	46.5	20%	0.196	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	124.4	-179.5	-174.8	-107	0	0	0	111.2	L788 K791 R842 P844	Y786-L788 HydrophobicContact CD1-CD2 4.17Å; Y786-L788 HydrophobicContact CD1-CG 4.39Å; Y786-L788 HydrophobicContact CE1-CD2 3.92Å; Y786-L788 HydrophobicContact CE1-CG 4.47Å; Y786-K791 WeakPolarHBondContact OH-CA 3.27Å; Y786-R842 WeakPolarHBondContact CB-O 3.5Å; Y786-R842 PolarHBondContact N-O 2.96Å; Y786-P844 HydrophobicContact CD2-CB 3.73Å; Y786-P844 HydrophobicContact CD2-CG 4.14Å; Y786-P844 HydrophobicContact CE2-CB 3.77Å; Y786-P844 HydrophobicContact CE2-CG 4.49Å; Y786-P844 HydrophobicContact CG-CB 4.14Å
787	D	80	Confident	85	Confident	38 Å²	38	48.6 Å²	48.6	20%	0.203	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	107.9	174.5	-175.8	-6.3	0	0	0	110.3	K789 T790 K791 V792 K1110	D787-K789 PolarHBondContact O-N 2.97Å; D787-K789 WeakPolarHBondContact OD1-CB 3.5Å; D787-K789 PolarHBondContact OD1-N 2.92Å; D787-T790 WeakPolarHBondContact CB-OG1 3.15Å; D787-T790 VanDerWaalsContact CG-OG1 3.28Å; D787-T790 PolarHBondContact O-N 2.78Å; D787-T790 PolarHBondContact OD2-OG1 3.3Å; D787-T790 VanDerWaalsContact OD2-OG1 3.08Å; D787-K791 WeakPolarHBondContact O-CA 3.48Å; D787-K791 PolarHBondContact O-N 2.92Å; D787-V792 PolarHBondContact N-O 3.28Å; D787-K1110 IonicContact OD2-NZ 2.88Å; D787-K1110 PolarHBondContact OD2-NZ 2.94Å
788	L	78.3	Confident	84.7	Confident	67 Å²	67	49.4 Å²	49.4	35%	0.351	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-26.1	177.1	-72.3	164.6	0	0	0	113.5	Y786 A876	Y786-L788 HydrophobicContact CD1-CD2 4.17Å; Y786-L788 HydrophobicContact CD1-CG 4.39Å; Y786-L788 HydrophobicContact CE1-CD2 3.92Å; Y786-L788 HydrophobicContact CE1-CG 4.47Å; L788-A876 HydrophobicContact CD1-CB 4.38Å; L788-A876 HydrophobicContact CD2-CB 3.8Å
789	K	77.8	Confident	84.6	Confident	194 Å²	194	52 Å²	52	84%	0.843	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-46.9	-179.6	-64.8	-178.8	179.5	178.5	0	111.6	D787	D787-K789 PolarHBondContact O-N 2.97Å; D787-K789 WeakPolarHBondContact OD1-CB 3.5Å; D787-K789 PolarHBondContact OD1-N 2.92Å
790	T	74.3	Confident	84.5	Confident	37 Å²	37	52 Å²	52	23%	0.227	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-6.7	-177.8	53.3	0	0	0	0	113.3	D787 V792 K1110 V1115	D787-T790 WeakPolarHBondContact CB-OG1 3.15Å; D787-T790 VanDerWaalsContact CG-OG1 3.28Å; D787-T790 PolarHBondContact O-N 2.78Å; D787-T790 PolarHBondContact OD2-OG1 3.3Å; D787-T790 VanDerWaalsContact OD2-OG1 3.08Å; T790-V792 VanDerWaalsContact C-N 3.27Å; T790-V792 PolarHBondContact O-N 3.38Å; T790-V792 WeakPolarHBondContact OG1-CG2 3.46Å; T790-K1110 HydrophobicContact CG2-CD 4.31Å; T790-V1115 HydrophobicContact CG2-CG2 4.34Å
791	K	76.8	Confident	84.5	Confident	94 Å²	94	52.1 Å²	52.1	41%	0.409	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	37.4	-177.9	-57.1	-170.8	174.6	-159.8	0	113.6	Y786 D787 E879	Y786-K791 WeakPolarHBondContact OH-CA 3.27Å; D787-K791 WeakPolarHBondContact O-CA 3.48Å; D787-K791 PolarHBondContact O-N 2.92Å; K791-E879 WeakPolarHBondContact CE-OE2 3.21Å; K791-E879 IonicContact NZ-OE2 2.71Å; K791-E879 PolarHBondContact NZ-OE2 3.23Å
792	V	78	Confident	84.6	Confident	16 Å²	16	56.6 Å²	56.6	10%	0.097	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	148.2	-179.4	-68.4	0	0	0	0	111.5	D787 T790 A1108 K1110 V1115	D787-V792 PolarHBondContact N-O 3.28Å; T790-V792 VanDerWaalsContact C-N 3.27Å; T790-V792 PolarHBondContact O-N 3.38Å; T790-V792 WeakPolarHBondContact OG1-CG2 3.46Å; V792-A1108 HydrophobicContact CG1-CB 3.76Å; V792-K1110 HydrophobicContact CG2-CB 3.78Å; V792-V1115 HydrophobicContact CG1-CG1 4.06Å; V792-V1115 HydrophobicContact CG2-CG1 4.49Å; V792-V1115 HydrophobicContact CG2-CG2 4.14Å
793	S	79.5	Confident	84.7	Confident	25 Å²	25	54.6 Å²	54.6	18%	0.175	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	140.9	171.4	-62.7	0	0	0	0	111	E784 R785 V1109	E784-S793 WeakPolarHBondContact OE1-CB 3.36Å; E784-S793 PolarHBondContact OE1-OG 2.86Å; R785-S793 CarbonylContact O-C 3.43Å; R785-S793 VanDerWaalsContact O-CA 3.29Å; R785-S793 WeakPolarHBondContact O-CA 3.35Å; S793-V1109 WeakPolarHBondContact O-CA 3.21Å
794	C	78.2	Confident	84.9	Confident	13 Å²	13	54.7 Å²	54.7	9%	0.088	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	145.3	163.8	60.1	0	0	0	0	109.9	E784 R785 E796 K1110	E784-C794 CarbonylContact C-O 3.5Å; E784-C794 WeakPolarHBondContact CA-O 3.28Å; R785-C794 PolarHBondContact N-O 3.18Å; R785-C794 PolarHBondContact O-N 3.1Å; R785-C794 PolarHBondContact O-SG 3.03Å; C794-E796 HydrophobicContact CB-CG 4.32Å; C794-E796 PolarHBondContact SG-OE1 3.15Å; C794-K1110 WeakPolarHBondContact CB-O 3.5Å
795	L	79.5	Confident	85.4	Confident	108 Å²	108	51 Å²	51	57%	0.565	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	100.8	172.3	-175.7	69.8	0	0	0	107.2	K782 E784	K782-L795 HydrophobicContact CB-CD1 3.86Å; K782-L795 HydrophobicContact CB-CD2 4.22Å; K782-L795 HydrophobicContact CB-CG 3.92Å; K782-L795 HydrophobicContact CD-CD2 4.12Å; K782-L795 HydrophobicContact CD-CG 4.44Å; K782-L795 HydrophobicContact CG-CG 4.5Å; E784-L795 HydrophobicContact CB-CD1 4.42Å
796	E	83.2	Confident	85.6	Confident	81 Å²	81	49.8 Å²	49.8	38%	0.379	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	142.5	-174.2	-71	176.8	-179	0	0	110.6	K782 E783 R785 C794 V798	K782-E796 CarbonylContact C-O 3.53Å; K782-E796 WeakPolarHBondContact CA-O 3.28Å; E783-E796 PolarHBondContact N-O 3.11Å; E783-E796 PolarHBondContact O-N 3.48Å; R785-E796 WeakPolarHBondContact CD-OE2 3.39Å; R785-E796 IonicContact CZ-OE2 3.91Å; R785-E796 IonicContact NE-OE2 3.81Å; R785-E796 IonicContact NH1-OE2 3.73Å; R785-E796 PolarHBondContact NH1-OE2 3.25Å; C794-E796 HydrophobicContact CB-CG 4.32Å; C794-E796 PolarHBondContact SG-OE1 3.15Å; E796-V798 HydrophobicContact CB-CG1 4.2Å
797	T	88.7	Confident	85.8	Confident	45 Å²	45	47.7 Å²	47.7	28%	0.276	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	121.5	168	-58.3	0	0	0	0	108.4	C677 P705 L780 H781	C677-T797 HydrophobicContact CB-CG2 4.03Å; C677-T797 WeakPolarHBondContact CB-O 3.48Å; P705-T797 HydrophobicContact CB-CG2 4.04Å; P705-T797 HydrophobicContact CG-CG2 4.26Å; L780-T797 HydrophobicContact CB-CG2 4.09Å; L780-T797 HydrophobicContact CD1-CG2 4.22Å; L780-T797 HydrophobicContact CD2-CG2 4.34Å; L780-T797 HydrophobicContact CG-CG2 4.45Å; H781-T797 CarbonylContact O-C 3.55Å; H781-T797 WeakPolarHBondContact O-CA 3.2Å
798	V	91.4	Very high	86.5	Confident	16 Å²	16	45.9 Å²	45.9	10%	0.097	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	158	-177.7	-59.8	0	0	0	0	111.1	L780 H781 E783 E796	L780-V798 WeakPolarHBondContact CA-O 3.39Å; H781-V798 VanDerWaalsContact CD2-CG2 3.42Å; H781-V798 WeakPolarHBondContact CD2-CG2 3.3Å; H781-V798 PolarHBondContact N-O 2.95Å; H781-V798 WeakPolarHBondContact NE2-CG2 3.39Å; H781-V798 PolarHBondContact O-N 3.42Å; E783-V798 HydrophobicContact CB-CG2 3.66Å; E796-V798 HydrophobicContact CB-CG1 4.2Å
799	W	94.6	Very high	87.1	Confident	57 Å²	57	45.6 Å²	45.6	22%	0.216	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	136.8	168.5	-67.7	100.2	0	0	0	110.9	C677 G779 L780 F824 R828 M832	C677-W799 PolarHBondContact SG-NE1 3.3Å; C677-W799 VanDerWaalsContact SG-NE1 3.37Å; G779-W799 WeakPolarHBondContact O-CA 3.46Å; G779-W799 VanDerWaalsContact O-CE3 3.24Å; L780-W799 HydrophobicContact CD2-CD2 3.66Å; L780-W799 HydrophobicContact CD2-CE3 3.67Å; L780-W799 HydrophobicContact CD2-CG 4.16Å; L780-W799 HydrophobicContact CD2-CH2 4.23Å; L780-W799 HydrophobicContact CD2-CZ2 4.22Å; L780-W799 HydrophobicContact CD2-CZ3 3.96Å; L780-W799 HydrophobicContact CG-CE3 4.33Å; L780-W799 HydrophobicContact CG-CZ3 4.25Å; W799-F824 HydrophobicContact CH2-CB 3.98Å; W799-F824 HydrophobicContact CZ3-CB 3.69Å; W799-F824 HydrophobicContact CZ3-CD1 4.13Å; W799-F824 HydrophobicContact CZ3-CG 4.1Å; W799-R828 HydrophobicContact CD2-CG 4.21Å; W799-R828 VanDerWaalsContact CE2-CZ 3.49Å; W799-R828 HydrophobicContact CE3-CG 4.01Å; W799-R828 HydrophobicContact CH2-CG 4.25Å; W799-R828 HydrophobicContact CZ2-CG 4.44Å; W799-R828 HydrophobicContact CZ3-CG 4.04Å; W799-M832 HydrophobicContact CD2-CE 4.25Å; W799-M832 HydrophobicContact CE3-CE 3.43Å; W799-M832 VanDerWaalsContact CE3-CE 3.43Å; W799-M832 HydrophobicContact CZ3-CE 4.05Å
800	V	95.1	Very high	87.6	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.006	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-73.9	162.5	175.9	-53.4	0	0	0	0	111.5	G779 H781 N804 V805	G779-V800 PolarHBondContact O-N 3.01Å; H781-V800 HydrophobicContact CB-CG1 4.01Å; H781-V800 WeakPolarHBondContact ND1-CG1 3.42Å; V800-N804 HydrophobicContact CB-CB 3.74Å; V800-N804 HydrophobicContact CG2-CB 3.97Å; V800-V805 HydrophobicContact CG2-CG2 3.65Å
801	S	94.4	Very high	88.3	Confident	3 Å²	3	35.1 Å²	35.1	2%	0.021	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-75.8	161.1	173.5	74.6	0	0	0	0	111.8	A803 N804 V805 V833 F835 Q836	S801-A803 PolarHBondContact O-N 3.46Å; S801-N804 WeakPolarHBondContact CB-OD1 3.42Å; S801-N804 PolarHBondContact N-OD1 3.48Å; S801-N804 WeakPolarHBondContact O-CB 3.45Å; S801-N804 PolarHBondContact O-N 3.44Å; S801-N804 VanDerWaalsContact OG-CG 3.27Å; S801-N804 PolarHBondContact OG-N 3.03Å; S801-N804 PolarHBondContact OG-OD1 2.92Å; S801-V805 PolarHBondContact O-N 2.92Å; S801-V805 VanDerWaalsContact O-N 3.12Å; S801-V833 CarbonylContact C-O 3.23Å; S801-V833 VanDerWaalsContact CA-O 3.29Å; S801-V833 WeakPolarHBondContact CA-O 3.11Å; S801-V833 WeakPolarHBondContact CB-O 3.14Å; S801-F835 VanDerWaalsContact CB-C 3.41Å; S801-Q836 PolarHBondContact OG-N 2.98Å
802	R	94.7	Very high	88.8	Confident	100 Å²	100	30.7 Å²	30.7	38%	0.377	15%	0.15	S	C	.	.	H	α-helix	trans	-57.1	-36.6	173.4	-62.8	-174.9	-176	169	4.2	112.1	N804 V805 I806 L829 E830 M832 V833	R802-N804 VanDerWaalsContact C-N 3.31Å; R802-N804 PolarHBondContact O-N 3.35Å; R802-V805 PolarHBondContact O-N 2.95Å; R802-I806 WeakPolarHBondContact O-CG1 3.38Å; R802-I806 PolarHBondContact O-N 3.34Å; R802-L829 HydrophobicContact CG-CD1 4.02Å; R802-L829 PolarHBondContact NE-O 2.95Å; R802-E830 VanDerWaalsContact NH2-C 3.32Å; R802-E830 PolarHBondContact NH2-O 3.26Å; R802-M832 HydrophobicContact CG-CB 3.94Å; R802-M832 PolarHBondContact NE-O 3.42Å; R802-V833 PolarHBondContact N-O 3.12Å
803	A	91.1	Very high	89.2	Confident	8 Å²	8	29.9 Å²	29.9	7%	0.066	15%	0.145	C	C	.	.	H	α-helix	trans	-60.8	-39.9	174.6	0	0	0	0	0	112.1	S801 I806 Q807 P834 F835	S801-A803 PolarHBondContact O-N 3.46Å; A803-I806 PolarHBondContact O-N 2.97Å; A803-Q807 WeakPolarHBondContact O-CG 3.26Å; A803-Q807 PolarHBondContact O-N 2.9Å; A803-P834 WeakPolarHBondContact CB-O 3.45Å; A803-P834 PolarHBondContact N-O 3.21Å; A803-P834 VanDerWaalsContact N-O 3.09Å; A803-F835 HydrophobicContact CB-CD1 3.83Å; A803-F835 HydrophobicContact CB-CE1 4.28Å
804	N	93.1	Very high	89	Confident	13 Å²	13	30.9 Å²	30.9	7%	0.07	15%	0.145	C	C	.	.	H	α-helix	trans	-64.5	-44.3	175.5	-58.7	119.8	0	0	0	111.1	E764 V800 S801 R802 I806 Q807 R808	E764-N804 VanDerWaalsContact OE1-CA 3.28Å; E764-N804 WeakPolarHBondContact OE1-CA 3.43Å; E764-N804 WeakPolarHBondContact OE1-CB 3.24Å; E764-N804 VanDerWaalsContact OE1-CG 3.3Å; E764-N804 PolarHBondContact OE1-ND2 2.91Å; V800-N804 HydrophobicContact CB-CB 3.74Å; V800-N804 HydrophobicContact CG2-CB 3.97Å; S801-N804 WeakPolarHBondContact CB-OD1 3.42Å; S801-N804 PolarHBondContact N-OD1 3.48Å; S801-N804 WeakPolarHBondContact O-CB 3.45Å; S801-N804 PolarHBondContact O-N 3.44Å; S801-N804 VanDerWaalsContact OG-CG 3.27Å; S801-N804 PolarHBondContact OG-N 3.03Å; S801-N804 PolarHBondContact OG-OD1 2.92Å; R802-N804 VanDerWaalsContact C-N 3.31Å; R802-N804 PolarHBondContact O-N 3.35Å; N804-I806 VanDerWaalsContact C-N 3.31Å; N804-I806 PolarHBondContact O-N 3.08Å; N804-Q807 WeakPolarHBondContact O-CB 3.39Å; N804-Q807 PolarHBondContact O-N 3.14Å; N804-Q807 VanDerWaalsContact O-N 3.09Å; N804-R808 WeakPolarHBondContact O-CG 3.21Å; N804-R808 PolarHBondContact O-N 2.77Å
805	V	94.6	Very high	88.8	Confident	4 Å²	4	33.4 Å²	33.4	2%	0.024	16%	0.162	C	C	.	.	H	α-helix	trans	-57.4	-44.5	176.4	-179.9	0	0	0	0	111.1	V800 S801 R802 Q807 R808 R809 F824 L829 M832	V800-V805 HydrophobicContact CG2-CG2 3.65Å; S801-V805 PolarHBondContact O-N 2.92Å; S801-V805 VanDerWaalsContact O-N 3.12Å; R802-V805 PolarHBondContact O-N 2.95Å; V805-Q807 VanDerWaalsContact C-N 3.32Å; V805-Q807 PolarHBondContact O-N 3.41Å; V805-R808 PolarHBondContact O-N 2.77Å; V805-R809 VanDerWaalsContact O-CB 3.28Å; V805-R809 WeakPolarHBondContact O-CB 3.47Å; V805-R809 PolarHBondContact O-N 3.3Å; V805-F824 HydrophobicContact CG1-CZ 4.07Å; V805-F824 HydrophobicContact CG2-CZ 3.91Å; V805-L829 HydrophobicContact CB-CD1 4.27Å; V805-L829 HydrophobicContact CG1-CD1 4.24Å; V805-L829 HydrophobicContact CG2-CD1 4.05Å; V805-M832 HydrophobicContact CG2-SD 3.97Å
806	I	90.7	Very high	89.1	Confident	75 Å²	75	32.8 Å²	32.8	39%	0.385	16%	0.156	S	C	.	.	H	α-helix	trans	-60.7	-41.7	176.7	-68.8	165.7	0	0	0	111.1	T622 R802 A803 N804 G810	T622-I806 HydrophobicContact CG2-CG2 4.32Å; R802-I806 WeakPolarHBondContact O-CG1 3.38Å; R802-I806 PolarHBondContact O-N 3.34Å; A803-I806 PolarHBondContact O-N 2.97Å; N804-I806 VanDerWaalsContact C-N 3.31Å; N804-I806 PolarHBondContact O-N 3.08Å; I806-G810 PolarHBondContact O-N 3.37Å
807	Q	88.9	Confident	89.5	Confident	6 Å²	6	31.8 Å²	31.8	3%	0.028	16%	0.159	C	C	.	.	H	α-helix	trans	-68.1	-42.3	178	-71.9	-174.2	10.9	0	0	113.1	H591 T622 E764 A803 N804 V805 G810 R811	H591-Q807 PolarHBondContact CD2-NE2 2.72Å; H591-Q807 PolarHBondContact NE2-NE2 2.68Å; T622-Q807 HydrophobicContact CG2-CG 3.8Å; T622-Q807 PolarHBondContact OG1-NE2 3.43Å; E764-Q807 HydrophobicContact CG-CB 3.99Å; A803-Q807 WeakPolarHBondContact O-CG 3.26Å; A803-Q807 PolarHBondContact O-N 2.9Å; N804-Q807 WeakPolarHBondContact O-CB 3.39Å; N804-Q807 PolarHBondContact O-N 3.14Å; N804-Q807 VanDerWaalsContact O-N 3.09Å; V805-Q807 VanDerWaalsContact C-N 3.32Å; V805-Q807 PolarHBondContact O-N 3.41Å; Q807-G810 PolarHBondContact O-N 2.96Å; Q807-R811 WeakPolarHBondContact O-CG 3.43Å; Q807-R811 PolarHBondContact O-N 2.86Å
808	R	93.4	Very high	89.8	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.2	-48.1	175.7	-70	-179.8	179.2	-166	-1.6	110.4	F703 E764 D777 L780 N804 V805 G810 R811	F703-R808 HydrophobicContact CD1-CG 4.13Å; F703-R808 HydrophobicContact CD2-CB 3.79Å; F703-R808 HydrophobicContact CD2-CG 3.7Å; F703-R808 HydrophobicContact CE1-CG 4.08Å; F703-R808 HydrophobicContact CE2-CB 3.63Å; F703-R808 HydrophobicContact CE2-CG 3.65Å; F703-R808 HydrophobicContact CG-CB 4.5Å; F703-R808 HydrophobicContact CG-CG 3.94Å; F703-R808 HydrophobicContact CZ-CB 4.23Å; F703-R808 HydrophobicContact CZ-CG 3.85Å; E764-R808 HydrophobicContact CG-CG 3.87Å; E764-R808 IonicContact OE2-CZ 2.74Å; E764-R808 IonicContact OE2-NE 3.67Å; E764-R808 PolarHBondContact OE2-NE 3.43Å; E764-R808 IonicContact OE2-NH2 3.68Å; E764-R808 PolarHBondContact OE2-NH2 2.9Å; D777-R808 VanDerWaalsContact CG-CD 3.46Å; D777-R808 VanDerWaalsContact OD1-CD 3.29Å; D777-R808 WeakPolarHBondContact OD1-CD 3.3Å; D777-R808 IonicContact OD1-CZ 3.66Å; D777-R808 IonicContact OD1-NE 3.37Å; D777-R808 IonicContact OD1-NH1 3.58Å; D777-R808 PolarHBondContact OD1-NH1 2.97Å; D777-R808 VanDerWaalsContact OD2-CD 3.26Å; D777-R808 WeakPolarHBondContact OD2-CD 3.31Å; L780-R808 PolarHBondContact O-NH1 3.45Å; L780-R808 VanDerWaalsContact O-NH1 3.1Å; L780-R808 PolarHBondContact O-NH2 3.31Å; N804-R808 WeakPolarHBondContact O-CG 3.21Å; N804-R808 PolarHBondContact O-N 2.77Å; V805-R808 PolarHBondContact O-N 2.77Å; R808-G810 VanDerWaalsContact C-N 3.3Å; R808-G810 PolarHBondContact O-N 2.83Å; R808-R811 VanDerWaalsContact O-CB 3.25Å; R808-R811 WeakPolarHBondContact O-CB 3.48Å; R808-R811 VanDerWaalsContact O-CG 3.32Å; R808-R811 WeakPolarHBondContact O-CG 3.43Å; R808-R811 PolarHBondContact O-N 3.36Å
809	R	92	Very high	90	Very high	62 Å²	62	31.1 Å²	31.1	23%	0.234	15%	0.151	C	C	.	.	H	α-helix	trans	-54.7	-44.3	172.4	-177.4	-166.3	68.9	175.7	1	111.9	V647 E649 V805 R811 A812 A820	V647-R809 HydrophobicContact CB-CG 4.26Å; V647-R809 HydrophobicContact CG1-CG 3.85Å; E649-R809 HydrophobicContact CG-CG 4.46Å; E649-R809 WeakPolarHBondContact OE1-CD 3.5Å; E649-R809 IonicContact OE1-CZ 2.97Å; E649-R809 IonicContact OE1-NE 3.61Å; E649-R809 IonicContact OE1-NH1 3.33Å; E649-R809 PolarHBondContact OE1-NH1 2.85Å; V805-R809 VanDerWaalsContact O-CB 3.28Å; V805-R809 WeakPolarHBondContact O-CB 3.47Å; V805-R809 PolarHBondContact O-N 3.3Å; R809-R811 PolarHBondContact O-N 2.9Å; R809-A812 PolarHBondContact O-N 2.95Å; R809-A820 HydrophobicContact CB-CB 4.33Å; R809-A820 HydrophobicContact CG-CB 3.84Å
810	G	87.2	Confident	90.1	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.01	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	2.7	178	0	0	0	0	0	115.4	T488 I806 Q807 R808 A812 R814	T488-G810 PolarHBondContact OG1-O 3Å; I806-G810 PolarHBondContact O-N 3.37Å; Q807-G810 PolarHBondContact O-N 2.96Å; R808-G810 VanDerWaalsContact C-N 3.3Å; R808-G810 PolarHBondContact O-N 2.83Å; G810-A812 CarbonylContact C-O 3.57Å; G810-R814 PolarHBondContact O-NE 2.97Å
811	R	88.8	Confident	90.3	Very high	10 Å²	10	28.9 Å²	28.9	4%	0.038	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-21.4	167.2	-54.9	-70.4	152.5	-176.2	-11.9	112	L701 F703 A763 E764 I767 V775 Q807 R808 R809	L701-R811 HydrophobicContact CD2-CB 3.75Å; L701-R811 HydrophobicContact CD2-CG 4.03Å; F703-R811 HydrophobicContact CE2-CG 4.17Å; F703-R811 HydrophobicContact CZ-CG 3.96Å; A763-R811 WeakPolarHBondContact O-CD 3.41Å; A763-R811 PolarHBondContact O-NE 3.45Å; E764-R811 PolarHBondContact O-NE 2.93Å; E764-R811 VanDerWaalsContact O-NE 3.16Å; E764-R811 PolarHBondContact O-NH2 2.73Å; I767-R811 PolarHBondContact O-NH1 3.39Å; V775-R811 HydrophobicContact CG2-CB 3.9Å; Q807-R811 WeakPolarHBondContact O-CG 3.43Å; Q807-R811 PolarHBondContact O-N 2.86Å; R808-R811 VanDerWaalsContact O-CB 3.25Å; R808-R811 WeakPolarHBondContact O-CB 3.48Å; R808-R811 VanDerWaalsContact O-CG 3.32Å; R808-R811 WeakPolarHBondContact O-CG 3.43Å; R808-R811 PolarHBondContact O-N 3.36Å; R809-R811 PolarHBondContact O-N 2.9Å
812	A	88.6	Confident	90.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.142	C	C	.	.	S	Bend	trans	-91.1	166.3	160	0	0	0	0	0	110.1	V647 V775 R809 G810	V647-A812 HydrophobicContact CG1-CB 4.09Å; V647-A812 HydrophobicContact CG2-CB 4.07Å; V775-A812 HydrophobicContact CG2-CB 3.84Å; R809-A812 PolarHBondContact O-N 2.95Å; G810-A812 CarbonylContact C-O 3.57Å
813	G	84.6	Confident	90.5	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	82.2	9.8	174.4	0	0	0	0	0	115.5	Y645 Q816	Y645-G813 WeakPolarHBondContact CB-O 3.47Å; Y645-G813 PolarHBondContact N-O 3.12Å; G813-Q816 CarbonylContact C-O 3.58Å; G813-Q816 WeakPolarHBondContact CA-O 3.35Å
814	R	76.2	Confident	90.6	Very high	46 Å²	46	24.4 Å²	24.4	17%	0.174	13%	0.125	C	C	.	.	S	Bend	trans	-82.9	-56.3	-174.2	-68	-178.1	173	-170.6	-8.5	113.6	I767 G810	I767-R814 PolarHBondContact O-NH1 2.8Å; G810-R814 PolarHBondContact O-NE 2.97Å
815	C	74.9	Confident	90.7	Very high	66 Å²	66	25.8 Å²	25.8	45%	0.446	13%	0.134	S	C	.	.	S	Bend	trans	-96.4	-21.2	-179.8	-56.7	0	0	0	0	112.4	Y645 N770	Y645-C815 VanDerWaalsContact CE2-O 3.31Å; Y645-C815 WeakPolarHBondContact CE2-O 3.1Å; N770-C815 PolarHBondContact O-SG 3.4Å
816	Q	85.5	Confident	90.7	Very high	94 Å²	94	30.1 Å²	30.1	44%	0.439	15%	0.15	S	C	.	.	S	Bend	trans	-163.9	166.5	-174	58.4	-172.1	-30.4	0	0	109.2	Y645 V773 G813	Y645-Q816 WeakPolarHBondContact CB-O 3.02Å; Y645-Q816 VanDerWaalsContact CG-C 3.47Å; V773-Q816 HydrophobicContact CG2-CG 4.18Å; V773-Q816 VanDerWaalsContact CG2-NE2 3.25Å; G813-Q816 CarbonylContact C-O 3.58Å; G813-Q816 WeakPolarHBondContact CA-O 3.35Å
817	S	91.2	Very high	90.8	Very high	61 Å²	61	29.8 Å²	29.8	43%	0.427	15%	0.154	S	C	.	.			trans	-54.8	148.5	174.1	-55.6	0	0	0	0	111	Y645 P646	Y645-S817 VanDerWaalsContact CB-N 3.31Å; P646-S817 WeakPolarHBondContact CG-OG 3.35Å; P646-S817 WeakPolarHBondContact O-CA 3.45Å; P646-S817 WeakPolarHBondContact O-CB 3.47Å
818	G	93.9	Very high	91	Very high	2 Å²	2	31.5 Å²	31.5	2%	0.021	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	-172.9	-175.9	0	0	0	0	0	113.6	P646 V647 K648 V773	P646-G818 PolarHBondContact O-N 2.68Å; P646-G818 VanDerWaalsContact O-N 3.1Å; V647-G818 CarbonylContact C-O 3.54Å; V647-G818 VanDerWaalsContact CA-O 3.29Å; V647-G818 WeakPolarHBondContact CA-O 3.45Å; K648-G818 PolarHBondContact N-O 2.85Å; V773-G818 CarbonylContact O-C 3.46Å; V773-G818 WeakPolarHBondContact O-CA 3.49Å
819	F	97	Very high	91.1	Very high	45 Å²	45	33.1 Å²	33.1	20%	0.197	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	138.7	-176.4	-56.5	-96.6	0	0	0	109.7	K648 E696 V773 H774 V775 Y821	K648-F819 HydrophobicContact CB-CD1 3.85Å; K648-F819 HydrophobicContact CB-CE1 4.18Å; K648-F819 HydrophobicContact CD-CD1 4.29Å; K648-F819 HydrophobicContact CD-CE1 4.11Å; K648-F819 WeakPolarHBondContact O-CA 3.3Å; E696-F819 HydrophobicContact CB-CE2 4.06Å; E696-F819 HydrophobicContact CG-CE2 3.57Å; E696-F819 HydrophobicContact CG-CZ 3.85Å; V773-F819 HydrophobicContact CG1-CD2 4.26Å; V773-F819 PolarHBondContact O-N 3.32Å; H774-F819 CarbonylContact C-O 3.47Å; H774-F819 WeakPolarHBondContact CA-O 3.2Å; H774-F819 AromaticContact CE1-CD2 3.46Å; H774-F819 VanDerWaalsContact CE1-CD2 3.46Å; H774-F819 WeakPolarHBondContact CE1-CD2 3.31Å; H774-F819 AromaticContact ND1-CD2 3.54Å; H774-F819 AromaticContact ND1-CG 3.9Å; V775-F819 PolarHBondContact N-O 3.21Å; F819-Y821 HydrophobicContact CB-CD2 4.29Å; F819-Y821 HydrophobicContact CB-CE2 3.46Å; F819-Y821 VanDerWaalsContact CB-CE2 3.46Å; F819-Y821 HydrophobicContact CG-CE2 4.45Å
820	A	97.1	Very high	91.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	127.7	172.7	0	0	0	0	0	109.4	V647 K648 E649 H650 V775 R809	V647-A820 HydrophobicContact CG1-CB 3.73Å; K648-A820 PolarHBondContact O-N 2.76Å; E649-A820 CarbonylContact C-O 3.56Å; E649-A820 WeakPolarHBondContact CA-O 3.28Å; E649-A820 HydrophobicContact CG-CB 4.45Å; H650-A820 PolarHBondContact N-O 3.4Å; V775-A820 CarbonylContact O-C 3.59Å; V775-A820 WeakPolarHBondContact O-CA 3.41Å; R809-A820 HydrophobicContact CB-CB 4.33Å; R809-A820 HydrophobicContact CG-CB 3.84Å
821	Y	98.2	Very high	91.6	Very high	11 Å²	11	42.8 Å²	42.8	4%	0.043	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	105.1	-176.9	-58.1	-94	0	0	0	108.9	H650 I655 L687 I691 H774 V775 V776 D777 F819	H650-Y821 HydrophobicContact CB-CD1 3.74Å; H650-Y821 HydrophobicContact CB-CE1 4.23Å; H650-Y821 HydrophobicContact CB-CG 4.48Å; H650-Y821 AromaticContact CD2-CD1 3.9Å; H650-Y821 AromaticContact CD2-CE1 3.51Å; H650-Y821 CarbonylContact O-C 3.53Å; H650-Y821 WeakPolarHBondContact O-CA 3.41Å; I655-Y821 HydrophobicContact CG1-CD1 4.22Å; L687-Y821 HydrophobicContact CD1-CD1 3.89Å; L687-Y821 HydrophobicContact CD1-CE1 4.41Å; L687-Y821 HydrophobicContact CD1-CG 4.21Å; L687-Y821 HydrophobicContact CD2-CG 4.44Å; I691-Y821 HydrophobicContact CD1-CD1 4.44Å; I691-Y821 HydrophobicContact CD1-CD2 3.5Å; I691-Y821 HydrophobicContact CD1-CE1 4.43Å; I691-Y821 HydrophobicContact CD1-CE2 3.49Å; I691-Y821 VanDerWaalsContact CD1-CE2 3.49Å; I691-Y821 HydrophobicContact CD1-CG 4Å; I691-Y821 HydrophobicContact CG1-CD2 4.24Å; I691-Y821 HydrophobicContact CG1-CE1 4.27Å; I691-Y821 HydrophobicContact CG1-CE2 3.77Å; H774-Y821 HydrophobicContact CB-CE2 4.34Å; H774-Y821 AromaticContact ND1-CE2 3.81Å; V775-Y821 WeakPolarHBondContact O-CD2 3.43Å; V775-Y821 PolarHBondContact O-N 3.2Å; V776-Y821 CarbonylContact C-O 3.59Å; V776-Y821 WeakPolarHBondContact CA-O 3.31Å; D777-Y821 PolarHBondContact N-O 3.46Å; F819-Y821 HydrophobicContact CB-CD2 4.29Å; F819-Y821 HydrophobicContact CB-CE2 3.46Å; F819-Y821 VanDerWaalsContact CB-CE2 3.46Å; F819-Y821 HydrophobicContact CG-CE2 4.45Å
822	H	97.5	Very high	91.8	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	116.4	-177.3	-57	-56.4	0	0	0	109.9	E649 H650 Y651 L652 I655 D777 F824	E649-H822 IonicContact OE2-CD2 3.03Å; E649-H822 IonicContact OE2-NE2 3.36Å; E649-H822 PolarHBondContact OE2-NE2 3.39Å; H650-H822 PolarHBondContact O-N 2.99Å; Y651-H822 CarbonylContact C-O 3.49Å; Y651-H822 HydrophobicContact CD1-CB 4.12Å; Y651-H822 HydrophobicContact CE1-CB 4.4Å; Y651-H822 AromaticContact CE1-CD2 3.7Å; Y651-H822 AromaticContact CZ-CD2 3.66Å; L652-H822 PolarHBondContact N-O 2.9Å; L652-H822 VanDerWaalsContact N-O 3.09Å; I655-H822 VanDerWaalsContact CD1-O 3.29Å; I655-H822 WeakPolarHBondContact CD1-O 3.45Å; D777-H822 IonicContact OD2-ND1 2.81Å; H822-F824 HydrophobicContact CB-CD1 4.16Å; H822-F824 HydrophobicContact CB-CD2 4.36Å; H822-F824 HydrophobicContact CB-CE1 3.71Å; H822-F824 HydrophobicContact CB-CE2 3.93Å; H822-F824 HydrophobicContact CB-CG 4.47Å; H822-F824 HydrophobicContact CB-CZ 3.59Å; H822-F824 AromaticContact CG-CZ 3.82Å; H822-F824 AromaticContact ND1-CZ 3.86Å; H822-F824 PolarHBondContact O-N 2.81Å
823	L	95.5	Very high	92.1	Very high	15 Å²	15	46.9 Å²	46.9	8%	0.079	24%	0.24	C	C	.	.	S	Bend	trans	-78.9	32.7	-179	-67.2	171.5	0	0	0	113.2	I655 L679 L683 V684 L687 V776 D777	I655-L823 HydrophobicContact CD1-CD2 4.21Å; I655-L823 HydrophobicContact CG2-CD2 4.49Å; L679-L823 HydrophobicContact CD1-CD1 4.35Å; L683-L823 HydrophobicContact CD2-CD2 3.97Å; L683-L823 HydrophobicContact CG-CD2 3.98Å; V684-L823 HydrophobicContact CB-CD1 4.3Å; V684-L823 HydrophobicContact CG2-CD1 3.4Å; V684-L823 VanDerWaalsContact CG2-CD1 3.4Å; L687-L823 HydrophobicContact CD2-CD2 3.71Å; L687-L823 HydrophobicContact CD2-CG 4.24Å; V776-L823 HydrophobicContact CG1-CD1 4.1Å; V776-L823 HydrophobicContact CG1-CG 4.49Å; D777-L823 PolarHBondContact O-N 2.97Å
824	F	94.5	Very high	92.5	Very high	1 Å²	1	50.4 Å²	50.4	0%	0.004	26%	0.263	C	S	.	.	S	Bend	trans	-142.4	153.2	176	51.3	-92.3	0	0	0	109.9	Y651 L652 G779 W799 V805 H822 R828 L829 M832	Y651-F824 HydrophobicContact CD1-CE2 4.46Å; Y651-F824 HydrophobicContact CE1-CE2 4.26Å; L652-F824 VanDerWaalsContact CB-C 3.45Å; L652-F824 PolarHBondContact N-O 2.97Å; L652-F824 VanDerWaalsContact N-O 3.15Å; G779-F824 VanDerWaalsContact CA-CD1 3.49Å; W799-F824 HydrophobicContact CH2-CB 3.98Å; W799-F824 HydrophobicContact CZ3-CB 3.69Å; W799-F824 HydrophobicContact CZ3-CD1 4.13Å; W799-F824 HydrophobicContact CZ3-CG 4.1Å; V805-F824 HydrophobicContact CG1-CZ 4.07Å; V805-F824 HydrophobicContact CG2-CZ 3.91Å; H822-F824 HydrophobicContact CB-CD1 4.16Å; H822-F824 HydrophobicContact CB-CD2 4.36Å; H822-F824 HydrophobicContact CB-CE1 3.71Å; H822-F824 HydrophobicContact CB-CE2 3.93Å; H822-F824 HydrophobicContact CB-CG 4.47Å; H822-F824 HydrophobicContact CB-CZ 3.59Å; H822-F824 AromaticContact CG-CZ 3.82Å; H822-F824 AromaticContact ND1-CZ 3.86Å; H822-F824 PolarHBondContact O-N 2.81Å; F824-R828 HydrophobicContact CB-CB 4.17Å; F824-R828 HydrophobicContact CB-CG 4.1Å; F824-R828 HydrophobicContact CD2-CB 4.34Å; F824-R828 HydrophobicContact CD2-CG 4.37Å; F824-R828 HydrophobicContact CG-CG 4.46Å; F824-L829 HydrophobicContact CE2-CB 4.13Å; F824-L829 HydrophobicContact CE2-CD1 4.34Å; F824-M832 HydrophobicContact CD1-CE 4.25Å; F824-M832 HydrophobicContact CD2-CE 3.89Å; F824-M832 HydrophobicContact CE1-CE 4.24Å; F824-M832 HydrophobicContact CE2-CE 3.88Å; F824-M832 HydrophobicContact CE2-SD 4.43Å; F824-M832 HydrophobicContact CG-CE 4.07Å; F824-M832 HydrophobicContact CZ-CE 4.05Å
825	P	93.4	Very high	93.2	Very high	41 Å²	41	52.8 Å²	52.8	27%	0.266	28%	0.275	S	S	.	.			trans	-74.2	159.4	-178.4	30.2	-35.1	0	0	0	112	E653 S827 R828 L829	E653-P825 VanDerWaalsContact OE2-CA 3.26Å; E653-P825 WeakPolarHBondContact OE2-CA 3.5Å; P825-S827 PolarHBondContact O-N 3.22Å; P825-R828 HydrophobicContact CG-CB 3.97Å; P825-R828 VanDerWaalsContact O-CB 3.32Å; P825-R828 WeakPolarHBondContact O-CB 3.48Å; P825-R828 PolarHBondContact O-N 3.35Å; P825-L829 PolarHBondContact O-N 2.78Å
826	R	94.9	Very high	94	Very high	96 Å²	96	51.8 Å²	51.8	36%	0.362	26%	0.263	S	S	.	.	H	α-helix	trans	-54.9	-38.3	175.1	-72.6	172.7	177.7	89.9	0.1	113	Y651 E653 D654 R828 L829 E830	Y651-R826 HydrophobicContact CD1-CB 4.39Å; Y651-R826 HydrophobicContact CD1-CG 3.6Å; Y651-R826 HydrophobicContact CD2-CG 3.66Å; Y651-R826 VanDerWaalsContact CD2-CZ 3.45Å; Y651-R826 HydrophobicContact CE1-CG 3.98Å; Y651-R826 HydrophobicContact CE2-CG 4.06Å; Y651-R826 HydrophobicContact CG-CG 3.42Å; Y651-R826 VanDerWaalsContact CG-CG 3.42Å; E653-R826 WeakPolarHBondContact OE1-CD 3.42Å; E653-R826 VanDerWaalsContact OE1-CG 3.25Å; E653-R826 WeakPolarHBondContact OE1-CG 3.25Å; E653-R826 IonicContact OE1-CZ 3.84Å; E653-R826 PolarHBondContact OE1-N 2.77Å; E653-R826 IonicContact OE1-NE 4Å; E653-R826 IonicContact OE1-NH1 3.54Å; E653-R826 PolarHBondContact OE1-NH1 2.77Å; D654-R826 IonicContact OD1-CZ 2.95Å; D654-R826 IonicContact OD1-NH1 2.74Å; D654-R826 PolarHBondContact OD1-NH1 3.07Å; D654-R826 VanDerWaalsContact OD1-NH1 3.14Å; D654-R826 IonicContact OD1-NH2 3.24Å; D654-R826 IonicContact OD2-CZ 3.89Å; D654-R826 IonicContact OD2-NH1 2.76Å; D654-R826 PolarHBondContact OD2-NH1 2.72Å; D654-R826 VanDerWaalsContact OD2-NH1 3.16Å; D654-R826 IonicContact OD2-NH2 3.18Å; D654-R826 PolarHBondContact OD2-NH2 2.67Å; R826-R828 PolarHBondContact O-N 2.77Å; R826-L829 WeakPolarHBondContact O-CB 3.29Å; R826-L829 PolarHBondContact O-N 3.24Å; R826-E830 PolarHBondContact O-N 2.88Å; R826-E830 VanDerWaalsContact O-N 3.13Å
827	S	93.7	Very high	94.3	Very high	67 Å²	67	51 Å²	51	47%	0.469	27%	0.265	S	S	.	.	H	α-helix	trans	-60.8	-29.1	175.8	59.2	0	0	0	0	113.3	P825 K831	P825-S827 PolarHBondContact O-N 3.22Å; S827-K831 WeakPolarHBondContact O-CG 3.37Å; S827-K831 PolarHBondContact O-N 3.06Å
828	R	93.7	Very high	94.4	Very high	42 Å²	42	48.7 Å²	48.7	16%	0.158	25%	0.248	C	C	.	.	H	α-helix	trans	-69.7	-44.9	172.8	176.2	64.2	65.2	163.1	3.3	110.7	E674 D675 W799 F824 P825 R826 E830 K831 M832	E674-R828 PolarHBondContact O-NH1 3.25Å; E674-R828 PolarHBondContact O-NH2 3.41Å; D675-R828 IonicContact OD1-NH1 3.39Å; W799-R828 HydrophobicContact CD2-CG 4.21Å; W799-R828 VanDerWaalsContact CE2-CZ 3.49Å; W799-R828 HydrophobicContact CE3-CG 4.01Å; W799-R828 HydrophobicContact CH2-CG 4.25Å; W799-R828 HydrophobicContact CZ2-CG 4.44Å; W799-R828 HydrophobicContact CZ3-CG 4.04Å; F824-R828 HydrophobicContact CB-CB 4.17Å; F824-R828 HydrophobicContact CB-CG 4.1Å; F824-R828 HydrophobicContact CD2-CB 4.34Å; F824-R828 HydrophobicContact CD2-CG 4.37Å; F824-R828 HydrophobicContact CG-CG 4.46Å; P825-R828 HydrophobicContact CG-CB 3.97Å; P825-R828 VanDerWaalsContact O-CB 3.32Å; P825-R828 WeakPolarHBondContact O-CB 3.48Å; P825-R828 PolarHBondContact O-N 3.35Å; R826-R828 PolarHBondContact O-N 2.77Å; R828-E830 PolarHBondContact O-N 3.16Å; R828-K831 CarbonylContact O-C 3.51Å; R828-K831 WeakPolarHBondContact O-CA 3.3Å; R828-K831 PolarHBondContact O-N 2.84Å; R828-M832 HydrophobicContact CG-CE 3.69Å; R828-M832 HydrophobicContact CG-CG 4.47Å; R828-M832 WeakPolarHBondContact O-CG 3.04Å; R828-M832 PolarHBondContact O-N 2.8Å
829	L	95.5	Very high	94.4	Very high	34 Å²	34	50.9 Å²	50.9	18%	0.178	26%	0.258	C	S	.	.	H	α-helix	trans	-58	-38.8	177.9	-177.9	65	0	0	0	111.4	Y651 R802 V805 F824 P825 R826 K831 M832	Y651-L829 HydrophobicContact CE1-CB 4.37Å; Y651-L829 HydrophobicContact CE1-CD2 3.81Å; Y651-L829 VanDerWaalsContact OH-CD2 3.26Å; Y651-L829 WeakPolarHBondContact OH-CD2 3.44Å; R802-L829 HydrophobicContact CG-CD1 4.02Å; R802-L829 PolarHBondContact NE-O 2.95Å; V805-L829 HydrophobicContact CB-CD1 4.27Å; V805-L829 HydrophobicContact CG1-CD1 4.24Å; V805-L829 HydrophobicContact CG2-CD1 4.05Å; F824-L829 HydrophobicContact CE2-CB 4.13Å; F824-L829 HydrophobicContact CE2-CD1 4.34Å; P825-L829 PolarHBondContact O-N 2.78Å; R826-L829 WeakPolarHBondContact O-CB 3.29Å; R826-L829 PolarHBondContact O-N 3.24Å; L829-K831 VanDerWaalsContact C-N 3.28Å; L829-K831 PolarHBondContact O-N 2.85Å; L829-M832 HydrophobicContact CD1-SD 3.93Å; L829-M832 PolarHBondContact O-N 3.03Å
830	E	94.4	Very high	94.3	Very high	138 Å²	138	48.8 Å²	48.8	65%	0.645	25%	0.249	S	C	*	.	H	α-helix	trans	-65.2	-28.1	174.5	-68.8	172.9	-174.2	0	0	113.1	R802 R826 R828	R802-E830 VanDerWaalsContact NH2-C 3.32Å; R802-E830 PolarHBondContact NH2-O 3.26Å; R826-E830 PolarHBondContact O-N 2.88Å; R826-E830 VanDerWaalsContact O-N 3.13Å; R828-E830 PolarHBondContact O-N 3.16Å
831	K	93.7	Very high	94.2	Very high	129 Å²	129	52.5 Å²	52.5	56%	0.561	27%	0.269	S	S	*	.	H	α-helix	trans	-86.3	-19.2	174.5	-68.4	178.2	178.5	-178.7	0	113.5	E674 S827 R828 L829	E674-K831 IonicContact OE1-NZ 3.86Å; E674-K831 IonicContact OE2-NZ 3.72Å; E674-K831 PolarHBondContact OE2-NZ 2.67Å; S827-K831 WeakPolarHBondContact O-CG 3.37Å; S827-K831 PolarHBondContact O-N 3.06Å; R828-K831 CarbonylContact O-C 3.51Å; R828-K831 WeakPolarHBondContact O-CA 3.3Å; R828-K831 PolarHBondContact O-N 2.84Å; L829-K831 VanDerWaalsContact C-N 3.28Å; L829-K831 PolarHBondContact O-N 2.85Å
832	M	94.7	Very high	93.9	Very high	10 Å²	10	53.4 Å²	53.4	5%	0.049	27%	0.272	C	S	.	.	S	Bend	trans	-64	141.9	179.2	-72.1	175.6	179.3	0	0	112	W799 R802 V805 F824 R828 L829	W799-M832 HydrophobicContact CD2-CE 4.25Å; W799-M832 HydrophobicContact CE3-CE 3.43Å; W799-M832 VanDerWaalsContact CE3-CE 3.43Å; W799-M832 HydrophobicContact CZ3-CE 4.05Å; R802-M832 HydrophobicContact CG-CB 3.94Å; R802-M832 PolarHBondContact NE-O 3.42Å; V805-M832 HydrophobicContact CG2-SD 3.97Å; F824-M832 HydrophobicContact CD1-CE 4.25Å; F824-M832 HydrophobicContact CD2-CE 3.89Å; F824-M832 HydrophobicContact CE1-CE 4.24Å; F824-M832 HydrophobicContact CE2-CE 3.88Å; F824-M832 HydrophobicContact CE2-SD 4.43Å; F824-M832 HydrophobicContact CG-CE 4.07Å; F824-M832 HydrophobicContact CZ-CE 4.05Å; R828-M832 HydrophobicContact CG-CE 3.69Å; R828-M832 HydrophobicContact CG-CG 4.47Å; R828-M832 WeakPolarHBondContact O-CG 3.04Å; R828-M832 PolarHBondContact O-N 2.8Å; L829-M832 HydrophobicContact CD1-SD 3.93Å; L829-M832 PolarHBondContact O-N 3.03Å
833	V	93.8	Very high	93.5	Very high	85 Å²	85	54.4 Å²	54.4	52%	0.515	28%	0.278	S	S	.	.			trans	-63.5	147.8	175.9	-65.2	0	0	0	0	111.3	S801 R802 F835	S801-V833 CarbonylContact C-O 3.23Å; S801-V833 VanDerWaalsContact CA-O 3.29Å; S801-V833 WeakPolarHBondContact CA-O 3.11Å; S801-V833 WeakPolarHBondContact CB-O 3.14Å; R802-V833 PolarHBondContact N-O 3.12Å; V833-F835 WeakPolarHBondContact CG2-O 3.43Å; V833-F835 PolarHBondContact O-N 3.28Å
834	P	93	Very high	93.3	Very high	74 Å²	74	55.3 Å²	55.3	48%	0.481	29%	0.285	S	S	.	.	S	Bend	trans	-62.6	-40.9	-178.8	-25.5	35.1	0	0	0	114	A803	A803-P834 WeakPolarHBondContact CB-O 3.45Å; A803-P834 PolarHBondContact N-O 3.21Å; A803-P834 VanDerWaalsContact N-O 3.09Å
835	F	91.5	Very high	93.3	Very high	97 Å²	97	55.5 Å²	55.5	43%	0.425	29%	0.286	S	S	.	.	S	Bend	trans	-135.1	151.7	-176.3	-52.6	-67.3	0	0	0	110.2	D624 S801 A803 V833	D624-F835 HydrophobicContact CB-CE2 4.35Å; S801-F835 VanDerWaalsContact CB-C 3.41Å; A803-F835 HydrophobicContact CB-CD1 3.83Å; A803-F835 HydrophobicContact CB-CE1 4.28Å; V833-F835 WeakPolarHBondContact CG2-O 3.43Å; V833-F835 PolarHBondContact O-N 3.28Å
836	Q	90.5	Very high	93.4	Very high	44 Å²	44	54.1 Å²	54.1	21%	0.206	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-67.3	147.8	174.3	-172.4	172.6	7.9	0	0	111	H781 E783 S801	H781-Q836 PolarHBondContact CE1-NE2 3.45Å; E783-Q836 PolarHBondContact OE1-NE2 2.99Å; S801-Q836 PolarHBondContact OG-N 2.98Å
837	V	92.1	Very high	93.3	Very high	78 Å²	78	52.8 Å²	52.8	47%	0.473	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-67.6	128.3	172.4	-178.8	0	0	0	0	109.2	L841 R842	V837-L841 HydrophobicContact CG1-CB 4.09Å; V837-L841 HydrophobicContact CG1-CD1 4.27Å; V837-R842 PolarHBondContact O-NE 2.94Å
838	P	93.8	Very high	93.3	Very high	12 Å²	12	50 Å²	50	8%	0.078	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-55.7	143.5	-179.8	-27.6	35.6	0	0	0	113.5	R593 I840 L841 D870	R593-P838 HydrophobicContact CB-CB 4Å; R593-P838 HydrophobicContact CB-CG 4.29Å; R593-P838 HydrophobicContact CG-CG 4.38Å; R593-P838 VanDerWaalsContact CZ-CG 3.44Å; P838-I840 VanDerWaalsContact C-N 3.28Å; P838-I840 HydrophobicContact CB-CG2 4.05Å; P838-I840 PolarHBondContact O-N 3.24Å; P838-L841 HydrophobicContact CB-CG 4.33Å; P838-L841 HydrophobicContact CG-CD1 4.35Å; P838-L841 WeakPolarHBondContact O-CB 3.11Å; P838-L841 PolarHBondContact O-N 3.13Å; P838-D870 HydrophobicContact CG-CB 4.46Å
839	E	94.2	Very high	93.5	Very high	48 Å²	48	48 Å²	48	22%	0.224	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-58.4	-39.4	-177.9	-82.9	-176.2	-179.9	0	0	113.5	R593 V595 L841 R842 T843	R593-E839 WeakPolarHBondContact O-CB 3.45Å; R593-E839 PolarHBondContact O-N 2.91Å; V595-E839 HydrophobicContact CB-CB 3.91Å; V595-E839 PolarHBondContact N-OE2 3.03Å; E839-L841 PolarHBondContact O-N 3.02Å; E839-R842 WeakPolarHBondContact O-CG 3.37Å; E839-R842 PolarHBondContact O-N 2.83Å; E839-R842 IonicContact OE1-NH2 2.91Å; E839-R842 PolarHBondContact OE1-NH2 3.33Å; E839-R842 VanDerWaalsContact OE1-NH2 3.09Å; E839-T843 HydrophobicContact CB-CG2 4.49Å; E839-T843 PolarHBondContact O-N 2.66Å; E839-T843 PolarHBondContact O-OG1 2.75Å
840	I	94.7	Very high	93.5	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-57.1	-19	177.7	-165	168.9	0	0	0	113.4	V595 P838 L845 L848 A868 P872	V595-I840 HydrophobicContact CG2-CB 4.24Å; V595-I840 HydrophobicContact CG2-CG1 4.43Å; P838-I840 VanDerWaalsContact C-N 3.28Å; P838-I840 HydrophobicContact CB-CG2 4.05Å; P838-I840 PolarHBondContact O-N 3.24Å; I840-L845 HydrophobicContact CG1-CD2 4.22Å; I840-L848 HydrophobicContact CD1-CD2 3.74Å; I840-L848 HydrophobicContact CG1-CD2 3.84Å; I840-A868 HydrophobicContact CD1-CB 3.86Å; I840-P872 HydrophobicContact CD1-CG 4.45Å; I840-P872 HydrophobicContact CG1-CB 4.39Å; I840-P872 HydrophobicContact CG1-CG 4.34Å
841	L	94.6	Very high	93.5	Very high	79 Å²	79	42.3 Å²	42.3	41%	0.414	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-95.2	-6.4	178.1	-54.7	-174.3	0	0	0	113.7	V837 P838 E839 D870 S871 P872	V837-L841 HydrophobicContact CG1-CB 4.09Å; V837-L841 HydrophobicContact CG1-CD1 4.27Å; P838-L841 HydrophobicContact CB-CG 4.33Å; P838-L841 HydrophobicContact CG-CD1 4.35Å; P838-L841 WeakPolarHBondContact O-CB 3.11Å; P838-L841 PolarHBondContact O-N 3.13Å; E839-L841 PolarHBondContact O-N 3.02Å; L841-D870 HydrophobicContact CD1-CB 4.17Å; L841-D870 HydrophobicContact CD2-CB 4.42Å; L841-S871 WeakPolarHBondContact CD2-O 3.3Å; L841-P872 HydrophobicContact CD2-CB 4.47Å
842	R	91.8	Very high	93.5	Very high	30 Å²	30	36.2 Å²	36.2	11%	0.113	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.1	-10.9	-171.5	59.9	177	178.8	81.2	-6.3	115.2	E783 E784 R785 Y786 V837 E839	E783-R842 WeakPolarHBondContact OE1-CD 3.4Å; E783-R842 IonicContact OE1-CZ 2.77Å; E783-R842 IonicContact OE1-NE 2.95Å; E783-R842 PolarHBondContact OE1-NE 3.01Å; E783-R842 VanDerWaalsContact OE1-NE 3.14Å; E784-R842 PolarHBondContact O-NH1 2.69Å; R785-R842 CarbonylContact C-O 3.57Å; R785-R842 WeakPolarHBondContact CA-O 3.27Å; Y786-R842 WeakPolarHBondContact CB-O 3.5Å; Y786-R842 PolarHBondContact N-O 2.96Å; V837-R842 PolarHBondContact O-NE 2.94Å; E839-R842 WeakPolarHBondContact O-CG 3.37Å; E839-R842 PolarHBondContact O-N 2.83Å; E839-R842 IonicContact OE1-NH2 2.91Å; E839-R842 PolarHBondContact OE1-NH2 3.33Å; E839-R842 VanDerWaalsContact OE1-NH2 3.09Å
843	T	90.3	Very high	93.5	Very high	21 Å²	21	36 Å²	36	13%	0.129	19%	0.193	C	C	.	.	S	Bend	trans	-105.6	158.3	179.1	58.2	0	0	0	0	112.1	E839	E839-T843 HydrophobicContact CB-CG2 4.49Å; E839-T843 PolarHBondContact O-N 2.66Å; E839-T843 PolarHBondContact O-OG1 2.75Å
844	P	91.4	Very high	93.5	Very high	35 Å²	35	33.7 Å²	33.7	23%	0.227	18%	0.178	C	C	.	.			trans	-64.6	139.8	173.5	29	-36.7	0	0	0	111.3	Y786 E846	Y786-P844 HydrophobicContact CD2-CB 3.73Å; Y786-P844 HydrophobicContact CD2-CG 4.14Å; Y786-P844 HydrophobicContact CE2-CB 3.77Å; Y786-P844 HydrophobicContact CE2-CG 4.49Å; Y786-P844 HydrophobicContact CG-CB 4.14Å; P844-E846 WeakPolarHBondContact CB-OE2 3.23Å
845	L	94.4	Very high	93.4	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.021	16%	0.161	C	C	.	.			trans	-102.3	2.8	-165.3	-62.1	-179.2	0	0	0	114.4	I840 N847 L848 V849 P872 A876 V877 A880	I840-L845 HydrophobicContact CG1-CD2 4.22Å; L845-N847 PolarHBondContact O-N 3.09Å; L845-L848 HydrophobicContact CD2-CD2 3.99Å; L845-L848 CarbonylContact O-C 3.59Å; L845-L848 WeakPolarHBondContact O-CA 3.48Å; L845-L848 VanDerWaalsContact O-CB 3.27Å; L845-L848 WeakPolarHBondContact O-CB 3.42Å; L845-L848 PolarHBondContact O-N 3.5Å; L845-V849 WeakPolarHBondContact O-CG2 3.23Å; L845-V849 PolarHBondContact O-N 3.49Å; L845-P872 HydrophobicContact CD1-CB 3.66Å; L845-P872 HydrophobicContact CD1-CG 4.13Å; L845-A876 HydrophobicContact CD1-CB 4.06Å; L845-V877 HydrophobicContact CD1-CG2 3.86Å; L845-A880 HydrophobicContact CB-CB 3.95Å
846	E	94.4	Very high	93.5	Very high	12 Å²	12	29.6 Å²	29.6	6%	0.056	15%	0.154	C	C	.	.	H	α-helix	trans	-68.4	-38.7	-170.3	-44.3	87	177.9	0	0	111.9	P844 L848 V849 L850 A880 L883 L884	P844-E846 WeakPolarHBondContact CB-OE2 3.23Å; E846-L848 PolarHBondContact O-N 2.77Å; E846-V849 PolarHBondContact O-N 3.14Å; E846-L850 WeakPolarHBondContact O-CB 3.33Å; E846-L850 PolarHBondContact O-N 3.31Å; E846-A880 HydrophobicContact CB-CB 4.36Å; E846-A880 HydrophobicContact CG-CB 3.74Å; E846-L883 HydrophobicContact CG-CB 4.29Å; E846-L883 HydrophobicContact CG-CD2 3.62Å; E846-L883 HydrophobicContact CG-CG 4.44Å; E846-L884 HydrophobicContact CB-CD2 4.18Å; E846-L884 HydrophobicContact CB-CG 4.15Å
847	N	93.2	Very high	93.5	Very high	69 Å²	69	30 Å²	30	37%	0.369	16%	0.16	S	C	.	.	H	α-helix	trans	-59.3	-39.4	169.8	-78.7	-54.7	0	0	0	111.6	L845 L850 Q851 P910	L845-N847 PolarHBondContact O-N 3.09Å; N847-L850 PolarHBondContact O-N 2.78Å; N847-Q851 WeakPolarHBondContact O-CG 3.41Å; N847-Q851 PolarHBondContact O-N 2.91Å; N847-P910 WeakPolarHBondContact OD1-CD 3.24Å
848	L	94.3	Very high	93.5	Very high	8 Å²	8	31.4 Å²	31.4	4%	0.042	16%	0.162	C	C	.	.	H	α-helix	trans	-71.2	-41.2	-178.5	-157.9	67.1	0	0	0	112	V595 F599 I840 L845 E846 Q851 A852 L865	V595-L848 HydrophobicContact CG2-CD1 3.93Å; V595-L848 HydrophobicContact CG2-CD2 3.92Å; V595-L848 HydrophobicContact CG2-CG 4.47Å; F599-L848 HydrophobicContact CB-CD1 3.76Å; F599-L848 HydrophobicContact CD2-CD1 3.32Å; F599-L848 HydrophobicContact CD2-CD2 4.48Å; F599-L848 HydrophobicContact CD2-CG 3.72Å; F599-L848 HydrophobicContact CE2-CD1 4.1Å; F599-L848 HydrophobicContact CE2-CG 4.27Å; F599-L848 HydrophobicContact CG-CD1 3.73Å; I840-L848 HydrophobicContact CD1-CD2 3.74Å; I840-L848 HydrophobicContact CG1-CD2 3.84Å; L845-L848 HydrophobicContact CD2-CD2 3.99Å; L845-L848 CarbonylContact O-C 3.59Å; L845-L848 WeakPolarHBondContact O-CA 3.48Å; L845-L848 VanDerWaalsContact O-CB 3.27Å; L845-L848 WeakPolarHBondContact O-CB 3.42Å; L845-L848 PolarHBondContact O-N 3.5Å; E846-L848 PolarHBondContact O-N 2.77Å; L848-Q851 PolarHBondContact O-N 2.74Å; L848-A852 WeakPolarHBondContact O-CB 3.45Å; L848-A852 PolarHBondContact O-N 3.03Å; L848-L865 HydrophobicContact CD2-CD1 4.29Å; L848-L865 HydrophobicContact CD2-CD2 3.55Å; L848-L865 HydrophobicContact CG-CD2 3.84Å
849	V	96.8	Very high	93.5	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.9	-45.7	173.8	172	0	0	0	0	110.1	L845 E846 Q851 A852 K853 A861 L865 V877 A880 V881 L884 L890	L845-V849 WeakPolarHBondContact O-CG2 3.23Å; L845-V849 PolarHBondContact O-N 3.49Å; E846-V849 PolarHBondContact O-N 3.14Å; V849-Q851 PolarHBondContact O-N 3.29Å; V849-A852 WeakPolarHBondContact O-CB 3.41Å; V849-A852 PolarHBondContact O-N 2.99Å; V849-A852 VanDerWaalsContact O-N 3.14Å; V849-K853 WeakPolarHBondContact O-CG 3.34Å; V849-K853 PolarHBondContact O-N 3.15Å; V849-A861 HydrophobicContact CB-CB 4.42Å; V849-A861 HydrophobicContact CG1-CB 3.75Å; V849-A861 HydrophobicContact CG2-CB 4.05Å; V849-L865 HydrophobicContact CG2-CD1 4.12Å; V849-V877 HydrophobicContact CG2-CG1 4.29Å; V849-A880 HydrophobicContact CG2-CB 3.85Å; V849-V881 HydrophobicContact CG1-CG2 3.84Å; V849-V881 HydrophobicContact CG2-CG2 4.41Å; V849-L884 HydrophobicContact CB-CD1 3.8Å; V849-L884 HydrophobicContact CG1-CD1 3.5Å; V849-L890 HydrophobicContact CG1-CD1 4.03Å
850	L	95.7	Very high	93.5	Very high	7 Å²	7	32.9 Å²	32.9	4%	0.037	17%	0.17	C	C	.	.	H	α-helix	trans	-58.3	-46.9	175	177.6	55.6	0	0	0	111.3	E846 N847 A852 K853 I854 L884 V889 L896 L903 P910	E846-L850 WeakPolarHBondContact O-CB 3.33Å; E846-L850 PolarHBondContact O-N 3.31Å; N847-L850 PolarHBondContact O-N 2.78Å; L850-A852 VanDerWaalsContact C-N 3.34Å; L850-A852 PolarHBondContact O-N 3.18Å; L850-K853 PolarHBondContact O-N 3.19Å; L850-I854 HydrophobicContact CD1-CD1 4.17Å; L850-I854 HydrophobicContact CD1-CG1 4.37Å; L850-I854 HydrophobicContact CG-CD1 4.05Å; L850-I854 VanDerWaalsContact O-CG1 3.29Å; L850-I854 WeakPolarHBondContact O-CG1 3.01Å; L850-I854 PolarHBondContact O-N 2.98Å; L850-L884 HydrophobicContact CB-CD1 4.31Å; L850-V889 HydrophobicContact CD1-CG1 3.85Å; L850-L896 HydrophobicContact CD1-CD2 3.58Å; L850-L903 HydrophobicContact CD2-CD2 4.04Å; L850-P910 HydrophobicContact CD2-CG 4.19Å
851	Q	93.9	Very high	93.6	Very high	46 Å²	46	32.9 Å²	32.9	22%	0.215	17%	0.17	C	C	.	.	H	α-helix	trans	-60.7	-41.6	174.7	-69.1	-58.5	-47	0	0	112.2	Q574 F599 N847 L848 V849 K853 I854 H855	Q574-Q851 VanDerWaalsContact NE2-OE1 3.17Å; F599-Q851 HydrophobicContact CE1-CB 4Å; F599-Q851 HydrophobicContact CE2-CB 4Å; F599-Q851 HydrophobicContact CZ-CB 3.56Å; N847-Q851 WeakPolarHBondContact O-CG 3.41Å; N847-Q851 PolarHBondContact O-N 2.91Å; L848-Q851 PolarHBondContact O-N 2.74Å; V849-Q851 PolarHBondContact O-N 3.29Å; Q851-K853 VanDerWaalsContact C-N 3.28Å; Q851-K853 PolarHBondContact O-N 2.7Å; Q851-I854 PolarHBondContact O-N 3.44Å; Q851-H855 PolarHBondContact O-CD2 2.88Å; Q851-H855 VanDerWaalsContact O-CD2 3.23Å; Q851-H855 PolarHBondContact O-N 2.99Å
852	A	95.3	Very high	93.7	Very high	1 Å²	1	31 Å²	31	1%	0.008	16%	0.162	C	C	.	.	H	α-helix	trans	-57.8	-43.9	176.4	0	0	0	0	0	110.9	F599 L848 V849 L850 H855 M856 F864	F599-A852 HydrophobicContact CE2-CB 4.03Å; L848-A852 WeakPolarHBondContact O-CB 3.45Å; L848-A852 PolarHBondContact O-N 3.03Å; V849-A852 WeakPolarHBondContact O-CB 3.41Å; V849-A852 PolarHBondContact O-N 2.99Å; V849-A852 VanDerWaalsContact O-N 3.14Å; L850-A852 VanDerWaalsContact C-N 3.34Å; L850-A852 PolarHBondContact O-N 3.18Å; A852-H855 PolarHBondContact O-N 3.3Å; A852-M856 CarbonylContact O-C 3.48Å; A852-M856 WeakPolarHBondContact O-CA 3.15Å; A852-M856 PolarHBondContact O-N 3.27Å; A852-F864 HydrophobicContact CB-CB 4.36Å; A852-F864 HydrophobicContact CB-CD1 3.53Å; A852-F864 HydrophobicContact CB-CE1 4.06Å; A852-F864 HydrophobicContact CB-CG 4.01Å
853	K	94.6	Very high	93.9	Very high	5 Å²	5	34.5 Å²	34.5	2%	0.022	18%	0.179	C	C	.	.	H	α-helix	trans	-71.4	-28.4	178.7	-65.2	-49.2	-43.6	-156	0	114	V849 L850 Q851 P857 K859 L890 E894 L896	V849-K853 WeakPolarHBondContact O-CG 3.34Å; V849-K853 PolarHBondContact O-N 3.15Å; L850-K853 PolarHBondContact O-N 3.19Å; Q851-K853 VanDerWaalsContact C-N 3.28Å; Q851-K853 PolarHBondContact O-N 2.7Å; K853-P857 WeakPolarHBondContact CE-O 3.37Å; K853-P857 PolarHBondContact NZ-O 3.37Å; K853-P857 WeakPolarHBondContact O-CA 3.44Å; K853-K859 PolarHBondContact NZ-O 3.4Å; K853-L890 HydrophobicContact CB-CD2 4.27Å; K853-L890 HydrophobicContact CG-CD1 4.21Å; K853-L890 HydrophobicContact CG-CD2 3.94Å; K853-E894 HydrophobicContact CD-CB 4.29Å; K853-E894 WeakPolarHBondContact CD-O 3.27Å; K853-E894 WeakPolarHBondContact CE-O 3.37Å; K853-E894 PolarHBondContact NZ-O 3.41Å; K853-L896 HydrophobicContact CB-CD2 4.43Å; K853-L896 HydrophobicContact CB-CG 4.29Å
854	I	92.4	Very high	94.2	Very high	37 Å²	37	33.8 Å²	33.8	19%	0.19	18%	0.175	C	C	.	.	H	α-helix	trans	-68.8	-45.2	171.5	-67.4	163.8	0	0	0	110.7	Q574 L850 Q851 L896 A904	Q574-I854 HydrophobicContact CG-CG2 3.94Å; L850-I854 HydrophobicContact CD1-CD1 4.17Å; L850-I854 HydrophobicContact CD1-CG1 4.37Å; L850-I854 HydrophobicContact CG-CD1 4.05Å; L850-I854 VanDerWaalsContact O-CG1 3.29Å; L850-I854 WeakPolarHBondContact O-CG1 3.01Å; L850-I854 PolarHBondContact O-N 2.98Å; Q851-I854 PolarHBondContact O-N 3.44Å; I854-L896 HydrophobicContact CG1-CD1 4.17Å; I854-A904 HydrophobicContact CD1-CB 3.53Å; I854-A904 HydrophobicContact CG1-CB 3.73Å
855	H	92.4	Very high	94.5	Very high	29 Å²	29	32.1 Å²	32.1	13%	0.134	16%	0.164	C	C	.	.	H	α-helix	trans	-81.1	-36.9	-174.5	-78.4	-75.7	0	0	0	114	L570 Q574 F599 L603 Q851 A852	L570-H855 PolarHBondContact O-CE1 3.49Å; Q574-H855 WeakPolarHBondContact CG-CE1 3.14Å; F599-H855 AromaticContact CE1-CD2 3.74Å; F599-H855 AromaticContact CZ-CD2 3.95Å; L603-H855 HydrophobicContact CD1-CB 4.4Å; L603-H855 HydrophobicContact CD2-CB 3.87Å; Q851-H855 PolarHBondContact O-CD2 2.88Å; Q851-H855 VanDerWaalsContact O-CD2 3.23Å; Q851-H855 PolarHBondContact O-N 2.99Å; A852-H855 PolarHBondContact O-N 3.3Å
856	M	92.3	Very high	94.6	Very high	56 Å²	56	34.9 Å²	34.9	28%	0.276	18%	0.184	S	C	.	.			trans	-136.7	68.2	-174.2	-59.3	-60.7	-76.8	0	0	110.4	L603 A852 E858 K859 F864	L603-M856 HydrophobicContact CD2-CG 4.43Å; A852-M856 CarbonylContact O-C 3.48Å; A852-M856 WeakPolarHBondContact O-CA 3.15Å; A852-M856 PolarHBondContact O-N 3.27Å; M856-E858 VanDerWaalsContact C-OE2 3.3Å; M856-E858 WeakPolarHBondContact CE-OE1 3.47Å; M856-E858 PolarHBondContact O-N 2.95Å; M856-E858 VanDerWaalsContact O-N 3.12Å; M856-K859 PolarHBondContact O-N 3.25Å; M856-F864 HydrophobicContact CB-CD2 3.93Å; M856-F864 HydrophobicContact CB-CE2 4.24Å; M856-F864 HydrophobicContact CG-CD2 3.67Å; M856-F864 HydrophobicContact CG-CE2 3.51Å
857	P	91.3	Very high	94.7	Very high	52 Å²	52	38.9 Å²	38.9	34%	0.338	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.8	-173.4	24.6	-34.8	0	0	0	113.7	K853	K853-P857 WeakPolarHBondContact CE-O 3.37Å; K853-P857 PolarHBondContact NZ-O 3.37Å; K853-P857 WeakPolarHBondContact O-CA 3.44Å
858	E	91.4	Very high	94.8	Very high	107 Å²	107	36 Å²	36	50%	0.5	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-15	-178.1	79.6	-68.5	165.9	0	0	114.4	M856	M856-E858 VanDerWaalsContact C-OE2 3.3Å; M856-E858 WeakPolarHBondContact CE-OE1 3.47Å; M856-E858 PolarHBondContact O-N 2.95Å; M856-E858 VanDerWaalsContact O-N 3.12Å
859	K	93.6	Very high	94.8	Very high	47 Å²	47	36.5 Å²	36.5	20%	0.204	19%	0.19	C	C	.	.	S	Bend	trans	-101.5	149.5	179.4	-68.6	-168.9	-178.9	68.5	0	111.2	K853 M856 E863	K853-K859 PolarHBondContact NZ-O 3.4Å; M856-K859 PolarHBondContact O-N 3.25Å; K859-E863 HydrophobicContact CB-CB 4.48Å
860	T	95.9	Very high	94.6	Very high	45 Å²	45	38.2 Å²	38.2	28%	0.276	20%	0.199	S	C	.	.			trans	-69.1	155.4	166.5	65.8	0	0	0	0	110.2	V862 E863 F864 E894	T860-V862 PolarHBondContact O-N 3.02Å; T860-E863 PolarHBondContact O-N 2.72Å; T860-E863 VanDerWaalsContact OG1-CB 3.31Å; T860-E863 WeakPolarHBondContact OG1-CB 3.32Å; T860-E863 WeakPolarHBondContact OG1-CG 3.33Å; T860-E863 PolarHBondContact OG1-N 2.95Å; T860-E863 VanDerWaalsContact OG1-N 3.14Å; T860-F864 PolarHBondContact O-N 3.18Å; T860-E894 WeakPolarHBondContact CA-OE2 3.38Å; T860-E894 WeakPolarHBondContact CB-OE2 3.21Å
861	A	96.1	Very high	94.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-57.7	-40.4	176.3	0	0	0	0	0	111.4	V849 F864 L865 V877 V881 E894	V849-A861 HydrophobicContact CB-CB 4.42Å; V849-A861 HydrophobicContact CG1-CB 3.75Å; V849-A861 HydrophobicContact CG2-CB 4.05Å; A861-F864 PolarHBondContact O-N 3.05Å; A861-L865 VanDerWaalsContact O-CB 3.3Å; A861-L865 WeakPolarHBondContact O-CB 3.14Å; A861-L865 WeakPolarHBondContact O-CG 3.38Å; A861-L865 PolarHBondContact O-N 2.91Å; A861-V877 HydrophobicContact CB-CG1 3.82Å; A861-V881 HydrophobicContact CB-CG2 3.69Å; A861-E894 PolarHBondContact N-OE2 2.92Å
862	V	96.8	Very high	94.6	Very high	40 Å²	40	38.9 Å²	38.9	24%	0.242	21%	0.209	C	C	.	.	H	α-helix	trans	-64	-47.1	176.8	177.6	0	0	0	0	111.2	T860 F864 S866 I874 V877	T860-V862 PolarHBondContact O-N 3.02Å; V862-F864 VanDerWaalsContact C-N 3.27Å; V862-F864 PolarHBondContact O-N 3.2Å; V862-S866 WeakPolarHBondContact O-CB 3.31Å; V862-S866 PolarHBondContact O-N 3.43Å; V862-S866 PolarHBondContact O-OG 3.01Å; V862-I874 HydrophobicContact CG1-CG2 4.3Å; V862-I874 HydrophobicContact CG2-CG2 4.34Å; V862-V877 HydrophobicContact CG2-CB 4.21Å; V862-V877 HydrophobicContact CG2-CG1 3.74Å
863	E	96.1	Very high	94.5	Very high	103 Å²	103	43.2 Å²	43.2	48%	0.481	23%	0.232	S	C	.	.	H	α-helix	trans	-63.7	-33.1	177.7	-76.9	170.3	-164.5	0	0	113.2	K859 T860 S866 K867	K859-E863 HydrophobicContact CB-CB 4.48Å; T860-E863 PolarHBondContact O-N 2.72Å; T860-E863 VanDerWaalsContact OG1-CB 3.31Å; T860-E863 WeakPolarHBondContact OG1-CB 3.32Å; T860-E863 WeakPolarHBondContact OG1-CG 3.33Å; T860-E863 PolarHBondContact OG1-N 2.95Å; T860-E863 VanDerWaalsContact OG1-N 3.14Å; E863-S866 PolarHBondContact O-OG 3.29Å; E863-S866 VanDerWaalsContact O-OG 3.13Å; E863-K867 WeakPolarHBondContact O-CE 3.35Å
864	F	96.3	Very high	94.5	Very high	6 Å²	6	47.6 Å²	47.6	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-75.9	-53.5	177.5	-177.9	-90.9	0	0	0	111.3	F599 I602 L603 A852 M856 T860 A861 V862 S866 K867	F599-F864 AromaticContact CD2-CE1 3.69Å; F599-F864 HydrophobicContact CD2-CE1 3.69Å; F599-F864 HydrophobicContact CD2-CZ 4.43Å; F599-F864 HydrophobicContact CE2-CD1 4.1Å; F599-F864 AromaticContact CE2-CE1 3.26Å; F599-F864 HydrophobicContact CE2-CE1 3.26Å; F599-F864 AromaticContact CE2-CZ 3.93Å; F599-F864 HydrophobicContact CE2-CZ 3.93Å; F599-F864 AromaticContact CZ-CE1 3.8Å; F599-F864 HydrophobicContact CZ-CE1 3.8Å; F599-F864 HydrophobicContact CZ-CZ 4.01Å; I602-F864 HydrophobicContact CB-CE1 4.27Å; I602-F864 HydrophobicContact CB-CZ 3.94Å; I602-F864 HydrophobicContact CD1-CD1 4.41Å; I602-F864 HydrophobicContact CD1-CE1 3.89Å; I602-F864 HydrophobicContact CD1-CZ 4.43Å; I602-F864 HydrophobicContact CG2-CD1 4.47Å; I602-F864 HydrophobicContact CG2-CD2 4.22Å; I602-F864 HydrophobicContact CG2-CE1 3.89Å; I602-F864 HydrophobicContact CG2-CE2 3.62Å; I602-F864 HydrophobicContact CG2-CZ 3.45Å; I602-F864 VanDerWaalsContact CG2-CZ 3.45Å; L603-F864 HydrophobicContact CD2-CE2 3.76Å; L603-F864 HydrophobicContact CD2-CZ 3.61Å; L603-F864 HydrophobicContact CG-CZ 4.17Å; A852-F864 HydrophobicContact CB-CB 4.36Å; A852-F864 HydrophobicContact CB-CD1 3.53Å; A852-F864 HydrophobicContact CB-CE1 4.06Å; A852-F864 HydrophobicContact CB-CG 4.01Å; M856-F864 HydrophobicContact CB-CD2 3.93Å; M856-F864 HydrophobicContact CB-CE2 4.24Å; M856-F864 HydrophobicContact CG-CD2 3.67Å; M856-F864 HydrophobicContact CG-CE2 3.51Å; T860-F864 PolarHBondContact O-N 3.18Å; A861-F864 PolarHBondContact O-N 3.05Å; V862-F864 VanDerWaalsContact C-N 3.27Å; V862-F864 PolarHBondContact O-N 3.2Å; F864-S866 VanDerWaalsContact C-N 3.34Å; F864-S866 PolarHBondContact O-N 3.08Å; F864-K867 WeakPolarHBondContact O-CB 3.49Å; F864-K867 PolarHBondContact O-N 2.93Å
865	L	96.8	Very high	94.5	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-73.1	-23.4	-174.9	-65.2	177	0	0	0	113.4	F599 I602 L848 V849 A861 K867 A868 P872 V877	F599-L865 HydrophobicContact CD2-CD2 4.28Å; I602-L865 HydrophobicContact CD1-CD2 4.43Å; L848-L865 HydrophobicContact CD2-CD1 4.29Å; L848-L865 HydrophobicContact CD2-CD2 3.55Å; L848-L865 HydrophobicContact CG-CD2 3.84Å; V849-L865 HydrophobicContact CG2-CD1 4.12Å; A861-L865 VanDerWaalsContact O-CB 3.3Å; A861-L865 WeakPolarHBondContact O-CB 3.14Å; A861-L865 WeakPolarHBondContact O-CG 3.38Å; A861-L865 PolarHBondContact O-N 2.91Å; L865-K867 PolarHBondContact O-N 3.35Å; L865-K867 VanDerWaalsContact O-N 3.11Å; L865-A868 WeakPolarHBondContact O-CB 3.37Å; L865-A868 PolarHBondContact O-N 3.08Å; L865-P872 HydrophobicContact CB-CG 3.95Å; L865-P872 WeakPolarHBondContact O-CD 3.49Å; L865-V877 HydrophobicContact CD1-CG1 4.04Å; L865-V877 HydrophobicContact CD1-CG2 3.97Å
866	S	96.5	Very high	94.6	Very high	63 Å²	63	52.6 Å²	52.6	44%	0.441	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-16.4	170.7	57.1	0	0	0	0	113.5	V862 E863 F864 A868	V862-S866 WeakPolarHBondContact O-CB 3.31Å; V862-S866 PolarHBondContact O-N 3.43Å; V862-S866 PolarHBondContact O-OG 3.01Å; E863-S866 PolarHBondContact O-OG 3.29Å; E863-S866 VanDerWaalsContact O-OG 3.13Å; F864-S866 VanDerWaalsContact C-N 3.34Å; F864-S866 PolarHBondContact O-N 3.08Å; S866-A868 VanDerWaalsContact C-N 3.32Å
867	K	95.9	Very high	94.8	Very high	96 Å²	96	50.1 Å²	50.1	42%	0.417	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-0.1	174.1	-59.8	174.6	-174.5	168	0	113.1	I602 Y631 E863 F864 L865	I602-K867 HydrophobicContact CG2-CB 4.02Å; Y631-K867 WeakPolarHBondContact CE2-O 3.45Å; Y631-K867 VanDerWaalsContact CZ-O 3.23Å; Y631-K867 PolarHBondContact OH-O 3.33Å; E863-K867 WeakPolarHBondContact O-CE 3.35Å; F864-K867 WeakPolarHBondContact O-CB 3.49Å; F864-K867 PolarHBondContact O-N 2.93Å; L865-K867 PolarHBondContact O-N 3.35Å; L865-K867 VanDerWaalsContact O-N 3.11Å
868	A	95.9	Very high	95	Very high	8 Å²	8	50.7 Å²	50.7	7%	0.066	27%	0.267	C	S	.	.	S	Bend	trans	-57.8	160.9	172.7	0	0	0	0	0	111.4	I602 I840 L865 S866 D870	I602-A868 HydrophobicContact CD1-CB 3.87Å; I602-A868 HydrophobicContact CG1-CB 4.35Å; I840-A868 HydrophobicContact CD1-CB 3.86Å; L865-A868 WeakPolarHBondContact O-CB 3.37Å; L865-A868 PolarHBondContact O-N 3.08Å; S866-A868 VanDerWaalsContact C-N 3.32Å; A868-D870 WeakPolarHBondContact CB-O 3.34Å; A868-D870 PolarHBondContact O-N 2.85Å
869	V	94.2	Very high	95	Very high	19 Å²	19	48.7 Å²	48.7	12%	0.115	26%	0.258	C	S	.	.	S	Bend	trans	-58.2	-41.8	174.7	177.6	0	0	0	0	110.6	L601 R627 F628 Y631	L601-V869 HydrophobicContact CD1-CG2 3.95Å; R627-V869 HydrophobicContact CG-CG1 3.93Å; F628-V869 HydrophobicContact CD1-CG2 4.38Å; F628-V869 HydrophobicContact CE1-CG1 4.36Å; F628-V869 HydrophobicContact CE1-CG2 4.23Å; Y631-V869 HydrophobicContact CD1-CG2 4.05Å; Y631-V869 HydrophobicContact CD2-CG2 4.13Å; Y631-V869 HydrophobicContact CE1-CG2 4.14Å; Y631-V869 HydrophobicContact CE2-CG2 4.21Å; Y631-V869 HydrophobicContact CG-CG2 4.04Å
870	D	94	Very high	95.1	Very high	36 Å²	36	46.6 Å²	46.6	19%	0.193	25%	0.249	C	C	.	.	S	Bend	trans	-122.6	113.4	166.3	-69.9	-74.2	0	0	0	107.8	R593 R627 P838 L841 A868	R593-D870 IonicContact CZ-OD2 2.72Å; R593-D870 VanDerWaalsContact CZ-OD2 3.24Å; R593-D870 IonicContact NH1-OD2 3.99Å; R593-D870 PolarHBondContact NH1-OD2 3.03Å; R593-D870 IonicContact NH2-OD2 4Å; R593-D870 PolarHBondContact NH2-OD2 2.9Å; R627-D870 IonicContact NH1-OD1 2.77Å; R627-D870 PolarHBondContact NH1-OD1 3.15Å; R627-D870 IonicContact NH1-OD2 3.69Å; R627-D870 PolarHBondContact NH1-OD2 3.03Å; P838-D870 HydrophobicContact CG-CB 4.46Å; L841-D870 HydrophobicContact CD1-CB 4.17Å; L841-D870 HydrophobicContact CD2-CB 4.42Å; A868-D870 WeakPolarHBondContact CB-O 3.34Å; A868-D870 PolarHBondContact O-N 2.85Å
871	S	95	Very high	95.2	Very high	62 Å²	62	44.8 Å²	44.8	43%	0.434	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-64.5	130	-179.7	178.4	0	0	0	0	110.2	L841	L841-S871 WeakPolarHBondContact CD2-O 3.3Å
872	P	94.5	Very high	95.1	Very high	5 Å²	5	48.5 Å²	48.5	3%	0.032	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-62	161.4	169.4	27	-32.7	0	0	0	111.2	I840 L841 L845 L865 I874 V877	I840-P872 HydrophobicContact CD1-CG 4.45Å; I840-P872 HydrophobicContact CG1-CB 4.39Å; I840-P872 HydrophobicContact CG1-CG 4.34Å; L841-P872 HydrophobicContact CD2-CB 4.47Å; L845-P872 HydrophobicContact CD1-CB 3.66Å; L845-P872 HydrophobicContact CD1-CG 4.13Å; L865-P872 HydrophobicContact CB-CG 3.95Å; L865-P872 WeakPolarHBondContact O-CD 3.49Å; P872-I874 PolarHBondContact O-N 3.28Å; P872-V877 HydrophobicContact CB-CG2 4.12Å; P872-V877 HydrophobicContact CG-CG2 3.67Å
873	N	92.2	Very high	95	Very high	91 Å²	91	47.8 Å²	47.8	49%	0.487	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-61.5	127.8	171.9	-175.8	-22.1	0	0	0	109.3	K875 A876 V877	N873-K875 PolarHBondContact O-N 3.36Å; N873-K875 WeakPolarHBondContact OD1-CB 3.47Å; N873-K875 PolarHBondContact OD1-N 2.9Å; N873-A876 HydrophobicContact CB-CB 4.25Å; N873-A876 WeakPolarHBondContact O-CA 3.26Å; N873-A876 WeakPolarHBondContact O-CB 3.23Å; N873-A876 PolarHBondContact O-N 2.84Å; N873-V877 PolarHBondContact O-N 3.32Å
874	I	94.9	Very high	95	Very high	97 Å²	97	42.9 Å²	42.9	50%	0.497	23%	0.229	S	C	.	.	H	α-helix	trans	-52.3	-41.9	178.9	-59.4	172.5	0	0	0	110.7	V862 P872 A876 V877 D878	V862-I874 HydrophobicContact CG1-CG2 4.3Å; V862-I874 HydrophobicContact CG2-CG2 4.34Å; P872-I874 PolarHBondContact O-N 3.28Å; I874-A876 VanDerWaalsContact C-N 3.28Å; I874-A876 PolarHBondContact O-N 3.39Å; I874-V877 WeakPolarHBondContact O-CB 3.27Å; I874-V877 PolarHBondContact O-N 3.2Å; I874-D878 VanDerWaalsContact O-CG 3.31Å; I874-D878 PolarHBondContact O-N 3.03Å
875	K	93.1	Very high	95	Very high	151 Å²	151	44.6 Å²	44.6	66%	0.657	24%	0.237	S	C	*	.	H	α-helix	trans	-60.5	-35.5	177.5	-63.7	-174.9	178.2	-175.9	0	113.1	N873 E879	N873-K875 PolarHBondContact O-N 3.36Å; N873-K875 WeakPolarHBondContact OD1-CB 3.47Å; N873-K875 PolarHBondContact OD1-N 2.9Å; K875-E879 WeakPolarHBondContact O-CB 3.45Å; K875-E879 VanDerWaalsContact O-CG 3.28Å; K875-E879 WeakPolarHBondContact O-CG 3.32Å; K875-E879 PolarHBondContact O-N 3.25Å
876	A	93	Very high	94.8	Very high	21 Å²	21	47.9 Å²	47.9	17%	0.174	25%	0.252	C	S	.	.	H	α-helix	trans	-71.1	-34.9	177.4	0	0	0	0	0	111.5	L788 L845 N873 I874 A880	L788-A876 HydrophobicContact CD1-CB 4.38Å; L788-A876 HydrophobicContact CD2-CB 3.8Å; L845-A876 HydrophobicContact CD1-CB 4.06Å; N873-A876 HydrophobicContact CB-CB 4.25Å; N873-A876 WeakPolarHBondContact O-CA 3.26Å; N873-A876 WeakPolarHBondContact O-CB 3.23Å; N873-A876 PolarHBondContact O-N 2.84Å; I874-A876 VanDerWaalsContact C-N 3.28Å; I874-A876 PolarHBondContact O-N 3.39Å; A876-A880 WeakPolarHBondContact O-CB 3.33Å; A876-A880 PolarHBondContact O-N 3.46Å
877	V	96.4	Very high	94.7	Very high	3 Å²	3	45 Å²	45	2%	0.018	23%	0.231	C	C	.	.	H	α-helix	trans	-68.5	-45.9	173.5	-177.7	0	0	0	0	110.5	L845 V849 A861 V862 L865 P872 N873 I874 E879 A880 V881	L845-V877 HydrophobicContact CD1-CG2 3.86Å; V849-V877 HydrophobicContact CG2-CG1 4.29Å; A861-V877 HydrophobicContact CB-CG1 3.82Å; V862-V877 HydrophobicContact CG2-CB 4.21Å; V862-V877 HydrophobicContact CG2-CG1 3.74Å; L865-V877 HydrophobicContact CD1-CG1 4.04Å; L865-V877 HydrophobicContact CD1-CG2 3.97Å; P872-V877 HydrophobicContact CB-CG2 4.12Å; P872-V877 HydrophobicContact CG-CG2 3.67Å; N873-V877 PolarHBondContact O-N 3.32Å; I874-V877 WeakPolarHBondContact O-CB 3.27Å; I874-V877 PolarHBondContact O-N 3.2Å; V877-E879 PolarHBondContact O-N 3.14Å; V877-A880 WeakPolarHBondContact O-CB 3.46Å; V877-A880 PolarHBondContact O-N 3.44Å; V877-A880 VanDerWaalsContact O-N 3.14Å; V877-V881 HydrophobicContact CG1-CG2 4.48Å; V877-V881 WeakPolarHBondContact O-CG2 3.21Å; V877-V881 PolarHBondContact O-N 2.77Å
878	D	95.6	Very high	94.6	Very high	65 Å²	65	41.6 Å²	41.6	35%	0.348	22%	0.224	S	C	.	.	H	α-helix	trans	-61	-44.9	178.7	-66.7	-21.9	0	0	0	111.4	I874 A880 V881 I882	I874-D878 VanDerWaalsContact O-CG 3.31Å; I874-D878 PolarHBondContact O-N 3.03Å; D878-A880 VanDerWaalsContact C-N 3.27Å; D878-A880 PolarHBondContact O-N 3.32Å; D878-V881 PolarHBondContact O-N 2.89Å; D878-I882 WeakPolarHBondContact O-CB 3.4Å; D878-I882 VanDerWaalsContact O-CG1 3.23Å; D878-I882 WeakPolarHBondContact O-CG1 3.42Å; D878-I882 PolarHBondContact O-N 2.79Å
879	E	92.5	Very high	94.6	Very high	65 Å²	65	41.2 Å²	41.2	30%	0.304	22%	0.221	S	C	.	.	H	α-helix	trans	-61.2	-36.6	175.5	-74.3	-64.3	148.3	0	0	112.3	K791 K875 V877 L883	K791-E879 WeakPolarHBondContact CE-OE2 3.21Å; K791-E879 IonicContact NZ-OE2 2.71Å; K791-E879 PolarHBondContact NZ-OE2 3.23Å; K875-E879 WeakPolarHBondContact O-CB 3.45Å; K875-E879 VanDerWaalsContact O-CG 3.28Å; K875-E879 WeakPolarHBondContact O-CG 3.32Å; K875-E879 PolarHBondContact O-N 3.25Å; V877-E879 PolarHBondContact O-N 3.14Å; E879-L883 PolarHBondContact O-N 3.44Å
880	A	95.1	Very high	94.7	Very high	2 Å²	2	40.6 Å²	40.6	2%	0.017	22%	0.217	C	C	.	.	H	α-helix	trans	-68.1	-40.5	175.5	0	0	0	0	0	112.4	L845 E846 V849 A876 V877 D878 L883 L884	L845-A880 HydrophobicContact CB-CB 3.95Å; E846-A880 HydrophobicContact CB-CB 4.36Å; E846-A880 HydrophobicContact CG-CB 3.74Å; V849-A880 HydrophobicContact CG2-CB 3.85Å; A876-A880 WeakPolarHBondContact O-CB 3.33Å; A876-A880 PolarHBondContact O-N 3.46Å; V877-A880 WeakPolarHBondContact O-CB 3.46Å; V877-A880 PolarHBondContact O-N 3.44Å; V877-A880 VanDerWaalsContact O-N 3.14Å; D878-A880 VanDerWaalsContact C-N 3.27Å; D878-A880 PolarHBondContact O-N 3.32Å; A880-L883 PolarHBondContact O-N 3Å; A880-L884 WeakPolarHBondContact O-CG 3.37Å; A880-L884 PolarHBondContact O-N 3.48Å; A880-L884 VanDerWaalsContact O-N 3.07Å
881	V	97.5	Very high	94.7	Very high	8 Å²	8	41 Å²	41	5%	0.048	22%	0.22	C	C	.	.	H	α-helix	trans	-63	-48.1	173.2	171	0	0	0	0	110.4	V849 A861 V877 D878 L883 L884 Q885 E894	V849-V881 HydrophobicContact CG1-CG2 3.84Å; V849-V881 HydrophobicContact CG2-CG2 4.41Å; A861-V881 HydrophobicContact CB-CG2 3.69Å; V877-V881 HydrophobicContact CG1-CG2 4.48Å; V877-V881 WeakPolarHBondContact O-CG2 3.21Å; V877-V881 PolarHBondContact O-N 2.77Å; D878-V881 PolarHBondContact O-N 2.89Å; V881-L883 VanDerWaalsContact C-N 3.3Å; V881-L883 PolarHBondContact O-N 3.49Å; V881-L884 PolarHBondContact O-N 2.83Å; V881-L884 VanDerWaalsContact O-N 3.15Å; V881-Q885 HydrophobicContact CG1-CG 4.34Å; V881-Q885 WeakPolarHBondContact O-CG 3.44Å; V881-Q885 PolarHBondContact O-N 3.47Å; V881-E894 HydrophobicContact CG1-CG 3.88Å
882	I	95	Very high	94.7	Very high	77 Å²	77	45.9 Å²	45.9	40%	0.395	24%	0.235	S	C	.	.	H	α-helix	trans	-57.8	-43.8	177.8	-70.1	164.3	0	0	0	110.3	D878 Q885 E886	D878-I882 WeakPolarHBondContact O-CB 3.4Å; D878-I882 VanDerWaalsContact O-CG1 3.23Å; D878-I882 WeakPolarHBondContact O-CG1 3.42Å; D878-I882 PolarHBondContact O-N 2.79Å; I882-Q885 PolarHBondContact O-N 3.37Å; I882-E886 WeakPolarHBondContact O-CB 3.5Å; I882-E886 PolarHBondContact O-N 2.87Å
883	L	93.7	Very high	94.7	Very high	25 Å²	25	53.5 Å²	53.5	13%	0.131	26%	0.263	C	S	.	.	H	α-helix	trans	-61.5	-47.4	176.6	-177.6	65.1	0	0	0	111.4	E846 E879 A880 V881 Q885 E886 I887	E846-L883 HydrophobicContact CG-CB 4.29Å; E846-L883 HydrophobicContact CG-CD2 3.62Å; E846-L883 HydrophobicContact CG-CG 4.44Å; E879-L883 PolarHBondContact O-N 3.44Å; A880-L883 PolarHBondContact O-N 3Å; V881-L883 VanDerWaalsContact C-N 3.3Å; V881-L883 PolarHBondContact O-N 3.49Å; L883-Q885 VanDerWaalsContact C-N 3.25Å; L883-Q885 PolarHBondContact O-N 3.07Å; L883-E886 PolarHBondContact O-N 3.46Å; L883-I887 HydrophobicContact CD1-CG2 4.27Å; L883-I887 WeakPolarHBondContact O-CG1 3.44Å; L883-I887 PolarHBondContact O-N 2.93Å
884	L	96.8	Very high	94.8	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.5	-32	178.8	-70.8	176.4	0	0	0	112.6	E846 V849 L850 A880 V881 I887 G888 V889 L890 P910	E846-L884 HydrophobicContact CB-CD2 4.18Å; E846-L884 HydrophobicContact CB-CG 4.15Å; V849-L884 HydrophobicContact CB-CD1 3.8Å; V849-L884 HydrophobicContact CG1-CD1 3.5Å; L850-L884 HydrophobicContact CB-CD1 4.31Å; A880-L884 WeakPolarHBondContact O-CG 3.37Å; A880-L884 PolarHBondContact O-N 3.48Å; A880-L884 VanDerWaalsContact O-N 3.07Å; V881-L884 PolarHBondContact O-N 2.83Å; V881-L884 VanDerWaalsContact O-N 3.15Å; L884-I887 HydrophobicContact CD2-CD1 4.12Å; L884-G888 PolarHBondContact O-N 3.15Å; L884-V889 HydrophobicContact CB-CB 4.31Å; L884-V889 HydrophobicContact CD2-CB 4.13Å; L884-V889 HydrophobicContact CD2-CG1 4.09Å; L884-V889 HydrophobicContact CD2-CG2 4.4Å; L884-V889 WeakPolarHBondContact O-CA 3.31Å; L884-V889 WeakPolarHBondContact O-CB 3.4Å; L884-V889 PolarHBondContact O-N 3.12Å; L884-L890 HydrophobicContact CB-CB 4.33Å; L884-L890 HydrophobicContact CB-CD1 3.81Å; L884-L890 HydrophobicContact CB-CG 3.86Å; L884-L890 HydrophobicContact CD1-CD1 3.76Å; L884-L890 HydrophobicContact CD1-CG 4.26Å; L884-L890 HydrophobicContact CG-CD1 4.48Å; L884-L890 PolarHBondContact O-N 3.45Å; L884-L890 VanDerWaalsContact O-N 3.11Å; L884-P910 HydrophobicContact CD2-CB 3.86Å; L884-P910 HydrophobicContact CD2-CG 3.89Å
885	Q	96	Very high	94.9	Very high	43 Å²	43	51.2 Å²	51.2	20%	0.201	24%	0.244	C	C	.	.	H	α-helix	trans	-70.3	-44.5	171.6	-71.3	172	-21.3	0	0	111.6	V881 I882 L883 I887 G888 L890 D891	V881-Q885 HydrophobicContact CG1-CG 4.34Å; V881-Q885 WeakPolarHBondContact O-CG 3.44Å; V881-Q885 PolarHBondContact O-N 3.47Å; I882-Q885 PolarHBondContact O-N 3.37Å; L883-Q885 VanDerWaalsContact C-N 3.25Å; L883-Q885 PolarHBondContact O-N 3.07Å; Q885-I887 VanDerWaalsContact C-N 3.32Å; Q885-I887 PolarHBondContact O-N 3.38Å; Q885-G888 PolarHBondContact O-N 3.46Å; Q885-L890 WeakPolarHBondContact CA-O 3.42Å; Q885-L890 HydrophobicContact CG-CB 3.95Å; Q885-D891 WeakPolarHBondContact CG-O 3.36Å; Q885-D891 PolarHBondContact NE2-O 3.09Å
886	E	92.1	Very high	95	Very high	68 Å²	68	45.8 Å²	45.8	32%	0.318	22%	0.221	S	C	.	.	H	α-helix	trans	-61	-39.1	178.7	-175.5	174.9	-153.6	0	0	111.8	I882 L883 G888 K1080	I882-E886 WeakPolarHBondContact O-CB 3.5Å; I882-E886 PolarHBondContact O-N 2.87Å; L883-E886 PolarHBondContact O-N 3.46Å; E886-G888 VanDerWaalsContact C-N 3.27Å; E886-G888 PolarHBondContact O-N 3.4Å; E886-K1080 IonicContact OE1-NZ 3.3Å; E886-K1080 PolarHBondContact OE1-NZ 3.35Å
887	I	94.2	Very high	95	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.01	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-0.2	176	70.4	172.9	0	0	0	113.5	L883 L884 Q885 V889 P910 R911 K914	L883-I887 HydrophobicContact CD1-CG2 4.27Å; L883-I887 WeakPolarHBondContact O-CG1 3.44Å; L883-I887 PolarHBondContact O-N 2.93Å; L884-I887 HydrophobicContact CD2-CD1 4.12Å; Q885-I887 VanDerWaalsContact C-N 3.32Å; Q885-I887 PolarHBondContact O-N 3.38Å; I887-V889 HydrophobicContact CD1-CG2 3.75Å; I887-V889 HydrophobicContact CG1-CB 4.32Å; I887-V889 HydrophobicContact CG1-CG2 3.8Å; I887-P910 HydrophobicContact CD1-CB 3.75Å; I887-R911 HydrophobicContact CD1-CG 4.36Å; I887-R911 HydrophobicContact CG2-CG 4.46Å; I887-K914 HydrophobicContact CB-CD 4.44Å; I887-K914 PolarHBondContact O-NZ 3.21Å
888	G	93.9	Very high	94.9	Very high	26 Å²	26	48.3 Å²	48.3	27%	0.268	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.7	15.1	174.9	0	0	0	0	0	115.6	L884 Q885 E886 T897	L884-G888 PolarHBondContact O-N 3.15Å; Q885-G888 PolarHBondContact O-N 3.46Å; E886-G888 VanDerWaalsContact C-N 3.27Å; E886-G888 PolarHBondContact O-N 3.4Å; G888-T897 WeakPolarHBondContact O-CB 3.48Å; G888-T897 WeakPolarHBondContact O-CG2 3.38Å; G888-T897 PolarHBondContact O-OG1 2.95Å
889	V	96.1	Very high	94.8	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.222	C	C	.	.	S	Bend	trans	-76.8	-40.6	176.1	170	0	0	0	0	111.4	L850 L884 I887 L896 T897 G900 L903	L850-V889 HydrophobicContact CD1-CG1 3.85Å; L884-V889 HydrophobicContact CB-CB 4.31Å; L884-V889 HydrophobicContact CD2-CB 4.13Å; L884-V889 HydrophobicContact CD2-CG1 4.09Å; L884-V889 HydrophobicContact CD2-CG2 4.4Å; L884-V889 WeakPolarHBondContact O-CA 3.31Å; L884-V889 WeakPolarHBondContact O-CB 3.4Å; L884-V889 PolarHBondContact O-N 3.12Å; I887-V889 HydrophobicContact CD1-CG2 3.75Å; I887-V889 HydrophobicContact CG1-CB 4.32Å; I887-V889 HydrophobicContact CG1-CG2 3.8Å; V889-L896 HydrophobicContact CG1-CD2 4.25Å; V889-T897 PolarHBondContact O-N 3.46Å; V889-T897 PolarHBondContact O-OG1 2.64Å; V889-G900 WeakPolarHBondContact O-CA 3.14Å; V889-L903 HydrophobicContact CG2-CD1 3.75Å; V889-L903 HydrophobicContact CG2-CD2 4.49Å
890	L	96.8	Very high	94.9	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.026	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-113	149.9	177.3	-62.3	-178.1	0	0	0	111.1	V849 K853 L884 Q885 Y895 L896	V849-L890 HydrophobicContact CG1-CD1 4.03Å; K853-L890 HydrophobicContact CB-CD2 4.27Å; K853-L890 HydrophobicContact CG-CD1 4.21Å; K853-L890 HydrophobicContact CG-CD2 3.94Å; L884-L890 HydrophobicContact CB-CB 4.33Å; L884-L890 HydrophobicContact CB-CD1 3.81Å; L884-L890 HydrophobicContact CB-CG 3.86Å; L884-L890 HydrophobicContact CD1-CD1 3.76Å; L884-L890 HydrophobicContact CD1-CG 4.26Å; L884-L890 HydrophobicContact CG-CD1 4.48Å; L884-L890 PolarHBondContact O-N 3.45Å; L884-L890 VanDerWaalsContact O-N 3.11Å; Q885-L890 WeakPolarHBondContact CA-O 3.42Å; Q885-L890 HydrophobicContact CG-CB 3.95Å; L890-Y895 CarbonylContact C-O 3.6Å; L890-Y895 VanDerWaalsContact CA-O 3.32Å; L890-Y895 WeakPolarHBondContact CA-O 3.4Å; L890-L896 HydrophobicContact CD2-CD2 3.79Å; L890-L896 HydrophobicContact CD2-CG 4.28Å
891	D	95.1	Very high	94.8	Very high	46 Å²	46	45 Å²	45	25%	0.246	22%	0.218	C	C	.	.			trans	-85.7	179.3	167.2	75.5	7.4	0	0	0	111.7	Q885 R893 E894 Y895 T897	Q885-D891 WeakPolarHBondContact CG-O 3.36Å; Q885-D891 PolarHBondContact NE2-O 3.09Å; D891-R893 PolarHBondContact O-N 3.21Å; D891-R893 VanDerWaalsContact O-N 3.12Å; D891-R893 VanDerWaalsContact OD1-C 3.23Å; D891-R893 VanDerWaalsContact OD1-CA 3.28Å; D891-R893 WeakPolarHBondContact OD1-CA 3.22Å; D891-R893 WeakPolarHBondContact OD1-CB 3.49Å; D891-R893 PolarHBondContact OD1-N 3.03Å; D891-E894 PolarHBondContact O-N 3.43Å; D891-E894 PolarHBondContact OD1-N 3.34Å; D891-Y895 PolarHBondContact N-O 3.22Å; D891-Y895 PolarHBondContact OD1-N 3.15Å; D891-T897 HydrophobicContact CB-CG2 4.26Å
892	Q	93.8	Very high	94.5	Very high	164 Å²	164	44.8 Å²	44.8	77%	0.766	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-14.7	179.3	-65.5	-62.7	-19.2	0	0	113.9
893	R	94.4	Very high	94.4	Very high	164 Å²	164	41.1 Å²	41.1	62%	0.619	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.6	10.8	176.3	-63	177.2	-179.2	178.5	0.8	111.9	D891 Y895	D891-R893 PolarHBondContact O-N 3.21Å; D891-R893 VanDerWaalsContact O-N 3.12Å; D891-R893 VanDerWaalsContact OD1-C 3.23Å; D891-R893 VanDerWaalsContact OD1-CA 3.28Å; D891-R893 WeakPolarHBondContact OD1-CA 3.22Å; D891-R893 WeakPolarHBondContact OD1-CB 3.49Å; D891-R893 PolarHBondContact OD1-N 3.03Å; R893-Y895 HydrophobicContact CB-CD2 3.62Å; R893-Y895 HydrophobicContact CB-CE2 3.78Å; R893-Y895 PolarHBondContact O-N 2.84Å
894	E	95.4	Very high	94.3	Very high	26 Å²	26	40.9 Å²	40.9	12%	0.121	20%	0.198	C	C	.	.	S	Bend	trans	63.2	18.7	-176	-50.1	-178	-167.9	0	0	115	K853 T860 A861 V881 D891	K853-E894 HydrophobicContact CD-CB 4.29Å; K853-E894 WeakPolarHBondContact CD-O 3.27Å; K853-E894 WeakPolarHBondContact CE-O 3.37Å; K853-E894 PolarHBondContact NZ-O 3.41Å; T860-E894 WeakPolarHBondContact CA-OE2 3.38Å; T860-E894 WeakPolarHBondContact CB-OE2 3.21Å; A861-E894 PolarHBondContact N-OE2 2.92Å; V881-E894 HydrophobicContact CG1-CG 3.88Å; D891-E894 PolarHBondContact O-N 3.43Å; D891-E894 PolarHBondContact OD1-N 3.34Å
895	Y	95.8	Very high	93.9	Very high	115 Å²	115	43.7 Å²	43.7	45%	0.451	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-78.9	148.1	170.3	-66.8	-73.1	0	0	0	110.6	L890 D891 R893 T897	L890-Y895 CarbonylContact C-O 3.6Å; L890-Y895 VanDerWaalsContact CA-O 3.32Å; L890-Y895 WeakPolarHBondContact CA-O 3.4Å; D891-Y895 PolarHBondContact N-O 3.22Å; D891-Y895 PolarHBondContact OD1-N 3.15Å; R893-Y895 HydrophobicContact CB-CD2 3.62Å; R893-Y895 HydrophobicContact CB-CE2 3.78Å; R893-Y895 PolarHBondContact O-N 2.84Å; Y895-T897 PolarHBondContact O-N 2.91Å
896	L	94.9	Very high	93.7	Very high	36 Å²	36	41.9 Å²	41.9	19%	0.188	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-64.1	120.6	172.2	-70.8	167.7	0	0	0	109.4	L850 K853 I854 V889 L890 Q901	L850-L896 HydrophobicContact CD1-CD2 3.58Å; K853-L896 HydrophobicContact CB-CD2 4.43Å; K853-L896 HydrophobicContact CB-CG 4.29Å; I854-L896 HydrophobicContact CG1-CD1 4.17Å; V889-L896 HydrophobicContact CG1-CD2 4.25Å; L890-L896 HydrophobicContact CD2-CD2 3.79Å; L890-L896 HydrophobicContact CD2-CG 4.28Å; L896-Q901 HydrophobicContact CB-CG 3.96Å; L896-Q901 PolarHBondContact O-NE2 3.03Å
897	T	95	Very high	93.4	Very high	39 Å²	39	40.5 Å²	40.5	24%	0.239	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-67	171.7	169.6	69.1	0	0	0	0	110	G888 V889 D891 Y895 L899 G900 Q901	G888-T897 WeakPolarHBondContact O-CB 3.48Å; G888-T897 WeakPolarHBondContact O-CG2 3.38Å; G888-T897 PolarHBondContact O-OG1 2.95Å; V889-T897 PolarHBondContact O-N 3.46Å; V889-T897 PolarHBondContact O-OG1 2.64Å; D891-T897 HydrophobicContact CB-CG2 4.26Å; Y895-T897 PolarHBondContact O-N 2.91Å; T897-L899 PolarHBondContact O-N 2.93Å; T897-L899 PolarHBondContact OG1-N 3.36Å; T897-G900 CarbonylContact O-C 3.56Å; T897-G900 WeakPolarHBondContact O-CA 3.19Å; T897-G900 PolarHBondContact O-N 3.24Å; T897-G900 PolarHBondContact OG1-N 3.16Å; T897-Q901 WeakPolarHBondContact O-CG 3.36Å; T897-Q901 PolarHBondContact O-N 3.2Å
898	T	92.5	Very high	93.2	Very high	38 Å²	38	41.6 Å²	41.6	23%	0.233	21%	0.208	C	C	.	.	H	α-helix	trans	-58.4	-37.5	173	-40.3	0	0	0	0	111.9	Q901 R902 L1182	T898-Q901 PolarHBondContact O-N 2.98Å; T898-R902 WeakPolarHBondContact O-CG 3.25Å; T898-R902 PolarHBondContact O-N 2.86Å; T898-L1182 VanDerWaalsContact CG2-C 3.49Å; T898-L1182 HydrophobicContact CG2-CB 3.78Å; T898-L1182 VanDerWaalsContact CG2-O 3.23Å; T898-L1182 WeakPolarHBondContact CG2-O 3.47Å
899	L	94.9	Very high	93.2	Very high	17 Å²	17	41.5 Å²	41.5	9%	0.089	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-49.4	171.1	175.1	62	0	0	0	110.7	T897 Q901 R902 L903 K914 V917 L1182	T897-L899 PolarHBondContact O-N 2.93Å; T897-L899 PolarHBondContact OG1-N 3.36Å; L899-Q901 VanDerWaalsContact C-N 3.29Å; L899-Q901 PolarHBondContact O-N 3.44Å; L899-R902 PolarHBondContact O-N 3.18Å; L899-L903 HydrophobicContact CD1-CD1 4.36Å; L899-L903 HydrophobicContact CG-CD1 4.35Å; L899-L903 WeakPolarHBondContact O-CB 3.44Å; L899-L903 PolarHBondContact O-N 3.25Å; L899-K914 HydrophobicContact CD2-CD 4.29Å; L899-K914 HydrophobicContact CD2-CG 4.24Å; L899-V917 HydrophobicContact CD1-CB 4.2Å; L899-V917 HydrophobicContact CD1-CG1 3.84Å; L899-L1182 HydrophobicContact CB-CD1 4.02Å; L899-L1182 HydrophobicContact CD1-CD1 4.48Å; L899-L1182 HydrophobicContact CD1-CD2 4.23Å
900	G	94.9	Very high	93.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-58	-38.7	178.8	0	0	0	0	0	113.4	V889 T897 L903 A904	V889-G900 WeakPolarHBondContact O-CA 3.14Å; T897-G900 CarbonylContact O-C 3.56Å; T897-G900 WeakPolarHBondContact O-CA 3.19Å; T897-G900 PolarHBondContact O-N 3.24Å; T897-G900 PolarHBondContact OG1-N 3.16Å; G900-L903 PolarHBondContact O-N 3.44Å; G900-A904 WeakPolarHBondContact O-CB 3.48Å; G900-A904 PolarHBondContact O-N 3.5Å
901	Q	92.2	Very high	93.1	Very high	47 Å²	47	43.7 Å²	43.7	22%	0.22	21%	0.21	C	C	.	.	H	α-helix	trans	-63.4	-44.5	176.2	-70	170.5	13.9	0	0	112.1	L896 T897 T898 L899 L903 H905	L896-Q901 HydrophobicContact CB-CG 3.96Å; L896-Q901 PolarHBondContact O-NE2 3.03Å; T897-Q901 WeakPolarHBondContact O-CG 3.36Å; T897-Q901 PolarHBondContact O-N 3.2Å; T898-Q901 PolarHBondContact O-N 2.98Å; L899-Q901 VanDerWaalsContact C-N 3.29Å; L899-Q901 PolarHBondContact O-N 3.44Å; Q901-L903 VanDerWaalsContact C-N 3.33Å; Q901-H905 PolarHBondContact O-CD2 3.1Å; Q901-H905 VanDerWaalsContact O-CD2 3.26Å
902	R	91.8	Very high	93.2	Very high	3 Å²	3	41.6 Å²	41.6	1%	0.011	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-44.5	175	-61.6	-65.2	178.9	-164.5	1.6	111.4	T898 L899 A904 H905 V917 A1018 F1019 L1182 S1184	T898-R902 WeakPolarHBondContact O-CG 3.25Å; T898-R902 PolarHBondContact O-N 2.86Å; L899-R902 PolarHBondContact O-N 3.18Å; R902-A904 VanDerWaalsContact C-N 3.34Å; R902-A904 PolarHBondContact O-N 3.04Å; R902-H905 PolarHBondContact O-N 2.82Å; R902-V917 HydrophobicContact CB-CG1 4.39Å; R902-V917 HydrophobicContact CB-CG2 4.23Å; R902-A1018 WeakPolarHBondContact CD-O 3.41Å; R902-A1018 PolarHBondContact NH1-O 2.92Å; R902-A1018 WeakPolarHBondContact O-CB 3.36Å; R902-F1019 VanDerWaalsContact NH1-CB 3.34Å; R902-F1019 VanDerWaalsContact NH1-CD2 3.3Å; R902-L1182 HydrophobicContact CG-CD2 3.85Å; R902-L1182 PolarHBondContact NE-O 2.99Å; R902-L1182 VanDerWaalsContact NE-O 3.13Å; R902-L1182 PolarHBondContact NH2-O 2.8Å; R902-S1184 PolarHBondContact NH2-O 2.86Å; R902-S1184 VanDerWaalsContact NH2-O 3.07Å
903	L	93.1	Very high	93.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-71	-31.2	-173	-160.5	157.8	0	0	0	111.8	L850 V889 L899 G900 Q901 H905 I906 P910 A913 K914 V917	L850-L903 HydrophobicContact CD2-CD2 4.04Å; V889-L903 HydrophobicContact CG2-CD1 3.75Å; V889-L903 HydrophobicContact CG2-CD2 4.49Å; L899-L903 HydrophobicContact CD1-CD1 4.36Å; L899-L903 HydrophobicContact CG-CD1 4.35Å; L899-L903 WeakPolarHBondContact O-CB 3.44Å; L899-L903 PolarHBondContact O-N 3.25Å; G900-L903 PolarHBondContact O-N 3.44Å; Q901-L903 VanDerWaalsContact C-N 3.33Å; L903-H905 PolarHBondContact O-N 2.9Å; L903-H905 VanDerWaalsContact O-N 3.14Å; L903-I906 PolarHBondContact O-N 2.98Å; L903-P910 WeakPolarHBondContact CD1-O 3.46Å; L903-P910 HydrophobicContact CD2-CB 4.26Å; L903-A913 HydrophobicContact CD1-CB 4.25Å; L903-A913 HydrophobicContact CD2-CB 3.31Å; L903-A913 HydrophobicContact CG-CB 3.44Å; L903-A913 VanDerWaalsContact CG-CB 3.44Å; L903-K914 HydrophobicContact CD1-CB 3.71Å; L903-V917 HydrophobicContact CB-CG2 4.42Å
904	A	90.7	Very high	93.5	Very high	19 Å²	19	26.1 Å²	26.1	16%	0.157	13%	0.133	C	C	.	.	H	α-helix	trans	-55.1	-28.5	175.2	0	0	0	0	0	114.5	I854 G900 R902 I906	I854-A904 HydrophobicContact CD1-CB 3.53Å; I854-A904 HydrophobicContact CG1-CB 3.73Å; G900-A904 WeakPolarHBondContact O-CB 3.48Å; G900-A904 PolarHBondContact O-N 3.5Å; R902-A904 VanDerWaalsContact C-N 3.34Å; R902-A904 PolarHBondContact O-N 3.04Å; A904-I906 VanDerWaalsContact C-N 3.31Å
905	H	88.3	Confident	93.6	Very high	59 Å²	59	24.9 Å²	24.9	27%	0.273	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-21	176.2	-67.4	-77.9	0	0	0	112.9	Q901 R902 L903 N1014 A1018	Q901-H905 PolarHBondContact O-CD2 3.1Å; Q901-H905 VanDerWaalsContact O-CD2 3.26Å; R902-H905 PolarHBondContact O-N 2.82Å; L903-H905 PolarHBondContact O-N 2.9Å; L903-H905 VanDerWaalsContact O-N 3.14Å; H905-N1014 WeakPolarHBondContact O-CB 3.49Å; H905-N1014 VanDerWaalsContact O-CG 3.28Å; H905-A1018 HydrophobicContact CB-CB 4.03Å
906	I	91.8	Very high	93.7	Very high	5 Å²	5	19.4 Å²	19.4	3%	0.026	11%	0.106	C	C	.	.	S	Bend	trans	-96	104.3	-172.3	-50.1	174.3	0	0	0	109.8	L903 A904 T908 A913 I916 V917 F1011 N1014 I1015	L903-I906 PolarHBondContact O-N 2.98Å; A904-I906 VanDerWaalsContact C-N 3.31Å; I906-T908 VanDerWaalsContact C-N 3.32Å; I906-T908 HydrophobicContact CG2-CG2 3.96Å; I906-T908 PolarHBondContact O-N 3.01Å; I906-A913 HydrophobicContact CB-CB 4.02Å; I906-A913 HydrophobicContact CG2-CB 4.08Å; I906-I916 HydrophobicContact CD1-CB 4.24Å; I906-I916 HydrophobicContact CD1-CG2 3.82Å; I906-I916 HydrophobicContact CG2-CD1 3.94Å; I906-V917 HydrophobicContact CD1-CG2 3.72Å; I906-F1011 HydrophobicContact CG2-CD1 4.16Å; I906-F1011 HydrophobicContact CG2-CE1 4.49Å; I906-N1014 HydrophobicContact CG1-CB 4.47Å; I906-I1015 HydrophobicContact CD1-CG1 4.46Å
907	S	85.6	Confident	93.9	Very high	39 Å²	39	17.7 Å²	17.7	27%	0.273	10%	0.097	S	C	.	.			trans	-74.9	71.2	-176.2	63.1	0	0	0	0	114.1	R549 Q1010 N1014	R549-S907 PolarHBondContact NH2-O 2.87Å; S907-Q1010 PolarHBondContact OG-NE2 3.1Å; S907-Q1010 VanDerWaalsContact OG-NE2 3.13Å; S907-N1014 PolarHBondContact N-ND2 3.39Å; S907-N1014 PolarHBondContact OG-ND2 3.49Å
908	T	91.2	Very high	94	Very high	25 Å²	25	16 Å²	16	15%	0.153	9%	0.086	C	C	.	.	S	Bend	trans	-152.7	-178.9	174.7	-165.5	0	0	0	0	111	I906 L912 A913 I916 V932 F1011	I906-T908 VanDerWaalsContact C-N 3.32Å; I906-T908 HydrophobicContact CG2-CG2 3.96Å; I906-T908 PolarHBondContact O-N 3.01Å; T908-L912 HydrophobicContact CG2-CB 3.93Å; T908-A913 HydrophobicContact CG2-CB 3.7Å; T908-I916 HydrophobicContact CG2-CD1 4.5Å; T908-V932 HydrophobicContact CG2-CG1 4.33Å; T908-F1011 HydrophobicContact CG2-CE1 4.38Å
909	D	93.3	Very high	94.3	Very high	25 Å²	25	14.2 Å²	14.2	13%	0.134	8%	0.075	C	C	.	.			trans	-53.9	139.6	175.1	-179.5	-74	0	0	0	110.9	R911 L912 A913 F1106	D909-R911 PolarHBondContact O-N 2.81Å; D909-R911 VanDerWaalsContact O-N 3.12Å; D909-R911 VanDerWaalsContact OD1-CB 3.29Å; D909-R911 WeakPolarHBondContact OD1-CB 3.46Å; D909-R911 IonicContact OD1-CZ 2.67Å; D909-R911 PolarHBondContact OD1-N 3.07Å; D909-R911 IonicContact OD1-NE 2.75Å; D909-R911 PolarHBondContact OD1-NE 2.71Å; D909-R911 IonicContact OD1-NH2 3.69Å; D909-R911 IonicContact OD2-CZ 2.84Å; D909-R911 IonicContact OD2-NE 2.9Å; D909-R911 IonicContact OD2-NH2 3.82Å; D909-R911 PolarHBondContact OD2-NH2 3.48Å; D909-L912 HydrophobicContact CB-CB 4.38Å; D909-L912 HydrophobicContact CB-CD1 4.24Å; D909-L912 HydrophobicContact CB-CG 4.18Å; D909-L912 PolarHBondContact O-N 2.87Å; D909-A913 WeakPolarHBondContact O-CB 3.29Å; D909-A913 PolarHBondContact O-N 3.05Å; D909-F1106 HydrophobicContact CB-CE2 4.02Å; D909-F1106 HydrophobicContact CB-CZ 3.89Å
910	P	95.7	Very high	94.3	Very high	4 Å²	4	13.4 Å²	13.4	3%	0.026	7%	0.071	C	C	.	.	H	α-helix	trans	-59	-32	-173.3	-26	37.2	0	0	0	113.7	N847 L850 L884 I887 L903 K914	N847-P910 WeakPolarHBondContact OD1-CD 3.24Å; L850-P910 HydrophobicContact CD2-CG 4.19Å; L884-P910 HydrophobicContact CD2-CB 3.86Å; L884-P910 HydrophobicContact CD2-CG 3.89Å; I887-P910 HydrophobicContact CD1-CB 3.75Å; L903-P910 WeakPolarHBondContact CD1-O 3.46Å; L903-P910 HydrophobicContact CD2-CB 4.26Å; P910-K914 WeakPolarHBondContact O-CB 3.46Å; P910-K914 PolarHBondContact O-N 3.45Å
911	R	95.7	Very high	94.4	Very high	46 Å²	46	13.6 Å²	13.6	17%	0.174	7%	0.072	C	C	.	.	H	α-helix	trans	-70.5	-40.9	176.6	-64.5	164.6	-70.6	-165.7	-4.4	111.9	I887 D909 K914 A915 G1051 L1052	I887-R911 HydrophobicContact CD1-CG 4.36Å; I887-R911 HydrophobicContact CG2-CG 4.46Å; D909-R911 PolarHBondContact O-N 2.81Å; D909-R911 VanDerWaalsContact O-N 3.12Å; D909-R911 VanDerWaalsContact OD1-CB 3.29Å; D909-R911 WeakPolarHBondContact OD1-CB 3.46Å; D909-R911 IonicContact OD1-CZ 2.67Å; D909-R911 PolarHBondContact OD1-N 3.07Å; D909-R911 IonicContact OD1-NE 2.75Å; D909-R911 PolarHBondContact OD1-NE 2.71Å; D909-R911 IonicContact OD1-NH2 3.69Å; D909-R911 IonicContact OD2-CZ 2.84Å; D909-R911 IonicContact OD2-NE 2.9Å; D909-R911 IonicContact OD2-NH2 3.82Å; D909-R911 PolarHBondContact OD2-NH2 3.48Å; R911-K914 WeakPolarHBondContact O-CB 3.45Å; R911-K914 PolarHBondContact O-N 3.21Å; R911-A915 PolarHBondContact O-N 3.28Å; R911-G1051 CarbonylContact C-O 2.99Å; R911-G1051 WeakPolarHBondContact CA-O 3.32Å; R911-G1051 WeakPolarHBondContact CB-O 3.49Å; R911-G1051 CarbonylContact O-C 3.56Å; R911-G1051 VanDerWaalsContact O-O 3.04Å; R911-L1052 HydrophobicContact CB-CD2 4.04Å
912	L	96.8	Very high	94.7	Very high	3 Å²	3	11.6 Å²	11.6	2%	0.016	6%	0.063	C	C	.	.	H	α-helix	trans	-68.8	-38.5	175.5	-64.1	-177.2	0	0	0	111.6	T908 D909 K914 A915 I916 V932 L935 L1052 F1106	T908-L912 HydrophobicContact CG2-CB 3.93Å; D909-L912 HydrophobicContact CB-CB 4.38Å; D909-L912 HydrophobicContact CB-CD1 4.24Å; D909-L912 HydrophobicContact CB-CG 4.18Å; D909-L912 PolarHBondContact O-N 2.87Å; L912-K914 VanDerWaalsContact C-N 3.35Å; L912-A915 WeakPolarHBondContact O-CB 3.37Å; L912-A915 PolarHBondContact O-N 2.87Å; L912-I916 WeakPolarHBondContact O-CG1 3.24Å; L912-I916 PolarHBondContact O-N 3.32Å; L912-V932 HydrophobicContact CB-CG1 4.07Å; L912-V932 HydrophobicContact CB-CG2 3.95Å; L912-V932 HydrophobicContact CD1-CG1 4.14Å; L912-V932 HydrophobicContact CD2-CG2 4.15Å; L912-V932 HydrophobicContact CG-CG2 4.46Å; L912-L935 HydrophobicContact CD2-CD1 3.74Å; L912-L1052 HydrophobicContact CD2-CD2 3.83Å; L912-F1106 HydrophobicContact CD1-CD1 4.23Å; L912-F1106 HydrophobicContact CD1-CD2 4.34Å; L912-F1106 HydrophobicContact CD1-CE1 3.71Å; L912-F1106 HydrophobicContact CD1-CE2 3.82Å; L912-F1106 HydrophobicContact CD1-CZ 3.48Å; L912-F1106 VanDerWaalsContact CD1-CZ 3.48Å; L912-F1106 HydrophobicContact CD2-CD1 4.35Å; L912-F1106 HydrophobicContact CD2-CD2 3.68Å; L912-F1106 HydrophobicContact CD2-CE2 3.9Å; L912-F1106 HydrophobicContact CD2-CG 3.94Å; L912-F1106 HydrophobicContact CD2-CZ 4.34Å; L912-F1106 HydrophobicContact CG-CD2 3.91Å; L912-F1106 HydrophobicContact CG-CE1 4.33Å; L912-F1106 HydrophobicContact CG-CE2 3.57Å; L912-F1106 HydrophobicContact CG-CG 4.44Å; L912-F1106 HydrophobicContact CG-CZ 3.81Å
913	A	96.8	Very high	94.9	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-65.2	-40.1	174.9	0	0	0	0	0	110.9	L903 I906 T908 D909 A915 I916 V917	L903-A913 HydrophobicContact CD1-CB 4.25Å; L903-A913 HydrophobicContact CD2-CB 3.31Å; L903-A913 HydrophobicContact CG-CB 3.44Å; L903-A913 VanDerWaalsContact CG-CB 3.44Å; I906-A913 HydrophobicContact CB-CB 4.02Å; I906-A913 HydrophobicContact CG2-CB 4.08Å; T908-A913 HydrophobicContact CG2-CB 3.7Å; D909-A913 WeakPolarHBondContact O-CB 3.29Å; D909-A913 PolarHBondContact O-N 3.05Å; A913-A915 PolarHBondContact O-N 2.53Å; A913-I916 WeakPolarHBondContact O-CB 3.37Å; A913-I916 PolarHBondContact O-N 2.88Å; A913-V917 WeakPolarHBondContact O-CG2 3.46Å; A913-V917 PolarHBondContact O-N 3.04Å
914	K	97.5	Very high	95.1	Very high	2 Å²	2	12.4 Å²	12.4	1%	0.009	7%	0.066	C	C	.	.	H	α-helix	trans	-58.3	-46.4	170.1	-176.2	179.3	175	171.1	0	111.7	I887 L899 L903 P910 R911 L912 I916 V917 L918 A1050 D1133	I887-K914 HydrophobicContact CB-CD 4.44Å; I887-K914 PolarHBondContact O-NZ 3.21Å; L899-K914 HydrophobicContact CD2-CD 4.29Å; L899-K914 HydrophobicContact CD2-CG 4.24Å; L903-K914 HydrophobicContact CD1-CB 3.71Å; P910-K914 WeakPolarHBondContact O-CB 3.46Å; P910-K914 PolarHBondContact O-N 3.45Å; R911-K914 WeakPolarHBondContact O-CB 3.45Å; R911-K914 PolarHBondContact O-N 3.21Å; L912-K914 VanDerWaalsContact C-N 3.35Å; K914-I916 VanDerWaalsContact C-N 3.27Å; K914-I916 PolarHBondContact O-N 3.43Å; K914-V917 PolarHBondContact O-N 3.44Å; K914-L918 HydrophobicContact CG-CD1 4.04Å; K914-L918 HydrophobicContact CG-CG 4.33Å; K914-L918 WeakPolarHBondContact O-CG 3.19Å; K914-L918 PolarHBondContact O-N 3.35Å; K914-A1050 WeakPolarHBondContact CE-O 3.35Å; K914-D1133 WeakPolarHBondContact CE-OD2 3.25Å; K914-D1133 IonicContact NZ-OD2 3.48Å; K914-D1133 PolarHBondContact NZ-OD2 3.22Å
915	A	97.9	Very high	95.5	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-57	-40.7	176.4	0	0	0	0	0	112.1	R911 L912 A913 A919 L1048	R911-A915 PolarHBondContact O-N 3.28Å; L912-A915 WeakPolarHBondContact O-CB 3.37Å; L912-A915 PolarHBondContact O-N 2.87Å; A913-A915 PolarHBondContact O-N 2.53Å; A915-A919 WeakPolarHBondContact O-CB 3.32Å; A915-A919 PolarHBondContact O-N 3.32Å; A915-L1048 HydrophobicContact CB-CD1 4.43Å
916	I	97.9	Very high	95.9	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-64.3	-48	175.9	-70.8	168.9	0	0	0	111.7	I906 T908 L912 A913 K914 L918 A919 A920 L925 L929 V932 F1011 I1015	I906-I916 HydrophobicContact CD1-CB 4.24Å; I906-I916 HydrophobicContact CD1-CG2 3.82Å; I906-I916 HydrophobicContact CG2-CD1 3.94Å; T908-I916 HydrophobicContact CG2-CD1 4.5Å; L912-I916 WeakPolarHBondContact O-CG1 3.24Å; L912-I916 PolarHBondContact O-N 3.32Å; A913-I916 WeakPolarHBondContact O-CB 3.37Å; A913-I916 PolarHBondContact O-N 2.88Å; K914-I916 VanDerWaalsContact C-N 3.27Å; K914-I916 PolarHBondContact O-N 3.43Å; I916-L918 VanDerWaalsContact C-N 3.33Å; I916-L918 PolarHBondContact O-N 3.48Å; I916-A919 PolarHBondContact O-N 2.95Å; I916-A920 PolarHBondContact O-N 3.31Å; I916-L925 HydrophobicContact CG2-CD1 4.07Å; I916-L929 HydrophobicContact CD1-CD2 4.17Å; I916-L929 HydrophobicContact CG1-CD2 4.29Å; I916-L929 HydrophobicContact CG2-CD2 4.4Å; I916-V932 HydrophobicContact CD1-CB 4.21Å; I916-V932 HydrophobicContact CD1-CG1 3.96Å; I916-V932 HydrophobicContact CD1-CG2 4.03Å; I916-V932 HydrophobicContact CG1-CG2 3.98Å; I916-F1011 HydrophobicContact CD1-CG 4.5Å; I916-I1015 HydrophobicContact CG2-CD1 3.42Å; I916-I1015 VanDerWaalsContact CG2-CD1 3.42Å; I916-I1015 HydrophobicContact CG2-CG1 3.6Å
917	V	97.3	Very high	96.2	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-59	-48.3	179.2	176.3	0	0	0	0	110.2	L899 R902 L903 I906 A913 K914 A919 A920 I921 L1020 L1182	L899-V917 HydrophobicContact CD1-CB 4.2Å; L899-V917 HydrophobicContact CD1-CG1 3.84Å; R902-V917 HydrophobicContact CB-CG1 4.39Å; R902-V917 HydrophobicContact CB-CG2 4.23Å; L903-V917 HydrophobicContact CB-CG2 4.42Å; I906-V917 HydrophobicContact CD1-CG2 3.72Å; A913-V917 WeakPolarHBondContact O-CG2 3.46Å; A913-V917 PolarHBondContact O-N 3.04Å; K914-V917 PolarHBondContact O-N 3.44Å; V917-A919 VanDerWaalsContact C-N 3.35Å; V917-A919 PolarHBondContact O-N 3.09Å; V917-A920 PolarHBondContact O-N 2.98Å; V917-I921 HydrophobicContact CG1-CD1 4.12Å; V917-I921 WeakPolarHBondContact O-CG1 3.38Å; V917-I921 PolarHBondContact O-N 3.17Å; V917-L1020 HydrophobicContact CB-CD1 4.3Å; V917-L1020 HydrophobicContact CG1-CD1 4.26Å; V917-L1020 HydrophobicContact CG1-CD2 4.21Å; V917-L1020 HydrophobicContact CG2-CD1 3.99Å; V917-L1182 HydrophobicContact CG1-CD2 3.7Å
918	L	97.7	Very high	96.8	Very high	4 Å²	4	8.7 Å²	8.7	2%	0.021	4%	0.041	C	C	.	.	H	α-helix	trans	-62	-42.9	176.9	-65	178.3	0	0	0	110.9	K914 I916 A920 I921 F922 V1047 A1050 V1178	K914-L918 HydrophobicContact CG-CD1 4.04Å; K914-L918 HydrophobicContact CG-CG 4.33Å; K914-L918 WeakPolarHBondContact O-CG 3.19Å; K914-L918 PolarHBondContact O-N 3.35Å; I916-L918 VanDerWaalsContact C-N 3.33Å; I916-L918 PolarHBondContact O-N 3.48Å; L918-A920 VanDerWaalsContact C-N 3.28Å; L918-A920 PolarHBondContact O-N 2.86Å; L918-I921 CarbonylContact O-C 3.27Å; L918-I921 PolarHBondContact O-N 2.85Å; L918-F922 HydrophobicContact CB-CD2 4.17Å; L918-F922 HydrophobicContact CB-CE2 4.46Å; L918-F922 HydrophobicContact CD2-CE2 4.28Å; L918-F922 WeakPolarHBondContact O-CB 3.44Å; L918-F922 VanDerWaalsContact O-CD2 3.24Å; L918-F922 WeakPolarHBondContact O-CD2 3.48Å; L918-F922 PolarHBondContact O-N 3.22Å; L918-V1047 HydrophobicContact CB-CG1 3.82Å; L918-A1050 HydrophobicContact CD1-CB 3.79Å; L918-V1178 HydrophobicContact CD2-CG1 4.17Å
919	A	98	Very high	97.2	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-62.7	-32.8	179.3	0	0	0	0	0	113.8	A915 I916 V917 R923 C924 L925 L928 V1047	A915-A919 WeakPolarHBondContact O-CB 3.32Å; A915-A919 PolarHBondContact O-N 3.32Å; I916-A919 PolarHBondContact O-N 2.95Å; V917-A919 VanDerWaalsContact C-N 3.35Å; V917-A919 PolarHBondContact O-N 3.09Å; A919-R923 PolarHBondContact O-N 3.47Å; A919-C924 PolarHBondContact O-N 2.87Å; A919-L925 HydrophobicContact CB-CD1 4.16Å; A919-L925 PolarHBondContact O-N 2.62Å; A919-L928 HydrophobicContact CB-CB 3.69Å; A919-L928 HydrophobicContact CB-CD2 4.02Å; A919-L928 HydrophobicContact CB-CG 3.67Å; A919-V1047 HydrophobicContact CB-CG1 3.98Å
920	A	96.6	Very high	97.4	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-65.1	-44	170.9	0	0	0	0	0	111.7	I916 V917 L918 R923 L925 L1020 L1186	I916-A920 PolarHBondContact O-N 3.31Å; V917-A920 PolarHBondContact O-N 2.98Å; L918-A920 VanDerWaalsContact C-N 3.28Å; L918-A920 PolarHBondContact O-N 2.86Å; A920-R923 PolarHBondContact O-N 3.2Å; A920-L925 HydrophobicContact CB-CD1 4.28Å; A920-L925 HydrophobicContact CB-CD2 4.27Å; A920-L1020 HydrophobicContact CB-CB 4.05Å; A920-L1020 HydrophobicContact CB-CD1 4.43Å; A920-L1186 HydrophobicContact CB-CD2 4.44Å
921	I	96.3	Very high	97.5	Very high	5 Å²	5	6.2 Å²	6.2	3%	0.026	3%	0.027	C	C	.	.	H	α-helix	trans	-68.1	-44.3	179.9	-64.6	171.4	0	0	0	111.6	V917 L918 R923 M1177 V1178 L1182 L1186	V917-I921 HydrophobicContact CG1-CD1 4.12Å; V917-I921 WeakPolarHBondContact O-CG1 3.38Å; V917-I921 PolarHBondContact O-N 3.17Å; L918-I921 CarbonylContact O-C 3.27Å; L918-I921 PolarHBondContact O-N 2.85Å; I921-R923 PolarHBondContact O-N 2.87Å; I921-M1177 HydrophobicContact CG2-CE 4.14Å; I921-V1178 HydrophobicContact CD1-CG1 4.21Å; I921-V1178 HydrophobicContact CG2-CG2 4.15Å; I921-L1182 HydrophobicContact CD1-CD2 3.92Å; I921-L1182 HydrophobicContact CD1-CG 4.04Å; I921-L1186 HydrophobicContact CG1-CD2 4.5Å
922	F	97.8	Very high	97.6	Very high	5 Å²	5	4 Å²	4	2%	0.022	2%	0.019	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	3	177.8	-74.8	-80.9	0	0	0	113.5	L918 C924 L1043 V1047 L1131 L1174 M1177 V1178 L1201 L1204	L918-F922 HydrophobicContact CB-CD2 4.17Å; L918-F922 HydrophobicContact CB-CE2 4.46Å; L918-F922 HydrophobicContact CD2-CE2 4.28Å; L918-F922 WeakPolarHBondContact O-CB 3.44Å; L918-F922 VanDerWaalsContact O-CD2 3.24Å; L918-F922 WeakPolarHBondContact O-CD2 3.48Å; L918-F922 PolarHBondContact O-N 3.22Å; F922-C924 VanDerWaalsContact C-N 3.33Å; F922-C924 PolarHBondContact O-N 3.46Å; F922-L1043 HydrophobicContact CD1-CD1 4.31Å; F922-V1047 HydrophobicContact CB-CG2 3.66Å; F922-V1047 HydrophobicContact CD1-CG2 4.38Å; F922-V1047 HydrophobicContact CD2-CG2 3.9Å; F922-V1047 HydrophobicContact CG-CG2 3.73Å; F922-L1131 HydrophobicContact CD1-CD2 4.22Å; F922-L1131 HydrophobicContact CE1-CD2 3.39Å; F922-L1131 HydrophobicContact CE2-CD2 4.31Å; F922-L1131 HydrophobicContact CZ-CD2 3.46Å; F922-L1131 VanDerWaalsContact CZ-CD2 3.46Å; F922-L1174 HydrophobicContact CE1-CD2 4.16Å; F922-M1177 HydrophobicContact CD1-CE 3.98Å; F922-M1177 HydrophobicContact CE1-CE 3.67Å; F922-M1177 HydrophobicContact CZ-CE 4.04Å; F922-V1178 HydrophobicContact CE2-CG2 3.83Å; F922-V1178 HydrophobicContact CZ-CG2 3.9Å; F922-L1201 HydrophobicContact CB-CD2 4.44Å; F922-L1201 HydrophobicContact CD1-CD2 3.52Å; F922-L1201 HydrophobicContact CE1-CD2 4.19Å; F922-L1201 HydrophobicContact CG-CD2 4.37Å; F922-L1204 HydrophobicContact CD1-CD2 3.91Å; F922-L1204 HydrophobicContact CE1-CD2 3.81Å
923	R	97.2	Very high	97.5	Very high	20 Å²	20	3.9 Å²	3.9	8%	0.075	2%	0.018	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	37.1	174.4	-57.1	-179.6	-171.1	178.2	6.1	114.5	A919 A920 I921 Q1033 C1034 N1035 E1036 Y1037 Q1194 L1201	A919-R923 PolarHBondContact O-N 3.47Å; A920-R923 PolarHBondContact O-N 3.2Å; I921-R923 PolarHBondContact O-N 2.87Å; R923-Q1033 VanDerWaalsContact CB-O 3.23Å; R923-Q1033 WeakPolarHBondContact CB-O 3.32Å; R923-Q1033 VanDerWaalsContact CD-O 3.32Å; R923-Q1033 WeakPolarHBondContact CD-O 3.23Å; R923-Q1033 VanDerWaalsContact CG-O 3.26Å; R923-Q1033 WeakPolarHBondContact CG-O 3.31Å; R923-C1034 CarbonylContact C-O 3.59Å; R923-C1034 WeakPolarHBondContact CA-O 3.35Å; R923-N1035 CarbonylContact O-C 3.54Å; R923-N1035 WeakPolarHBondContact O-CA 3.4Å; R923-E1036 HydrophobicContact CB-CB 4.18Å; R923-E1036 VanDerWaalsContact CD-OE2 3.26Å; R923-E1036 WeakPolarHBondContact CD-OE2 3.47Å; R923-E1036 IonicContact CZ-OE2 2.75Å; R923-E1036 IonicContact NE-OE2 3.06Å; R923-E1036 IonicContact NH1-OE2 3.91Å; R923-E1036 PolarHBondContact NH1-OE2 2.84Å; R923-E1036 PolarHBondContact O-N 3.49Å; R923-E1036 VanDerWaalsContact O-N 3.15Å; R923-Y1037 HydrophobicContact CB-CD2 4Å; R923-Y1037 PolarHBondContact O-N 3.28Å; R923-Q1194 PolarHBondContact NH2-O 3.18Å; R923-L1201 HydrophobicContact CB-CD1 4.29Å; R923-L1201 HydrophobicContact CG-CD1 3.84Å
924	C	97.6	Very high	97.5	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.019	C	C	.	.			trans	-128.7	40.6	175	66.9	0	0	0	0	111	A919 F922 P927 L928 C1034 V1044	A919-C924 PolarHBondContact O-N 2.87Å; F922-C924 VanDerWaalsContact C-N 3.33Å; F922-C924 PolarHBondContact O-N 3.46Å; C924-P927 WeakPolarHBondContact O-CD 3.46Å; C924-L928 WeakPolarHBondContact O-CD2 3.45Å; C924-C1034 PolarHBondContact N-O 2.87Å; C924-V1044 HydrophobicContact CB-CG2 3.96Å
925	L	98.1	Very high	97.3	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-68.1	-47.7	-164.2	178.4	58.5	0	0	0	114.2	I916 A919 A920 L928 L929 I1015 V1021 C1027 C1034	I916-L925 HydrophobicContact CG2-CD1 4.07Å; A919-L925 HydrophobicContact CB-CD1 4.16Å; A919-L925 PolarHBondContact O-N 2.62Å; A920-L925 HydrophobicContact CB-CD1 4.28Å; A920-L925 HydrophobicContact CB-CD2 4.27Å; L925-L928 PolarHBondContact O-N 2.71Å; L925-L928 VanDerWaalsContact O-N 3.1Å; L925-L929 HydrophobicContact CD1-CD1 4.27Å; L925-L929 HydrophobicContact CD1-CG 4.02Å; L925-L929 HydrophobicContact CD2-CD1 4.44Å; L925-L929 HydrophobicContact CG-CD1 3.97Å; L925-L929 HydrophobicContact CG-CG 4.19Å; L925-L929 PolarHBondContact O-N 3.15Å; L925-I1015 HydrophobicContact CD1-CD1 4.04Å; L925-I1015 HydrophobicContact CD2-CD1 4.29Å; L925-I1015 HydrophobicContact CD2-CG2 4.29Å; L925-V1021 HydrophobicContact CD2-CG1 4.09Å; L925-C1027 HydrophobicContact CD2-CB 4.11Å; L925-C1034 HydrophobicContact CB-CB 4.34Å; L925-C1034 VanDerWaalsContact CB-O 3.3Å; L925-C1034 WeakPolarHBondContact CB-O 3.27Å; L925-C1034 HydrophobicContact CD2-CB 4.2Å; L925-C1034 PolarHBondContact N-O 3.26Å
926	H	98	Very high	96.9	Very high	36 Å²	36	7.8 Å²	7.8	17%	0.167	4%	0.041	C	C	.	.	H	α-helix	trans	-58	-48	-171.2	-179.9	70.5	0	0	0	113.9	L928 L929 V930 E976 C1027 N1035	H926-L928 VanDerWaalsContact C-N 3.26Å; H926-L928 PolarHBondContact O-N 3.44Å; H926-L929 WeakPolarHBondContact O-CB 3.36Å; H926-L929 PolarHBondContact O-N 2.98Å; H926-L929 VanDerWaalsContact O-N 3.15Å; H926-V930 PolarHBondContact O-N 2.87Å; H926-V930 VanDerWaalsContact O-N 3.11Å; H926-E976 IonicContact NE2-OE2 3.28Å; H926-C1027 WeakPolarHBondContact CB-O 3.28Å; H926-N1035 WeakPolarHBondContact CB-OD1 3.41Å; H926-N1035 PolarHBondContact N-OD1 3.46Å
927	P	98.2	Very high	96.5	Very high	7 Å²	7	10.1 Å²	10.1	5%	0.045	5%	0.05	C	C	.	.	H	α-helix	trans	-55.1	-40	174.7	-25.6	32.6	0	0	0	113.1	C924 V930 V931 V969 S1038 V1044	C924-P927 WeakPolarHBondContact O-CD 3.46Å; P927-V930 WeakPolarHBondContact O-CB 3.44Å; P927-V930 PolarHBondContact O-N 3.15Å; P927-V931 VanDerWaalsContact O-CG2 3.31Å; P927-V931 WeakPolarHBondContact O-CG2 3.4Å; P927-V931 PolarHBondContact O-N 3.15Å; P927-V969 HydrophobicContact CB-CG1 4.18Å; P927-V969 HydrophobicContact CB-CG2 3.95Å; P927-S1038 VanDerWaalsContact CG-O 3.31Å; P927-S1038 WeakPolarHBondContact CG-O 3.32Å; P927-V1044 HydrophobicContact CB-CG1 3.97Å; P927-V1044 HydrophobicContact CB-CG2 4.13Å; P927-V1044 HydrophobicContact CG-CG2 4.08Å
928	L	98.2	Very high	96.1	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-71.7	-34.2	-179.5	-85.3	-56	0	0	0	112.4	A919 C924 L925 H926 V930 V931 V932 V1044 L1048	A919-L928 HydrophobicContact CB-CB 3.69Å; A919-L928 HydrophobicContact CB-CD2 4.02Å; A919-L928 HydrophobicContact CB-CG 3.67Å; C924-L928 WeakPolarHBondContact O-CD2 3.45Å; L925-L928 PolarHBondContact O-N 2.71Å; L925-L928 VanDerWaalsContact O-N 3.1Å; H926-L928 VanDerWaalsContact C-N 3.26Å; H926-L928 PolarHBondContact O-N 3.44Å; L928-V930 VanDerWaalsContact C-N 3.3Å; L928-V930 PolarHBondContact O-N 2.92Å; L928-V931 PolarHBondContact O-N 3.49Å; L928-V932 WeakPolarHBondContact O-CB 3.48Å; L928-V932 VanDerWaalsContact O-CG2 3.29Å; L928-V932 WeakPolarHBondContact O-CG2 3.45Å; L928-V932 PolarHBondContact O-N 2.85Å; L928-V1044 HydrophobicContact CD2-CB 4.39Å; L928-V1044 HydrophobicContact CD2-CG1 3.79Å; L928-V1044 HydrophobicContact CD2-CG2 4.49Å; L928-L1048 HydrophobicContact CD1-CB 3.79Å; L928-L1048 HydrophobicContact CD1-CD1 3.66Å; L928-L1048 HydrophobicContact CD1-CG 4.22Å
929	L	97.9	Very high	95.9	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.9	-41.6	171.2	-76.1	177.8	0	0	0	111.9	I916 L925 H926 S933 F1011 I1015 C1027	I916-L929 HydrophobicContact CD1-CD2 4.17Å; I916-L929 HydrophobicContact CG1-CD2 4.29Å; I916-L929 HydrophobicContact CG2-CD2 4.4Å; L925-L929 HydrophobicContact CD1-CD1 4.27Å; L925-L929 HydrophobicContact CD1-CG 4.02Å; L925-L929 HydrophobicContact CD2-CD1 4.44Å; L925-L929 HydrophobicContact CG-CD1 3.97Å; L925-L929 HydrophobicContact CG-CG 4.19Å; L925-L929 PolarHBondContact O-N 3.15Å; H926-L929 WeakPolarHBondContact O-CB 3.36Å; H926-L929 PolarHBondContact O-N 2.98Å; H926-L929 VanDerWaalsContact O-N 3.15Å; L929-S933 VanDerWaalsContact O-CB 3.28Å; L929-S933 WeakPolarHBondContact O-CB 3.48Å; L929-S933 PolarHBondContact O-N 3.24Å; L929-S933 VanDerWaalsContact O-N 3.07Å; L929-S933 PolarHBondContact O-OG 3.48Å; L929-F1011 HydrophobicContact CD2-CB 3.52Å; L929-F1011 HydrophobicContact CD2-CD2 4.38Å; L929-F1011 HydrophobicContact CD2-CG 4.29Å; L929-I1015 HydrophobicContact CD1-CD1 4.13Å; L929-I1015 HydrophobicContact CD2-CD1 3.54Å; L929-I1015 HydrophobicContact CG-CD1 4.24Å; L929-C1027 HydrophobicContact CD1-CB 3.77Å
930	V	98.3	Very high	95.6	Very high	1 Å²	1	12.9 Å²	12.9	1%	0.006	7%	0.065	C	C	.	.	H	α-helix	trans	-64.1	-50.1	175	175.8	0	0	0	0	110.2	H926 P927 L928 V932 S933 C934 V969 V972 I1008	H926-V930 PolarHBondContact O-N 2.87Å; H926-V930 VanDerWaalsContact O-N 3.11Å; P927-V930 WeakPolarHBondContact O-CB 3.44Å; P927-V930 PolarHBondContact O-N 3.15Å; L928-V930 VanDerWaalsContact C-N 3.3Å; L928-V930 PolarHBondContact O-N 2.92Å; V930-V932 PolarHBondContact O-N 3.47Å; V930-S933 PolarHBondContact O-N 2.91Å; V930-C934 WeakPolarHBondContact O-CB 3.46Å; V930-C934 PolarHBondContact O-N 3.03Å; V930-C934 PolarHBondContact O-SG 2.75Å; V930-C934 VanDerWaalsContact O-SG 3.34Å; V930-V969 HydrophobicContact CB-CG2 4.47Å; V930-V969 HydrophobicContact CG1-CG2 4.46Å; V930-V972 HydrophobicContact CG1-CB 3.73Å; V930-V972 HydrophobicContact CG1-CG1 4.14Å; V930-V972 HydrophobicContact CG1-CG2 3.69Å; V930-V972 HydrophobicContact CG2-CG1 4.28Å; V930-I1008 HydrophobicContact CG2-CD1 3.88Å
931	V	98.1	Very high	94.8	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.006	8%	0.082	C	C	.	.	H	α-helix	trans	-56	-51.6	179	168.8	0	0	0	0	111.5	P927 L928 S933 C934 L935 H965 V969 L1048	P927-V931 VanDerWaalsContact O-CG2 3.31Å; P927-V931 WeakPolarHBondContact O-CG2 3.4Å; P927-V931 PolarHBondContact O-N 3.15Å; L928-V931 PolarHBondContact O-N 3.49Å; V931-S933 VanDerWaalsContact C-N 3.27Å; V931-S933 PolarHBondContact O-N 3.07Å; V931-C934 PolarHBondContact O-N 3.44Å; V931-L935 HydrophobicContact CG1-CD1 3.82Å; V931-L935 HydrophobicContact CG1-CG 4.3Å; V931-L935 WeakPolarHBondContact O-CB 3.42Å; V931-L935 WeakPolarHBondContact O-CG 3.46Å; V931-L935 PolarHBondContact O-N 2.86Å; V931-H965 HydrophobicContact CG1-CB 4.02Å; V931-H965 HydrophobicContact CG2-CB 3.82Å; V931-H965 WeakPolarHBondContact CG2-O 3.17Å; V931-V969 HydrophobicContact CG2-CG2 3.72Å; V931-L1048 HydrophobicContact CG1-CD1 4.12Å; V931-L1048 HydrophobicContact CG1-CD2 4.23Å
932	V	97.1	Very high	93.4	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-61.1	-38.5	179.7	171	0	0	0	0	111.5	T908 L912 I916 L928 V930 T936 F1011	T908-V932 HydrophobicContact CG2-CG1 4.33Å; L912-V932 HydrophobicContact CB-CG1 4.07Å; L912-V932 HydrophobicContact CB-CG2 3.95Å; L912-V932 HydrophobicContact CD1-CG1 4.14Å; L912-V932 HydrophobicContact CD2-CG2 4.15Å; L912-V932 HydrophobicContact CG-CG2 4.46Å; I916-V932 HydrophobicContact CD1-CB 4.21Å; I916-V932 HydrophobicContact CD1-CG1 3.96Å; I916-V932 HydrophobicContact CD1-CG2 4.03Å; I916-V932 HydrophobicContact CG1-CG2 3.98Å; L928-V932 WeakPolarHBondContact O-CB 3.48Å; L928-V932 VanDerWaalsContact O-CG2 3.29Å; L928-V932 WeakPolarHBondContact O-CG2 3.45Å; L928-V932 PolarHBondContact O-N 2.85Å; V930-V932 PolarHBondContact O-N 3.47Å; V932-T936 PolarHBondContact O-N 2.89Å; V932-T936 VanDerWaalsContact O-N 3.09Å; V932-T936 PolarHBondContact O-OG1 3.48Å; V932-F1011 HydrophobicContact CG1-CE2 3.83Å; V932-F1011 HydrophobicContact CG1-CZ 3.93Å
933	S	96.2	Very high	91.8	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-67.3	-41	176.9	-58.9	0	0	0	0	112	L929 V930 V931 T936 R937 I1008	L929-S933 VanDerWaalsContact O-CB 3.28Å; L929-S933 WeakPolarHBondContact O-CB 3.48Å; L929-S933 PolarHBondContact O-N 3.24Å; L929-S933 VanDerWaalsContact O-N 3.07Å; L929-S933 PolarHBondContact O-OG 3.48Å; V930-S933 PolarHBondContact O-N 2.91Å; V931-S933 VanDerWaalsContact C-N 3.27Å; V931-S933 PolarHBondContact O-N 3.07Å; S933-T936 WeakPolarHBondContact O-CB 3.47Å; S933-T936 PolarHBondContact O-N 3.35Å; S933-R937 PolarHBondContact O-N 3.14Å; S933-I1008 WeakPolarHBondContact OG-CG1 3.44Å
934	C	95.8	Very high	89.8	Confident	3 Å²	3	23.9 Å²	23.9	2%	0.02	14%	0.137	C	C	.	.	H	α-helix	trans	-71.1	-33.3	177.2	-70.5	0	0	0	0	113.1	V930 V931 T936 R937 D938 P939 F968	V930-C934 WeakPolarHBondContact O-CB 3.46Å; V930-C934 PolarHBondContact O-N 3.03Å; V930-C934 PolarHBondContact O-SG 2.75Å; V930-C934 VanDerWaalsContact O-SG 3.34Å; V931-C934 PolarHBondContact O-N 3.44Å; C934-T936 VanDerWaalsContact C-N 3.28Å; C934-T936 PolarHBondContact O-N 3.18Å; C934-R937 CarbonylContact C-O 3.56Å; C934-R937 VanDerWaalsContact CA-O 3.3Å; C934-R937 WeakPolarHBondContact CA-O 3.47Å; C934-R937 CarbonylContact O-C 3.41Å; C934-R937 PolarHBondContact O-N 3.37Å; C934-D938 PolarHBondContact O-N 3.19Å; C934-P939 HydrophobicContact CB-CG 4.45Å; C934-F968 HydrophobicContact CB-CB 3.78Å; C934-F968 HydrophobicContact CB-CD1 4.09Å; C934-F968 HydrophobicContact CB-CD2 3.72Å; C934-F968 HydrophobicContact CB-CE2 4.3Å; C934-F968 HydrophobicContact CB-CG 3.62Å
935	L	93.8	Very high	88	Confident	19 Å²	19	30.9 Å²	30.9	10%	0.099	17%	0.169	C	C	.	.	H	α-helix	trans	-68.1	-29.5	171	-70.8	172.5	0	0	0	111.9	L912 V931 F968 F1106 M1107 D1119	L912-L935 HydrophobicContact CD2-CD1 3.74Å; V931-L935 HydrophobicContact CG1-CD1 3.82Å; V931-L935 HydrophobicContact CG1-CG 4.3Å; V931-L935 WeakPolarHBondContact O-CB 3.42Å; V931-L935 WeakPolarHBondContact O-CG 3.46Å; V931-L935 PolarHBondContact O-N 2.86Å; L935-F968 HydrophobicContact CD2-CE2 4.13Å; L935-F1106 HydrophobicContact CB-CD1 4.2Å; L935-F1106 HydrophobicContact CD1-CB 3.94Å; L935-F1106 HydrophobicContact CD1-CD1 3.97Å; L935-F1106 HydrophobicContact CD1-CG 4.09Å; L935-F1106 HydrophobicContact CD2-CB 4.41Å; L935-F1106 HydrophobicContact CD2-CD1 4.24Å; L935-F1106 HydrophobicContact CG-CD1 4.37Å; L935-M1107 HydrophobicContact CD2-CE 4.2Å; L935-D1119 HydrophobicContact CD2-CB 4.42Å
936	T	89.6	Confident	86.9	Confident	62 Å²	62	31.9 Å²	31.9	38%	0.38	18%	0.175	S	C	.	.	H	α-helix	trans	-76.9	-32	172.7	-54.2	0	0	0	0	111.9	V932 S933 C934 L1007	V932-T936 PolarHBondContact O-N 2.89Å; V932-T936 VanDerWaalsContact O-N 3.09Å; V932-T936 PolarHBondContact O-OG1 3.48Å; S933-T936 WeakPolarHBondContact O-CB 3.47Å; S933-T936 PolarHBondContact O-N 3.35Å; C934-T936 VanDerWaalsContact C-N 3.28Å; C934-T936 PolarHBondContact O-N 3.18Å; T936-L1007 HydrophobicContact CG2-CD1 3.79Å
937	R	88	Confident	85.9	Confident	50 Å²	50	33.3 Å²	33.3	19%	0.189	18%	0.179	C	C	.	.	S	Bend	trans	-148.1	113.8	-179.6	176.3	55.7	61	138.1	-0.9	110.7	S735 N736 S933 C934 S1000 F1003 I1004	S735-R937 PolarHBondContact O-NH2 2.74Å; S735-R937 VanDerWaalsContact O-NH2 3.11Å; N736-R937 VanDerWaalsContact CA-NH1 3.31Å; N736-R937 PolarHBondContact O-NH1 3.28Å; S933-R937 PolarHBondContact O-N 3.14Å; C934-R937 CarbonylContact C-O 3.56Å; C934-R937 VanDerWaalsContact CA-O 3.3Å; C934-R937 WeakPolarHBondContact CA-O 3.47Å; C934-R937 CarbonylContact O-C 3.41Å; C934-R937 PolarHBondContact O-N 3.37Å; R937-S1000 WeakPolarHBondContact CD-OG 3.31Å; R937-F1003 HydrophobicContact CB-CD1 3.68Å; R937-F1003 HydrophobicContact CB-CE1 4.02Å; R937-F1003 HydrophobicContact CG-CD1 3.79Å; R937-F1003 HydrophobicContact CG-CE1 4.48Å; R937-I1004 HydrophobicContact CB-CG1 4.32Å; R937-I1004 HydrophobicContact CG-CG1 4.43Å; R937-I1004 WeakPolarHBondContact O-CD1 3.43Å
938	D	89.8	Confident	85.2	Confident	55 Å²	55	36 Å²	36	29%	0.294	20%	0.202	S	C	.	.			trans	-59.8	124.6	177.7	-164.3	-28.9	0	0	0	111.3	C934 F940 S1000	C934-D938 PolarHBondContact O-N 3.19Å; D938-F940 VanDerWaalsContact C-N 3.31Å; D938-F940 WeakPolarHBondContact OD1-CB 3.37Å; D938-F940 VanDerWaalsContact OD1-CD2 3.29Å; D938-F940 WeakPolarHBondContact OD1-CD2 3.44Å; D938-F940 PolarHBondContact OD1-N 2.85Å; D938-S1000 WeakPolarHBondContact O-CB 3.5Å; D938-S1000 PolarHBondContact O-OG 2.92Å
939	P	92.9	Very high	84.7	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.225	C	C	.	.			trans	-72.3	-21.5	176.3	28.9	-35.1	0	0	0	113.4	C934 F968 L996 Y997 L1001 I1004	C934-P939 HydrophobicContact CB-CG 4.45Å; P939-F968 HydrophobicContact CG-CD1 3.86Å; P939-F968 HydrophobicContact CG-CE1 4.28Å; P939-L996 HydrophobicContact CB-CD2 4.23Å; P939-Y997 PolarHBondContact O-N 3.09Å; P939-L1001 HydrophobicContact CB-CD2 4Å; P939-I1004 HydrophobicContact CB-CD1 3.67Å; P939-I1004 HydrophobicContact CG-CD1 4.41Å
940	F	91.3	Very high	84.2	Confident	6 Å²	6	41.1 Å²	41.1	3%	0.026	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-83.4	147.7	-176.3	-60.6	-79.9	0	0	0	111.8	D938 S942 V950 V953 K954 L957 F968 A971 N994 L995 L996	D938-F940 VanDerWaalsContact C-N 3.31Å; D938-F940 WeakPolarHBondContact OD1-CB 3.37Å; D938-F940 VanDerWaalsContact OD1-CD2 3.29Å; D938-F940 WeakPolarHBondContact OD1-CD2 3.44Å; D938-F940 PolarHBondContact OD1-N 2.85Å; F940-S942 PolarHBondContact O-N 2.92Å; F940-V950 HydrophobicContact CB-CG1 3.78Å; F940-V950 HydrophobicContact CD1-CG1 4.21Å; F940-V950 HydrophobicContact CD2-CG1 4.46Å; F940-V950 HydrophobicContact CG-CG1 3.9Å; F940-V953 HydrophobicContact CE1-CG1 4.01Å; F940-K954 HydrophobicContact CD2-CD 4.44Å; F940-K954 HydrophobicContact CD2-CG 4.28Å; F940-K954 HydrophobicContact CE1-CG 4.33Å; F940-K954 HydrophobicContact CE2-CD 4.18Å; F940-K954 VanDerWaalsContact CE2-CE 3.43Å; F940-K954 HydrophobicContact CE2-CG 3.7Å; F940-K954 HydrophobicContact CZ-CG 3.74Å; F940-L957 HydrophobicContact CE1-CD1 3.81Å; F940-L957 HydrophobicContact CZ-CD1 3.75Å; F940-F968 HydrophobicContact CD2-CD1 4.47Å; F940-F968 HydrophobicContact CD2-CE1 4.15Å; F940-F968 AromaticContact CE2-CD1 3.78Å; F940-F968 HydrophobicContact CE2-CD1 3.78Å; F940-F968 AromaticContact CE2-CE1 3.78Å; F940-F968 HydrophobicContact CE2-CE1 3.78Å; F940-A971 HydrophobicContact CZ-CB 4.25Å; F940-N994 WeakPolarHBondContact CD1-O 3.28Å; F940-L995 CarbonylContact C-O 3.53Å; F940-L995 WeakPolarHBondContact CA-O 3.24Å; F940-L996 HydrophobicContact CD1-CD2 3.62Å; F940-L996 HydrophobicContact CE1-CD2 3.66Å; F940-L996 HydrophobicContact CG-CD2 4.29Å; F940-L996 HydrophobicContact CZ-CD2 4.37Å
941	S	79.8	Confident	83.6	Confident	52 Å²	52	42.8 Å²	42.8	36%	0.364	23%	0.234	S	C	.	.			trans	-79.6	62.2	171.1	-177.8	0	0	0	0	110.3	S943 N946 L995	S941-S943 PolarHBondContact O-N 3.18Å; S941-N946 PolarHBondContact O-ND2 3.37Å; S941-N946 PolarHBondContact O-OD1 3.02Å; S941-L995 PolarHBondContact N-O 3.21Å
942	S	67.9	Low	83.2	Confident	60 Å²	60	49.8 Å²	49.8	42%	0.42	27%	0.265	S	S	.	.			trans	-73.1	118.6	-179.7	66.9	0	0	0	0	111.6	F940	F940-S942 PolarHBondContact O-N 2.92Å
943	S	63.3	Low	83	Confident	40 Å²	40	50.6 Å²	50.6	28%	0.28	27%	0.27	S	S	.	.			trans	-116.7	167.2	164.2	71.9	0	0	0	0	108.8	S941 Q945 N946 R947	S941-S943 PolarHBondContact O-N 3.18Å; S943-Q945 PolarHBondContact O-N 2.81Å; S943-Q945 PolarHBondContact OG-N 3Å; S943-N946 WeakPolarHBondContact CA-OD1 3.11Å; S943-N946 WeakPolarHBondContact CB-OD1 3.4Å; S943-N946 PolarHBondContact N-OD1 2.89Å; S943-N946 PolarHBondContact O-OD1 2.97Å; S943-N946 VanDerWaalsContact O-OD1 3.07Å; S943-N946 PolarHBondContact OG-N 3.2Å; S943-N946 PolarHBondContact OG-OD1 3.24Å; S943-R947 PolarHBondContact O-N 3.08Å
944	L	56.8	Low	82.8	Confident	110 Å²	110	51.3 Å²	51.3	58%	0.576	27%	0.273	S	S	*	.	S	Bend	trans	-59.1	-36.5	173	-83.3	163.1	0	0	0	112.1	Q708	Q708-L944 HydrophobicContact CB-CD1 3.96Å; Q708-L944 HydrophobicContact CG-CD1 3.6Å; Q708-L944 HydrophobicContact CG-CG 4.27Å
945	Q	58.4	Low	82.5	Confident	146 Å²	146	53.6 Å²	53.6	68%	0.682	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-36.3	-173.9	-68.3	173.5	-10	0	0	113	S943	S943-Q945 PolarHBondContact O-N 2.81Å; S943-Q945 PolarHBondContact OG-N 3Å
946	N	75.6	Confident	82.4	Confident	22 Å²	22	58.7 Å²	58.7	12%	0.118	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	11	-177.9	73.2	-14.8	0	0	0	113.3	S941 S943 A948 E949 V950	S941-N946 PolarHBondContact O-ND2 3.37Å; S941-N946 PolarHBondContact O-OD1 3.02Å; S943-N946 WeakPolarHBondContact CA-OD1 3.11Å; S943-N946 WeakPolarHBondContact CB-OD1 3.4Å; S943-N946 PolarHBondContact N-OD1 2.89Å; S943-N946 PolarHBondContact O-OD1 2.97Å; S943-N946 VanDerWaalsContact O-OD1 3.07Å; S943-N946 PolarHBondContact OG-N 3.2Å; S943-N946 PolarHBondContact OG-OD1 3.24Å; N946-A948 VanDerWaalsContact C-N 3.31Å; N946-A948 PolarHBondContact O-N 3.44Å; N946-E949 HydrophobicContact CB-CB 4.44Å; N946-E949 WeakPolarHBondContact O-CA 3.24Å; N946-E949 WeakPolarHBondContact O-CB 3.36Å; N946-E949 PolarHBondContact O-N 2.94Å; N946-V950 WeakPolarHBondContact O-CG2 3.41Å; N946-V950 PolarHBondContact O-N 2.8Å
947	R	77.8	Confident	82.6	Confident	65 Å²	65	56.6 Å²	56.6	25%	0.245	31%	0.305	C	S	.	.	H	α-helix	trans	-55.9	-45.7	-176.9	-174.6	170.4	173.1	-175.9	-6.7	112.3	S943 E949 V950 D951 H1087	S943-R947 PolarHBondContact O-N 3.08Å; R947-E949 PolarHBondContact O-N 2.86Å; R947-V950 PolarHBondContact O-N 3Å; R947-D951 WeakPolarHBondContact O-CB 3.34Å; R947-D951 PolarHBondContact O-N 2.99Å; R947-D951 VanDerWaalsContact O-OD2 3.13Å; R947-H1087 PolarHBondContact NH2-CE1 3.44Å; R947-H1087 PolarHBondContact NH2-ND1 2.93Å; R947-H1087 VanDerWaalsContact NH2-ND1 3.16Å; R947-H1087 PolarHBondContact NH2-NE2 3.43Å
948	A	83.3	Confident	82.7	Confident	64 Å²	64	54.4 Å²	54.4	53%	0.529	30%	0.297	S	S	.	.	H	α-helix	trans	-64.3	-28	176.4	0	0	0	0	0	113.2	N946 K952	N946-A948 VanDerWaalsContact C-N 3.31Å; N946-A948 PolarHBondContact O-N 3.44Å; A948-K952 VanDerWaalsContact O-CG 3.26Å; A948-K952 WeakPolarHBondContact O-CG 3.43Å; A948-K952 PolarHBondContact O-N 3.13Å
949	E	86.4	Confident	82.5	Confident	105 Å²	105	57.6 Å²	57.6	49%	0.491	31%	0.31	S	S	.	.	H	α-helix	trans	-77.7	-41.8	175.9	-61.7	174.2	175	0	0	111	N946 R947 D951 K952 V953 L995	N946-E949 HydrophobicContact CB-CB 4.44Å; N946-E949 WeakPolarHBondContact O-CA 3.24Å; N946-E949 WeakPolarHBondContact O-CB 3.36Å; N946-E949 PolarHBondContact O-N 2.94Å; R947-E949 PolarHBondContact O-N 2.86Å; E949-D951 VanDerWaalsContact C-N 3.31Å; E949-D951 PolarHBondContact O-N 3.16Å; E949-K952 WeakPolarHBondContact O-CB 3.27Å; E949-K952 PolarHBondContact O-N 2.95Å; E949-V953 WeakPolarHBondContact O-CG2 3.33Å; E949-V953 PolarHBondContact O-N 3.49Å; E949-L995 HydrophobicContact CB-CD1 3.7Å
950	V	87.3	Confident	82.1	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.012	34%	0.34	C	S	.	.	H	α-helix	trans	-60.3	-42.3	172.6	173.6	0	0	0	0	110.8	F940 N946 R947 K952 V953 K954 L995	F940-V950 HydrophobicContact CB-CG1 3.78Å; F940-V950 HydrophobicContact CD1-CG1 4.21Å; F940-V950 HydrophobicContact CD2-CG1 4.46Å; F940-V950 HydrophobicContact CG-CG1 3.9Å; N946-V950 WeakPolarHBondContact O-CG2 3.41Å; N946-V950 PolarHBondContact O-N 2.8Å; R947-V950 PolarHBondContact O-N 3Å; V950-K952 VanDerWaalsContact C-N 3.31Å; V950-K952 PolarHBondContact O-N 2.75Å; V950-V953 PolarHBondContact O-N 3.37Å; V950-K954 HydrophobicContact CG1-CD 4.26Å; V950-K954 HydrophobicContact CG1-CG 4.45Å; V950-K954 WeakPolarHBondContact O-CG 3.46Å; V950-K954 PolarHBondContact O-N 3.42Å; V950-L995 HydrophobicContact CG2-CB 4.28Å; V950-L995 HydrophobicContact CG2-CD1 3.92Å
951	D	87	Confident	81.9	Confident	36 Å²	36	63.1 Å²	63.1	19%	0.193	34%	0.34	C	S	.	.	H	α-helix	trans	-64.5	-35.9	178	-64.4	-26.2	0	0	0	111.2	R947 E949 A955	R947-D951 WeakPolarHBondContact O-CB 3.34Å; R947-D951 PolarHBondContact O-N 2.99Å; R947-D951 VanDerWaalsContact O-OD2 3.13Å; E949-D951 VanDerWaalsContact C-N 3.31Å; E949-D951 PolarHBondContact O-N 3.16Å; D951-A955 WeakPolarHBondContact O-CB 3.16Å; D951-A955 PolarHBondContact O-N 3.12Å
952	K	89.7	Confident	82.4	Confident	148 Å²	148	61 Å²	61	64%	0.643	33%	0.327	S	S	*	.	H	α-helix	trans	-65.3	-43.8	171.4	-72.6	169.1	-171.8	176.7	0	112.5	A948 E949 V950 A955 L956	A948-K952 VanDerWaalsContact O-CG 3.26Å; A948-K952 WeakPolarHBondContact O-CG 3.43Å; A948-K952 PolarHBondContact O-N 3.13Å; E949-K952 WeakPolarHBondContact O-CB 3.27Å; E949-K952 PolarHBondContact O-N 2.95Å; V950-K952 VanDerWaalsContact C-N 3.31Å; V950-K952 PolarHBondContact O-N 2.75Å; K952-A955 WeakPolarHBondContact O-CB 3.18Å; K952-A955 PolarHBondContact O-N 3.18Å; K952-L956 PolarHBondContact O-N 3.48Å
953	V	91.8	Very high	83.7	Confident	18 Å²	18	58.2 Å²	58.2	11%	0.109	31%	0.307	C	S	.	.	H	α-helix	trans	-63.6	-43.4	176.9	171.1	0	0	0	0	110.6	F940 E949 V950 A955 L956 L957 N994 L995	F940-V953 HydrophobicContact CE1-CG1 4.01Å; E949-V953 WeakPolarHBondContact O-CG2 3.33Å; E949-V953 PolarHBondContact O-N 3.49Å; V950-V953 PolarHBondContact O-N 3.37Å; V953-A955 VanDerWaalsContact C-N 3.32Å; V953-A955 PolarHBondContact O-N 2.85Å; V953-L956 WeakPolarHBondContact O-CB 3.06Å; V953-L956 PolarHBondContact O-N 3.42Å; V953-L957 HydrophobicContact CG1-CD1 3.75Å; V953-L957 HydrophobicContact CG1-CG 4.27Å; V953-L957 WeakPolarHBondContact O-CB 3.46Å; V953-L957 WeakPolarHBondContact O-CG 3.42Å; V953-L957 PolarHBondContact O-N 2.88Å; V953-N994 HydrophobicContact CG1-CB 4.24Å; V953-L995 HydrophobicContact CG2-CD1 4.01Å; V953-L995 HydrophobicContact CG2-CG 4.27Å
954	K	92	Very high	85.2	Confident	15 Å²	15	56.4 Å²	56.4	7%	0.065	30%	0.295	C	S	.	.	H	α-helix	trans	-59.7	-41.7	173.8	-75.2	177.6	177.9	178.6	0	111.9	F940 V950 L957 S958 I1091	F940-K954 HydrophobicContact CD2-CD 4.44Å; F940-K954 HydrophobicContact CD2-CG 4.28Å; F940-K954 HydrophobicContact CE1-CG 4.33Å; F940-K954 HydrophobicContact CE2-CD 4.18Å; F940-K954 VanDerWaalsContact CE2-CE 3.43Å; F940-K954 HydrophobicContact CE2-CG 3.7Å; F940-K954 HydrophobicContact CZ-CG 3.74Å; V950-K954 HydrophobicContact CG1-CD 4.26Å; V950-K954 HydrophobicContact CG1-CG 4.45Å; V950-K954 WeakPolarHBondContact O-CG 3.46Å; V950-K954 PolarHBondContact O-N 3.42Å; K954-L957 PolarHBondContact O-N 3.45Å; K954-S958 WeakPolarHBondContact O-CB 3.39Å; K954-S958 PolarHBondContact O-N 3.32Å; K954-I1091 HydrophobicContact CB-CG2 3.75Å
955	A	89.7	Confident	87.1	Confident	50 Å²	50	51.3 Å²	51.3	41%	0.413	27%	0.268	S	S	.	.	H	α-helix	trans	-62.9	-41.9	175.2	0	0	0	0	0	111.8	D951 K952 V953 S958 H959 I1091	D951-A955 WeakPolarHBondContact O-CB 3.16Å; D951-A955 PolarHBondContact O-N 3.12Å; K952-A955 WeakPolarHBondContact O-CB 3.18Å; K952-A955 PolarHBondContact O-N 3.18Å; V953-A955 VanDerWaalsContact C-N 3.32Å; V953-A955 PolarHBondContact O-N 2.85Å; A955-S958 PolarHBondContact O-N 3.23Å; A955-H959 PolarHBondContact O-N 3.47Å; A955-I1091 HydrophobicContact CB-CG2 4.37Å
956	L	91.8	Very high	89	Confident	127 Å²	127	44.8 Å²	44.8	67%	0.665	24%	0.238	S	C	*	.	H	α-helix	trans	-62.7	-47.9	175.7	-176.7	66.4	0	0	0	111.7	K952 V953 S958 H959	K952-L956 PolarHBondContact O-N 3.48Å; V953-L956 WeakPolarHBondContact O-CB 3.06Å; V953-L956 PolarHBondContact O-N 3.42Å; L956-S958 VanDerWaalsContact C-N 3.34Å; L956-S958 PolarHBondContact O-N 3.39Å; L956-H959 PolarHBondContact O-N 2.89Å; L956-H959 PolarHBondContact O-ND1 3.39Å
957	L	93.5	Very high	90	Very high	18 Å²	18	43.8 Å²	43.8	9%	0.094	23%	0.232	C	C	.	.	H	α-helix	trans	-66.9	-32.5	177.8	-72.3	169.2	0	0	0	112.3	F940 V953 K954 H959 A967 R970 A971	F940-L957 HydrophobicContact CE1-CD1 3.81Å; F940-L957 HydrophobicContact CZ-CD1 3.75Å; V953-L957 HydrophobicContact CG1-CD1 3.75Å; V953-L957 HydrophobicContact CG1-CG 4.27Å; V953-L957 WeakPolarHBondContact O-CB 3.46Å; V953-L957 WeakPolarHBondContact O-CG 3.42Å; V953-L957 PolarHBondContact O-N 2.88Å; K954-L957 PolarHBondContact O-N 3.45Å; L957-H959 PolarHBondContact O-N 3.06Å; L957-A967 HydrophobicContact CB-CB 3.99Å; L957-R970 HydrophobicContact CD2-CB 4.44Å; L957-R970 WeakPolarHBondContact O-CD 3.41Å; L957-R970 PolarHBondContact O-NH1 2.79Å; L957-A971 HydrophobicContact CD1-CB 4Å
958	S	90.4	Very high	90.9	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.021	22%	0.222	C	C	.	.	H	α-helix	trans	-67.6	-20.1	174.9	166	0	0	0	0	112.4	K954 A955 L956 D960 S961 G962 S963 R970 I1091	K954-S958 WeakPolarHBondContact O-CB 3.39Å; K954-S958 PolarHBondContact O-N 3.32Å; A955-S958 PolarHBondContact O-N 3.23Å; L956-S958 VanDerWaalsContact C-N 3.34Å; L956-S958 PolarHBondContact O-N 3.39Å; S958-D960 PolarHBondContact O-N 2.93Å; S958-S961 WeakPolarHBondContact O-CB 3.38Å; S958-S961 PolarHBondContact O-N 3.21Å; S958-S961 VanDerWaalsContact O-N 3.1Å; S958-S961 PolarHBondContact O-OG 2.81Å; S958-S961 PolarHBondContact OG-OG 3.34Å; S958-G962 PolarHBondContact OG-N 3.5Å; S958-S963 PolarHBondContact OG-N 3.37Å; S958-R970 VanDerWaalsContact CA-NH1 3.33Å; S958-R970 PolarHBondContact O-NH1 3.39Å; S958-I1091 WeakPolarHBondContact OG-CD1 3.38Å
959	H	86.5	Confident	91.6	Very high	122 Å²	122	39.3 Å²	39.3	57%	0.565	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	48.2	-138.9	-166.4	-52.8	-43.5	0	0	0	109.3	A955 L956 L957 S961 R970	A955-H959 PolarHBondContact O-N 3.47Å; L956-H959 PolarHBondContact O-N 2.89Å; L956-H959 PolarHBondContact O-ND1 3.39Å; L957-H959 PolarHBondContact O-N 3.06Å; H959-S961 VanDerWaalsContact C-N 3.34Å; H959-S961 PolarHBondContact O-N 3.45Å; H959-R970 VanDerWaalsContact CD2-CZ 3.43Å
960	D	84.3	Confident	92.1	Very high	118 Å²	118	36.4 Å²	36.4	63%	0.631	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-90.4	10.9	177.1	-58.6	-28.8	0	0	0	114.3	S958 G962 R1099	S958-D960 PolarHBondContact O-N 2.93Å; D960-G962 VanDerWaalsContact C-N 3.27Å; D960-G962 PolarHBondContact O-N 2.91Å; D960-R1099 VanDerWaalsContact CB-CZ 3.42Å; D960-R1099 VanDerWaalsContact O-CZ 3.26Å; D960-R1099 PolarHBondContact O-NE 3.12Å; D960-R1099 PolarHBondContact O-NH1 3.46Å; D960-R1099 IonicContact OD2-NH2 3.79Å; D960-R1099 PolarHBondContact OD2-NH2 3.2Å
961	S	87.2	Confident	92.5	Very high	5 Å²	5	36.3 Å²	36.3	4%	0.035	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-71.7	-20.6	-174.2	71.4	0	0	0	0	113.9	S958 H959 S963 K1045	S958-S961 WeakPolarHBondContact O-CB 3.38Å; S958-S961 PolarHBondContact O-N 3.21Å; S958-S961 VanDerWaalsContact O-N 3.1Å; S958-S961 PolarHBondContact O-OG 2.81Å; S958-S961 PolarHBondContact OG-OG 3.34Å; H959-S961 VanDerWaalsContact C-N 3.34Å; H959-S961 PolarHBondContact O-N 3.45Å; S961-S963 VanDerWaalsContact C-N 3.31Å; S961-S963 PolarHBondContact O-N 2.93Å; S961-S963 PolarHBondContact OG-N 2.97Å; S961-K1045 PolarHBondContact O-NZ 3.1Å
962	G	89.9	Confident	93	Very high	8 Å²	8	34.6 Å²	34.6	8%	0.082	18%	0.179	C	C	.	.			trans	62.2	36	-175.6	0	0	0	0	0	113.1	S958 D960 N1092 S1121 Q1122	S958-G962 PolarHBondContact OG-N 3.5Å; D960-G962 VanDerWaalsContact C-N 3.27Å; D960-G962 PolarHBondContact O-N 2.91Å; G962-N1092 PolarHBondContact O-ND2 2.74Å; G962-N1092 PolarHBondContact O-OD1 3.49Å; G962-S1121 WeakPolarHBondContact O-CA 3.25Å; G962-Q1122 PolarHBondContact O-N 2.87Å
963	S	94.9	Very high	93.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-130.6	114.2	-176	177.7	0	0	0	0	113.1	S958 S961 H965 L966 A967 S1121	S958-S963 PolarHBondContact OG-N 3.37Å; S961-S963 VanDerWaalsContact C-N 3.31Å; S961-S963 PolarHBondContact O-N 2.93Å; S961-S963 PolarHBondContact OG-N 2.97Å; S963-H965 PolarHBondContact O-N 2.85Å; S963-H965 PolarHBondContact OG-N 2.96Å; S963-L966 PolarHBondContact O-N 3.29Å; S963-L966 WeakPolarHBondContact OG-CG 3.23Å; S963-L966 PolarHBondContact OG-N 3.47Å; S963-A967 PolarHBondContact O-N 2.88Å; S963-A967 VanDerWaalsContact O-N 3.16Å; S963-S1121 WeakPolarHBondContact CA-OG 3.2Å; S963-S1121 VanDerWaalsContact CB-OG 3.32Å; S963-S1121 WeakPolarHBondContact CB-OG 3.35Å; S963-S1121 WeakPolarHBondContact OG-CB 3.49Å; S963-S1121 PolarHBondContact OG-OG 2.96Å
964	D	95.2	Very high	93.3	Very high	3 Å²	3	29.5 Å²	29.5	2%	0.016	17%	0.168	C	C	.	.	H	α-helix	trans	-60.2	-36.4	168.5	-65.8	-58	0	0	0	110.8	A967 F968 T1090 I1091 S1120	D964-A967 WeakPolarHBondContact O-CB 3.42Å; D964-A967 PolarHBondContact O-N 3.39Å; D964-F968 PolarHBondContact O-N 2.68Å; D964-F968 VanDerWaalsContact O-N 3.1Å; D964-T1090 WeakPolarHBondContact OD2-CA 3.49Å; D964-T1090 WeakPolarHBondContact OD2-CB 3.34Å; D964-T1090 PolarHBondContact OD2-OG1 3.25Å; D964-I1091 WeakPolarHBondContact OD1-CG1 3.34Å; D964-I1091 WeakPolarHBondContact OD1-CG2 3.49Å; D964-I1091 PolarHBondContact OD1-N 2.9Å; D964-S1120 PolarHBondContact N-O 2.74Å; D964-S1120 PolarHBondContact OD2-N 3.43Å
965	H	97.4	Very high	93.5	Very high	3 Å²	3	29.6 Å²	29.6	1%	0.014	17%	0.168	C	C	.	.	H	α-helix	trans	-66.6	-41.7	-178.8	-57.9	114.4	0	0	0	112.4	V931 S963 A967 F968 V969 L1048 D1119 S1121	V931-H965 HydrophobicContact CG1-CB 4.02Å; V931-H965 HydrophobicContact CG2-CB 3.82Å; V931-H965 WeakPolarHBondContact CG2-O 3.17Å; S963-H965 PolarHBondContact O-N 2.85Å; S963-H965 PolarHBondContact OG-N 2.96Å; H965-A967 VanDerWaalsContact C-N 3.32Å; H965-F968 WeakPolarHBondContact O-CB 3.32Å; H965-F968 PolarHBondContact O-N 3.1Å; H965-V969 WeakPolarHBondContact O-CG2 3.47Å; H965-V969 PolarHBondContact O-N 2.96Å; H965-V969 VanDerWaalsContact O-N 3.15Å; H965-L1048 HydrophobicContact CB-CD2 3.74Å; H965-L1048 VanDerWaalsContact ND1-CD2 3.3Å; H965-L1048 WeakPolarHBondContact ND1-CD2 3.28Å; H965-D1119 IonicContact CE1-OD2 3.82Å; H965-D1119 PolarHBondContact CE1-OD2 3.39Å; H965-D1119 IonicContact NE2-OD2 3.38Å; H965-D1119 PolarHBondContact NE2-OD2 2.87Å; H965-D1119 VanDerWaalsContact NE2-OD2 3.12Å; H965-S1121 PolarHBondContact ND1-OG 3.07Å
966	L	97.1	Very high	93.7	Very high	9 Å²	9	30 Å²	30	5%	0.047	16%	0.161	C	C	.	.	H	α-helix	trans	-70.2	-29.3	173.6	-65.9	178.6	0	0	0	112.4	S963 F968 V969 R970 E1041 V1044 K1045	S963-L966 PolarHBondContact O-N 3.29Å; S963-L966 WeakPolarHBondContact OG-CG 3.23Å; S963-L966 PolarHBondContact OG-N 3.47Å; L966-F968 VanDerWaalsContact C-N 3.27Å; L966-F968 PolarHBondContact O-N 3.47Å; L966-V969 PolarHBondContact O-N 3.19Å; L966-R970 PolarHBondContact O-N 3.13Å; L966-E1041 HydrophobicContact CD1-CB 3.86Å; L966-E1041 HydrophobicContact CD1-CG 3.99Å; L966-V1044 HydrophobicContact CD2-CG1 3.87Å; L966-K1045 HydrophobicContact CD1-CD 3.85Å; L966-K1045 HydrophobicContact CD1-CG 4.07Å; L966-K1045 HydrophobicContact CG-CG 4.35Å
967	A	96.2	Very high	93.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.8	-38.3	169.9	0	0	0	0	0	111.4	L957 S963 D964 H965 A971	L957-A967 HydrophobicContact CB-CB 3.99Å; S963-A967 PolarHBondContact O-N 2.88Å; S963-A967 VanDerWaalsContact O-N 3.16Å; D964-A967 WeakPolarHBondContact O-CB 3.42Å; D964-A967 PolarHBondContact O-N 3.39Å; H965-A967 VanDerWaalsContact C-N 3.32Å; A967-A971 WeakPolarHBondContact O-CB 3.23Å; A967-A971 PolarHBondContact O-N 2.88Å
968	F	97.3	Very high	93.6	Very high	10 Å²	10	28.5 Å²	28.5	4%	0.044	15%	0.151	C	C	.	.	H	α-helix	trans	-63.4	-44.4	171.7	-61.9	-37.6	0	0	0	112.8	C934 L935 P939 F940 D964 H965 L966 R970 A971 V972	C934-F968 HydrophobicContact CB-CB 3.78Å; C934-F968 HydrophobicContact CB-CD1 4.09Å; C934-F968 HydrophobicContact CB-CD2 3.72Å; C934-F968 HydrophobicContact CB-CE2 4.3Å; C934-F968 HydrophobicContact CB-CG 3.62Å; L935-F968 HydrophobicContact CD2-CE2 4.13Å; P939-F968 HydrophobicContact CG-CD1 3.86Å; P939-F968 HydrophobicContact CG-CE1 4.28Å; F940-F968 HydrophobicContact CD2-CD1 4.47Å; F940-F968 HydrophobicContact CD2-CE1 4.15Å; F940-F968 AromaticContact CE2-CD1 3.78Å; F940-F968 HydrophobicContact CE2-CD1 3.78Å; F940-F968 AromaticContact CE2-CE1 3.78Å; F940-F968 HydrophobicContact CE2-CE1 3.78Å; D964-F968 PolarHBondContact O-N 2.68Å; D964-F968 VanDerWaalsContact O-N 3.1Å; H965-F968 WeakPolarHBondContact O-CB 3.32Å; H965-F968 PolarHBondContact O-N 3.1Å; L966-F968 VanDerWaalsContact C-N 3.27Å; L966-F968 PolarHBondContact O-N 3.47Å; F968-R970 VanDerWaalsContact C-N 3.34Å; F968-R970 PolarHBondContact O-N 3.49Å; F968-A971 PolarHBondContact O-N 3.14Å; F968-V972 WeakPolarHBondContact O-CG2 3.35Å; F968-V972 PolarHBondContact O-N 3.42Å; F968-V972 VanDerWaalsContact O-N 3.12Å
969	V	97.5	Very high	93.6	Very high	25 Å²	25	31.1 Å²	31.1	15%	0.152	17%	0.165	C	C	.	.	H	α-helix	trans	-58.1	-48.2	179.1	176.7	0	0	0	0	110.5	P927 V930 V931 H965 L966 V972 A973	P927-V969 HydrophobicContact CB-CG1 4.18Å; P927-V969 HydrophobicContact CB-CG2 3.95Å; V930-V969 HydrophobicContact CB-CG2 4.47Å; V930-V969 HydrophobicContact CG1-CG2 4.46Å; V931-V969 HydrophobicContact CG2-CG2 3.72Å; H965-V969 WeakPolarHBondContact O-CG2 3.47Å; H965-V969 PolarHBondContact O-N 2.96Å; H965-V969 VanDerWaalsContact O-N 3.15Å; L966-V969 PolarHBondContact O-N 3.19Å; V969-V972 PolarHBondContact O-N 3.29Å; V969-A973 VanDerWaalsContact O-CB 3.32Å; V969-A973 WeakPolarHBondContact O-CB 3.31Å; V969-A973 PolarHBondContact O-N 2.97Å
970	R	96.8	Very high	93.8	Very high	45 Å²	45	33.9 Å²	33.9	17%	0.17	17%	0.17	C	C	.	.	H	α-helix	trans	-70.1	-36.2	-178.5	-69	167.3	-172.1	143	0.9	113.2	L957 S958 H959 L966 F968 V972 A973 G974 E1041	L957-R970 HydrophobicContact CD2-CB 4.44Å; L957-R970 WeakPolarHBondContact O-CD 3.41Å; L957-R970 PolarHBondContact O-NH1 2.79Å; S958-R970 VanDerWaalsContact CA-NH1 3.33Å; S958-R970 PolarHBondContact O-NH1 3.39Å; H959-R970 VanDerWaalsContact CD2-CZ 3.43Å; L966-R970 PolarHBondContact O-N 3.13Å; F968-R970 VanDerWaalsContact C-N 3.34Å; F968-R970 PolarHBondContact O-N 3.49Å; R970-V972 VanDerWaalsContact C-N 3.31Å; R970-V972 PolarHBondContact O-N 3.48Å; R970-A973 PolarHBondContact O-N 3.49Å; R970-G974 PolarHBondContact O-N 3.04Å; R970-E1041 IonicContact CZ-OE1 3.71Å; R970-E1041 IonicContact NH2-OE1 3.33Å; R970-E1041 PolarHBondContact NH2-OE1 3.36Å; R970-E1041 IonicContact NH2-OE2 3.84Å; R970-E1041 PolarHBondContact NH2-OE2 2.97Å
971	A	96.5	Very high	93.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.8	-43.6	173.4	0	0	0	0	0	111.9	F940 L957 A967 F968 W975 Y990 L996	F940-A971 HydrophobicContact CZ-CB 4.25Å; L957-A971 HydrophobicContact CD1-CB 4Å; A967-A971 WeakPolarHBondContact O-CB 3.23Å; A967-A971 PolarHBondContact O-N 2.88Å; F968-A971 PolarHBondContact O-N 3.14Å; A971-W975 WeakPolarHBondContact O-CB 3.44Å; A971-W975 PolarHBondContact O-N 3.33Å; A971-Y990 PolarHBondContact O-OH 3.22Å; A971-Y990 VanDerWaalsContact O-OH 3.09Å; A971-L996 HydrophobicContact CB-CD2 4.12Å
972	V	96.5	Very high	93.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-75.8	-41.1	179.6	175.8	0	0	0	0	111.1	V930 F968 V969 R970 G974 W975 E976 L1001 I1004	V930-V972 HydrophobicContact CG1-CB 3.73Å; V930-V972 HydrophobicContact CG1-CG1 4.14Å; V930-V972 HydrophobicContact CG1-CG2 3.69Å; V930-V972 HydrophobicContact CG2-CG1 4.28Å; F968-V972 WeakPolarHBondContact O-CG2 3.35Å; F968-V972 PolarHBondContact O-N 3.42Å; F968-V972 VanDerWaalsContact O-N 3.12Å; V969-V972 PolarHBondContact O-N 3.29Å; R970-V972 VanDerWaalsContact C-N 3.31Å; R970-V972 PolarHBondContact O-N 3.48Å; V972-G974 PolarHBondContact O-N 2.98Å; V972-W975 WeakPolarHBondContact O-CB 3.32Å; V972-W975 PolarHBondContact O-N 3.49Å; V972-W975 VanDerWaalsContact O-N 3.14Å; V972-E976 HydrophobicContact CG1-CG 4.28Å; V972-E976 WeakPolarHBondContact O-CG 3.43Å; V972-E976 PolarHBondContact O-N 2.89Å; V972-L1001 HydrophobicContact CG2-CD2 4.17Å; V972-I1004 HydrophobicContact CG2-CG2 4.34Å
973	A	95.1	Very high	93.4	Very high	45 Å²	45	47.1 Å²	47.1	37%	0.372	22%	0.22	S	C	.	.	H	α-helix	trans	-59.6	-44.8	177.5	0	0	0	0	0	112.3	V969 R970 W975 E976 E977	V969-A973 VanDerWaalsContact O-CB 3.32Å; V969-A973 WeakPolarHBondContact O-CB 3.31Å; V969-A973 PolarHBondContact O-N 2.97Å; R970-A973 PolarHBondContact O-N 3.49Å; A973-W975 VanDerWaalsContact C-N 3.34Å; A973-W975 PolarHBondContact O-N 3.02Å; A973-E976 PolarHBondContact O-N 3.45Å; A973-E977 PolarHBondContact O-N 2.87Å
974	G	94.7	Very high	93.1	Very high	13 Å²	13	55.7 Å²	55.7	13%	0.134	25%	0.252	C	S	.	.	H	α-helix	trans	-66.1	-36.1	175.3	0	0	0	0	0	112.4	R970 V972 E977 V978 Y990	R970-G974 PolarHBondContact O-N 3.04Å; V972-G974 PolarHBondContact O-N 2.98Å; G974-E977 PolarHBondContact O-N 3.1Å; G974-V978 VanDerWaalsContact O-CG2 3.3Å; G974-V978 WeakPolarHBondContact O-CG2 3.08Å; G974-V978 PolarHBondContact O-N 3.2Å; G974-Y990 VanDerWaalsContact C-CZ 3.49Å; G974-Y990 WeakPolarHBondContact CA-OH 3.24Å
975	W	95.3	Very high	93	Very high	18 Å²	18	59.3 Å²	59.3	7%	0.068	28%	0.275	C	S	.	.	H	α-helix	trans	-63.7	-43.9	172.6	176	-116.4	0	0	0	112.7	A971 V972 A973 E977 V978 L979 R987 Y990 L991 L1001 H1005	A971-W975 WeakPolarHBondContact O-CB 3.44Å; A971-W975 PolarHBondContact O-N 3.33Å; V972-W975 WeakPolarHBondContact O-CB 3.32Å; V972-W975 PolarHBondContact O-N 3.49Å; V972-W975 VanDerWaalsContact O-N 3.14Å; A973-W975 VanDerWaalsContact C-N 3.34Å; A973-W975 PolarHBondContact O-N 3.02Å; W975-E977 VanDerWaalsContact C-N 3.3Å; W975-E977 PolarHBondContact O-N 3.27Å; W975-V978 PolarHBondContact O-N 2.97Å; W975-L979 HydrophobicContact CD2-CG 4.33Å; W975-L979 HydrophobicContact CH2-CD2 4.29Å; W975-L979 HydrophobicContact CZ2-CD1 4.43Å; W975-L979 HydrophobicContact CZ2-CD2 3.82Å; W975-L979 HydrophobicContact CZ2-CG 4.18Å; W975-L979 WeakPolarHBondContact O-CG 3.36Å; W975-L979 PolarHBondContact O-N 3.46Å; W975-R987 HydrophobicContact CH2-CB 4.16Å; W975-R987 HydrophobicContact CH2-CG 4.35Å; W975-R987 HydrophobicContact CZ3-CB 3.99Å; W975-R987 HydrophobicContact CZ3-CG 4.24Å; W975-Y990 HydrophobicContact CB-CD1 4.31Å; W975-Y990 HydrophobicContact CB-CE1 3.88Å; W975-Y990 AromaticContact CE3-CD1 3.98Å; W975-Y990 HydrophobicContact CE3-CD1 3.98Å; W975-L991 HydrophobicContact CE3-CD2 3.98Å; W975-L991 HydrophobicContact CE3-CG 4.25Å; W975-L991 HydrophobicContact CH2-CD1 3.88Å; W975-L991 HydrophobicContact CH2-CD2 4Å; W975-L991 HydrophobicContact CH2-CG 4.02Å; W975-L991 HydrophobicContact CZ3-CD1 3.91Å; W975-L991 HydrophobicContact CZ3-CD2 3.68Å; W975-L991 HydrophobicContact CZ3-CG 3.58Å; W975-L1001 HydrophobicContact CB-CD1 4.37Å; W975-L1001 HydrophobicContact CD2-CD1 3.74Å; W975-L1001 HydrophobicContact CE3-CD1 4.32Å; W975-L1001 HydrophobicContact CG-CD1 3.74Å; W975-L1001 HydrophobicContact CG-CD2 4.35Å; W975-L1001 HydrophobicContact CG-CG 4.48Å; W975-H1005 AromaticContact CD1-CE1 3.48Å; W975-H1005 VanDerWaalsContact CD1-CE1 3.48Å; W975-H1005 AromaticContact CD1-NE2 3.73Å; W975-H1005 AromaticContact NE1-CE1 3.62Å
976	E	92.9	Very high	92.7	Very high	59 Å²	59	61.4 Å²	61.4	28%	0.276	29%	0.29	S	S	.	.	H	α-helix	trans	-62.5	-37.7	175.9	-73	-178.4	165.3	0	0	111.9	H926 V972 A973 L979 R980 H1005	H926-E976 IonicContact NE2-OE2 3.28Å; V972-E976 HydrophobicContact CG1-CG 4.28Å; V972-E976 WeakPolarHBondContact O-CG 3.43Å; V972-E976 PolarHBondContact O-N 2.89Å; A973-E976 PolarHBondContact O-N 3.45Å; E976-L979 PolarHBondContact O-N 3.33Å; E976-R980 PolarHBondContact O-N 3.42Å; E976-H1005 IonicContact OE1-NE2 3.14Å
977	E	92.4	Very high	92.5	Very high	94 Å²	94	64.4 Å²	64.4	44%	0.439	30%	0.301	S	S	.	.	H	α-helix	trans	-62.2	-50.1	172.9	-175.7	170.3	-164.2	0	0	111.8	A973 G974 W975 L979 R980 W981	A973-E977 PolarHBondContact O-N 2.87Å; G974-E977 PolarHBondContact O-N 3.1Å; W975-E977 VanDerWaalsContact C-N 3.3Å; W975-E977 PolarHBondContact O-N 3.27Å; E977-L979 PolarHBondContact O-N 2.99Å; E977-R980 WeakPolarHBondContact O-CB 3.23Å; E977-R980 PolarHBondContact O-N 3.26Å; E977-W981 PolarHBondContact O-NE1 3.36Å
978	V	92.6	Very high	92.3	Very high	19 Å²	19	68.1 Å²	68.1	12%	0.115	32%	0.318	C	S	.	.	H	α-helix	trans	-62	-29.9	178.1	176.3	0	0	0	0	112.4	G974 W975 R980 S986 R987 Y990	G974-V978 VanDerWaalsContact O-CG2 3.3Å; G974-V978 WeakPolarHBondContact O-CG2 3.08Å; G974-V978 PolarHBondContact O-N 3.2Å; W975-V978 PolarHBondContact O-N 2.97Å; V978-R980 VanDerWaalsContact C-N 3.34Å; V978-R980 PolarHBondContact O-N 2.93Å; V978-S986 VanDerWaalsContact CG1-C 3.46Å; V978-S986 WeakPolarHBondContact CG1-O 3.47Å; V978-R987 VanDerWaalsContact CG1-CA 3.42Å; V978-R987 HydrophobicContact CG1-CB 4.1Å; V978-R987 HydrophobicContact CG1-CG 3.59Å; V978-Y990 HydrophobicContact CG2-CD2 3.95Å; V978-Y990 HydrophobicContact CG2-CG 3.97Å
979	L	90.4	Very high	92.1	Very high	57 Å²	57	71 Å²	71	30%	0.298	33%	0.334	S	S	.	.	H	α-helix	trans	-65.8	-33.1	172.5	-76.1	176.5	0	0	0	113.3	W975 E976 E977 Q982 R987	W975-L979 HydrophobicContact CD2-CG 4.33Å; W975-L979 HydrophobicContact CH2-CD2 4.29Å; W975-L979 HydrophobicContact CZ2-CD1 4.43Å; W975-L979 HydrophobicContact CZ2-CD2 3.82Å; W975-L979 HydrophobicContact CZ2-CG 4.18Å; W975-L979 WeakPolarHBondContact O-CG 3.36Å; W975-L979 PolarHBondContact O-N 3.46Å; E976-L979 PolarHBondContact O-N 3.33Å; E977-L979 PolarHBondContact O-N 2.99Å; L979-Q982 PolarHBondContact O-N 3.49Å; L979-R987 PolarHBondContact O-NH2 3.28Å
980	R	89.6	Confident	92	Very high	180 Å²	180	71.4 Å²	71.4	68%	0.679	33%	0.333	S	S	*	.	H	α-helix	trans	-66.7	-34.8	-178.7	-71.9	-174.4	-79.7	-142.8	-3.6	113.3	E976 E977 V978 Q982	E976-R980 PolarHBondContact O-N 3.42Å; E977-R980 WeakPolarHBondContact O-CB 3.23Å; E977-R980 PolarHBondContact O-N 3.26Å; V978-R980 VanDerWaalsContact C-N 3.34Å; V978-R980 PolarHBondContact O-N 2.93Å; R980-Q982 PolarHBondContact O-N 3.3Å
981	W	85.4	Confident	91.9	Very high	181 Å²	181	70.7 Å²	70.7	69%	0.686	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-12.2	-177.2	-59.5	102.6	0	0	0	114.4	E977 D983	E977-W981 PolarHBondContact O-NE1 3.36Å; W981-D983 PolarHBondContact O-N 3.41Å
982	Q	78.3	Confident	91.7	Very high	164 Å²	164	77.4 Å²	77.4	77%	0.766	36%	0.364	S	S	*	.			trans	57	9.5	-177.3	-59.9	-171.9	-0.2	0	0	116	L979 R980	L979-Q982 PolarHBondContact O-N 3.49Å; R980-Q982 PolarHBondContact O-N 3.3Å
983	D	89	Confident	91.5	Very high	65 Å²	65	84 Å²	84	35%	0.348	39%	0.394	S	S	.	.			trans	-84	131.5	174.7	178	34.6	0	0	0	111.4	W981 T985 S986 R987	W981-D983 PolarHBondContact O-N 3.41Å; D983-T985 PolarHBondContact OD1-N 3.25Å; D983-S986 VanDerWaalsContact OD2-CB 3.25Å; D983-S986 WeakPolarHBondContact OD2-CB 3.43Å; D983-S986 PolarHBondContact OD2-N 2.91Å; D983-S986 PolarHBondContact OD2-OG 3.48Å; D983-R987 WeakPolarHBondContact O-CD 3.39Å; D983-R987 WeakPolarHBondContact O-CG 3.22Å
984	R	90	Very high	91.5	Very high	179 Å²	179	82.7 Å²	82.7	68%	0.675	38%	0.381	S	S	*	.	H	α-helix	trans	-75.2	-39.3	179.6	-178	176.7	172	-179.8	-4.9	111.6	R987 E988	R984-R987 WeakPolarHBondContact O-CB 3.49Å; R984-R987 PolarHBondContact O-N 3.29Å; R984-E988 IonicContact CZ-OE1 2.92Å; R984-E988 IonicContact NE-OE1 3.11Å; R984-E988 PolarHBondContact NE-OE1 3.27Å; R984-E988 IonicContact NH2-OE1 2.85Å; R984-E988 PolarHBondContact NH2-OE1 3.48Å; R984-E988 PolarHBondContact O-N 3.28Å
985	T	92.4	Very high	91.4	Very high	79 Å²	79	84 Å²	84	49%	0.485	39%	0.385	S	S	.	.	H	α-helix	trans	-67.9	-44.7	-176.3	-58.8	0	0	0	0	110.9	D983 R987 E988 N989	D983-T985 PolarHBondContact OD1-N 3.25Å; T985-R987 VanDerWaalsContact C-N 3.25Å; T985-R987 PolarHBondContact O-N 2.94Å; T985-E988 PolarHBondContact O-N 3.02Å; T985-N989 WeakPolarHBondContact O-CB 3.47Å; T985-N989 PolarHBondContact O-N 3.25Å; T985-N989 PolarHBondContact O-OD1 3.03Å
986	S	91.1	Very high	91.3	Very high	48 Å²	48	83.7 Å²	83.7	34%	0.336	38%	0.384	S	S	.	.	H	α-helix	trans	-57.4	-38.3	174.1	-60.5	0	0	0	0	112.5	V978 D983 Y990	V978-S986 VanDerWaalsContact CG1-C 3.46Å; V978-S986 WeakPolarHBondContact CG1-O 3.47Å; D983-S986 VanDerWaalsContact OD2-CB 3.25Å; D983-S986 WeakPolarHBondContact OD2-CB 3.43Å; D983-S986 PolarHBondContact OD2-N 2.91Å; D983-S986 PolarHBondContact OD2-OG 3.48Å; S986-Y990 WeakPolarHBondContact O-CB 3.39Å; S986-Y990 PolarHBondContact O-N 3.03Å
987	R	92.1	Very high	91.1	Very high	72 Å²	72	84.3 Å²	84.3	27%	0.272	39%	0.385	S	S	.	.	H	α-helix	trans	-65.2	-47	175.7	-70.3	164.8	-176.7	179.7	-6.2	112.2	W975 V978 L979 D983 R984 T985 L991	W975-R987 HydrophobicContact CH2-CB 4.16Å; W975-R987 HydrophobicContact CH2-CG 4.35Å; W975-R987 HydrophobicContact CZ3-CB 3.99Å; W975-R987 HydrophobicContact CZ3-CG 4.24Å; V978-R987 VanDerWaalsContact CG1-CA 3.42Å; V978-R987 HydrophobicContact CG1-CB 4.1Å; V978-R987 HydrophobicContact CG1-CG 3.59Å; L979-R987 PolarHBondContact O-NH2 3.28Å; D983-R987 WeakPolarHBondContact O-CD 3.39Å; D983-R987 WeakPolarHBondContact O-CG 3.22Å; R984-R987 WeakPolarHBondContact O-CB 3.49Å; R984-R987 PolarHBondContact O-N 3.29Å; T985-R987 VanDerWaalsContact C-N 3.25Å; T985-R987 PolarHBondContact O-N 2.94Å; R987-L991 VanDerWaalsContact O-CG 3.24Å; R987-L991 WeakPolarHBondContact O-CG 3.42Å; R987-L991 PolarHBondContact O-N 2.99Å
988	E	92.4	Very high	91	Very high	78 Å²	78	80.9 Å²	80.9	36%	0.364	37%	0.372	S	S	.	.	H	α-helix	trans	-63.4	-46.3	178.5	-72.1	171.5	175	0	0	110.4	R984 T985 Y990 L991 E992	R984-E988 IonicContact CZ-OE1 2.92Å; R984-E988 IonicContact NE-OE1 3.11Å; R984-E988 PolarHBondContact NE-OE1 3.27Å; R984-E988 IonicContact NH2-OE1 2.85Å; R984-E988 PolarHBondContact NH2-OE1 3.48Å; R984-E988 PolarHBondContact O-N 3.28Å; T985-E988 PolarHBondContact O-N 3.02Å; E988-Y990 PolarHBondContact O-N 2.97Å; E988-L991 PolarHBondContact O-N 2.99Å; E988-E992 WeakPolarHBondContact O-CG 3.45Å; E988-E992 PolarHBondContact O-N 2.87Å
989	N	94.4	Very high	90.6	Very high	71 Å²	71	81 Å²	81	38%	0.38	37%	0.373	S	S	.	.	H	α-helix	trans	-58.9	-47.2	177	-67	-4.6	0	0	0	112.4	T985 L991 E992 E993	T985-N989 WeakPolarHBondContact O-CB 3.47Å; T985-N989 PolarHBondContact O-N 3.25Å; T985-N989 PolarHBondContact O-OD1 3.03Å; N989-L991 VanDerWaalsContact C-N 3.3Å; N989-L991 PolarHBondContact O-N 2.99Å; N989-E992 PolarHBondContact O-N 3.18Å; N989-E993 WeakPolarHBondContact O-CB 3.45Å; N989-E993 VanDerWaalsContact O-CG 3.29Å; N989-E993 WeakPolarHBondContact O-CG 3.16Å; N989-E993 PolarHBondContact O-N 3.22Å
990	Y	95.1	Very high	90.5	Very high	32 Å²	32	78.5 Å²	78.5	13%	0.125	36%	0.361	C	S	.	.	H	α-helix	trans	-62.9	-37.2	-179.2	-173.1	-93.4	0	0	0	112.6	A971 G974 W975 V978 S986 E988 N994 L996	A971-Y990 PolarHBondContact O-OH 3.22Å; A971-Y990 VanDerWaalsContact O-OH 3.09Å; G974-Y990 VanDerWaalsContact C-CZ 3.49Å; G974-Y990 WeakPolarHBondContact CA-OH 3.24Å; W975-Y990 HydrophobicContact CB-CD1 4.31Å; W975-Y990 HydrophobicContact CB-CE1 3.88Å; W975-Y990 AromaticContact CE3-CD1 3.98Å; W975-Y990 HydrophobicContact CE3-CD1 3.98Å; V978-Y990 HydrophobicContact CG2-CD2 3.95Å; V978-Y990 HydrophobicContact CG2-CG 3.97Å; S986-Y990 WeakPolarHBondContact O-CB 3.39Å; S986-Y990 PolarHBondContact O-N 3.03Å; E988-Y990 PolarHBondContact O-N 2.97Å; Y990-N994 WeakPolarHBondContact CD2-ND2 3.49Å; Y990-N994 VanDerWaalsContact CE2-ND2 3.27Å; Y990-N994 WeakPolarHBondContact CE2-ND2 3.36Å; Y990-N994 WeakPolarHBondContact O-CB 3.47Å; Y990-N994 PolarHBondContact O-N 3.36Å; Y990-N994 PolarHBondContact O-ND2 3.24Å; Y990-L996 HydrophobicContact CD1-CD1 3.85Å; Y990-L996 HydrophobicContact CE1-CD1 3.38Å
991	L	93.9	Very high	90.7	Very high	30 Å²	30	69.9 Å²	69.9	16%	0.157	33%	0.328	C	S	.	.	H	α-helix	trans	-65.6	-43.4	175.5	-68.1	168	0	0	0	111.5	W975 R987 E988 N989 L995 L996 A998 L1001	W975-L991 HydrophobicContact CE3-CD2 3.98Å; W975-L991 HydrophobicContact CE3-CG 4.25Å; W975-L991 HydrophobicContact CH2-CD1 3.88Å; W975-L991 HydrophobicContact CH2-CD2 4Å; W975-L991 HydrophobicContact CH2-CG 4.02Å; W975-L991 HydrophobicContact CZ3-CD1 3.91Å; W975-L991 HydrophobicContact CZ3-CD2 3.68Å; W975-L991 HydrophobicContact CZ3-CG 3.58Å; R987-L991 VanDerWaalsContact O-CG 3.24Å; R987-L991 WeakPolarHBondContact O-CG 3.42Å; R987-L991 PolarHBondContact O-N 2.99Å; E988-L991 PolarHBondContact O-N 2.99Å; N989-L991 VanDerWaalsContact C-N 3.3Å; N989-L991 PolarHBondContact O-N 2.99Å; L991-L995 CarbonylContact O-C 3.59Å; L991-L995 WeakPolarHBondContact O-CA 3.33Å; L991-L995 PolarHBondContact O-N 3.44Å; L991-L996 HydrophobicContact CD2-CB 3.82Å; L991-L996 PolarHBondContact O-N 3.27Å; L991-A998 HydrophobicContact CD1-CB 3.77Å; L991-A998 HydrophobicContact CD2-CB 4.04Å; L991-L1001 HydrophobicContact CD2-CD1 3.59Å
992	E	92.2	Very high	91	Very high	142 Å²	142	68.8 Å²	68.8	66%	0.664	32%	0.324	S	S	*	.	H	α-helix	trans	-68.6	-49	179.4	-71.3	-178.8	-177.7	0	0	111.8	E988 N989 N994 L995	E988-E992 WeakPolarHBondContact O-CG 3.45Å; E988-E992 PolarHBondContact O-N 2.87Å; N989-E992 PolarHBondContact O-N 3.18Å; E992-N994 VanDerWaalsContact C-N 3.32Å; E992-N994 PolarHBondContact O-N 3.48Å; E992-L995 PolarHBondContact O-N 3.4Å
993	E	93.1	Very high	91.5	Very high	138 Å²	138	63.1 Å²	63.1	65%	0.645	30%	0.297	S	S	*	.	H	α-helix	trans	-60.4	-39.8	-179.3	-73.8	175.5	-178.7	0	0	112.6	N989	N989-E993 WeakPolarHBondContact O-CB 3.45Å; N989-E993 VanDerWaalsContact O-CG 3.29Å; N989-E993 WeakPolarHBondContact O-CG 3.16Å; N989-E993 PolarHBondContact O-N 3.22Å
994	N	93.9	Very high	91.7	Very high	18 Å²	18	60 Å²	60	10%	0.096	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	8.4	-178.4	-62.7	-79.6	0	0	0	113.3	F940 V953 Y990 E992 L996	F940-N994 WeakPolarHBondContact CD1-O 3.28Å; V953-N994 HydrophobicContact CG1-CB 4.24Å; Y990-N994 WeakPolarHBondContact CD2-ND2 3.49Å; Y990-N994 VanDerWaalsContact CE2-ND2 3.27Å; Y990-N994 WeakPolarHBondContact CE2-ND2 3.36Å; Y990-N994 WeakPolarHBondContact O-CB 3.47Å; Y990-N994 PolarHBondContact O-N 3.36Å; Y990-N994 PolarHBondContact O-ND2 3.24Å; E992-N994 VanDerWaalsContact C-N 3.32Å; E992-N994 PolarHBondContact O-N 3.48Å; N994-L996 HydrophobicContact CB-CD1 3.8Å; N994-L996 HydrophobicContact CB-CD2 4.49Å; N994-L996 HydrophobicContact CB-CG 3.72Å; N994-L996 PolarHBondContact O-N 3.44Å
995	L	92.8	Very high	91.9	Very high	40 Å²	40	53.9 Å²	53.9	21%	0.209	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	41.5	-179.2	-57.8	175.2	0	0	0	112.8	F940 S941 E949 V950 V953 L991 E992	F940-L995 CarbonylContact C-O 3.53Å; F940-L995 WeakPolarHBondContact CA-O 3.24Å; S941-L995 PolarHBondContact N-O 3.21Å; E949-L995 HydrophobicContact CB-CD1 3.7Å; V950-L995 HydrophobicContact CG2-CB 4.28Å; V950-L995 HydrophobicContact CG2-CD1 3.92Å; V953-L995 HydrophobicContact CG2-CD1 4.01Å; V953-L995 HydrophobicContact CG2-CG 4.27Å; L991-L995 CarbonylContact O-C 3.59Å; L991-L995 WeakPolarHBondContact O-CA 3.33Å; L991-L995 PolarHBondContact O-N 3.44Å; E992-L995 PolarHBondContact O-N 3.4Å
996	L	93.3	Very high	91.9	Very high	11 Å²	11	51.1 Å²	51.1	6%	0.058	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-91.8	143.3	-175.6	-62.6	173.2	0	0	0	111.9	P939 F940 A971 Y990 L991 N994 L1001	P939-L996 HydrophobicContact CB-CD2 4.23Å; F940-L996 HydrophobicContact CD1-CD2 3.62Å; F940-L996 HydrophobicContact CE1-CD2 3.66Å; F940-L996 HydrophobicContact CG-CD2 4.29Å; F940-L996 HydrophobicContact CZ-CD2 4.37Å; A971-L996 HydrophobicContact CB-CD2 4.12Å; Y990-L996 HydrophobicContact CD1-CD1 3.85Å; Y990-L996 HydrophobicContact CE1-CD1 3.38Å; L991-L996 HydrophobicContact CD2-CB 3.82Å; L991-L996 PolarHBondContact O-N 3.27Å; N994-L996 HydrophobicContact CB-CD1 3.8Å; N994-L996 HydrophobicContact CB-CD2 4.49Å; N994-L996 HydrophobicContact CB-CG 3.72Å; N994-L996 PolarHBondContact O-N 3.44Å; L996-L1001 HydrophobicContact CB-CD1 3.96Å; L996-L1001 HydrophobicContact CD1-CD1 4.22Å
997	Y	89.4	Confident	92	Very high	73 Å²	73	48.8 Å²	48.8	29%	0.286	23%	0.23	S	C	.	.			trans	-96.4	103	177.8	-169.7	-127.9	0	0	0	110.8	P738 P939 P999 S1000 L1001	P738-Y997 WeakPolarHBondContact CD-OH 3.43Å; P738-Y997 HydrophobicContact CG-CE1 4.27Å; P939-Y997 PolarHBondContact O-N 3.09Å; Y997-P999 VanDerWaalsContact C-CD 3.42Å; Y997-P999 VanDerWaalsContact C-N 3.32Å; Y997-P999 HydrophobicContact CD1-CB 4.28Å; Y997-P999 HydrophobicContact CD1-CG 4.31Å; Y997-P999 HydrophobicContact CD2-CG 4.37Å; Y997-P999 HydrophobicContact CE1-CB 3.81Å; Y997-P999 HydrophobicContact CE1-CG 3.81Å; Y997-P999 HydrophobicContact CE2-CG 3.86Å; Y997-P999 VanDerWaalsContact O-N 3.14Å; Y997-S1000 WeakPolarHBondContact CD1-OG 3.25Å; Y997-S1000 WeakPolarHBondContact O-CA 3.47Å; Y997-S1000 VanDerWaalsContact O-CB 3.3Å; Y997-S1000 WeakPolarHBondContact O-CB 3.35Å; Y997-S1000 PolarHBondContact O-N 3.47Å; Y997-L1001 PolarHBondContact O-N 3.43Å; Y997-L1001 VanDerWaalsContact O-N 3.14Å
998	A	89.3	Confident	92.2	Very high	21 Å²	21	45.7 Å²	45.7	17%	0.174	22%	0.219	C	C	.	.	H	α-helix	trans	-50.5	-39.4	-175.5	0	0	0	0	0	115.2	L991 L1001 R1002	L991-A998 HydrophobicContact CD1-CB 3.77Å; L991-A998 HydrophobicContact CD2-CB 4.04Å; A998-L1001 PolarHBondContact O-N 2.76Å; A998-R1002 PolarHBondContact O-N 2.76Å; A998-R1002 VanDerWaalsContact O-N 3.08Å
999	P	84.5	Confident	92.3	Very high	21 Å²	21	48.6 Å²	48.6	14%	0.136	23%	0.23	C	C	.	.	H	α-helix	trans	-67.2	-34.1	174.5	-20.8	34.1	0	0	0	114.5	P738 Y997 R1002 F1003	P738-P999 HydrophobicContact CB-CB 4.08Å; P738-P999 HydrophobicContact CG-CB 3.14Å; P738-P999 HydrophobicContact CG-CG 3.74Å; Y997-P999 VanDerWaalsContact C-CD 3.42Å; Y997-P999 VanDerWaalsContact C-N 3.32Å; Y997-P999 HydrophobicContact CD1-CB 4.28Å; Y997-P999 HydrophobicContact CD1-CG 4.31Å; Y997-P999 HydrophobicContact CD2-CG 4.37Å; Y997-P999 HydrophobicContact CE1-CB 3.81Å; Y997-P999 HydrophobicContact CE1-CG 3.81Å; Y997-P999 HydrophobicContact CE2-CG 3.86Å; Y997-P999 VanDerWaalsContact O-N 3.14Å; P999-R1002 PolarHBondContact O-N 3.08Å; P999-F1003 PolarHBondContact O-N 3.33Å; P999-F1003 VanDerWaalsContact O-N 3.09Å
1000	S	89.4	Confident	92.1	Very high	5 Å²	5	46.1 Å²	46.1	4%	0.035	22%	0.216	C	C	.	.	H	α-helix	trans	-61.2	-45.8	171.4	-80.5	0	0	0	0	110.4	R937 D938 Y997 R1002 F1003 I1004	R937-S1000 WeakPolarHBondContact CD-OG 3.31Å; D938-S1000 WeakPolarHBondContact O-CB 3.5Å; D938-S1000 PolarHBondContact O-OG 2.92Å; Y997-S1000 WeakPolarHBondContact CD1-OG 3.25Å; Y997-S1000 WeakPolarHBondContact O-CA 3.47Å; Y997-S1000 VanDerWaalsContact O-CB 3.3Å; Y997-S1000 WeakPolarHBondContact O-CB 3.35Å; Y997-S1000 PolarHBondContact O-N 3.47Å; S1000-R1002 PolarHBondContact O-N 3.08Å; S1000-F1003 CarbonylContact O-C 3.51Å; S1000-F1003 WeakPolarHBondContact O-CA 3.39Å; S1000-F1003 WeakPolarHBondContact O-CB 3.44Å; S1000-F1003 PolarHBondContact O-N 2.71Å; S1000-I1004 VanDerWaalsContact O-CG1 3.32Å; S1000-I1004 WeakPolarHBondContact O-CG1 3.42Å; S1000-I1004 PolarHBondContact O-N 3.18Å
1001	L	93.5	Very high	92.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.2	-42.1	178.2	-68.7	167.4	0	0	0	112.4	P939 V972 W975 L991 L996 Y997 A998 F1003 I1004 H1005	P939-L1001 HydrophobicContact CB-CD2 4Å; V972-L1001 HydrophobicContact CG2-CD2 4.17Å; W975-L1001 HydrophobicContact CB-CD1 4.37Å; W975-L1001 HydrophobicContact CD2-CD1 3.74Å; W975-L1001 HydrophobicContact CE3-CD1 4.32Å; W975-L1001 HydrophobicContact CG-CD1 3.74Å; W975-L1001 HydrophobicContact CG-CD2 4.35Å; W975-L1001 HydrophobicContact CG-CG 4.48Å; L991-L1001 HydrophobicContact CD2-CD1 3.59Å; L996-L1001 HydrophobicContact CB-CD1 3.96Å; L996-L1001 HydrophobicContact CD1-CD1 4.22Å; Y997-L1001 PolarHBondContact O-N 3.43Å; Y997-L1001 VanDerWaalsContact O-N 3.14Å; A998-L1001 PolarHBondContact O-N 2.76Å; L1001-F1003 VanDerWaalsContact C-N 3.3Å; L1001-F1003 PolarHBondContact O-N 3.03Å; L1001-I1004 HydrophobicContact CD2-CD1 4.46Å; L1001-I1004 PolarHBondContact O-N 3.36Å; L1001-H1005 PolarHBondContact O-N 2.84Å
1002	R	90.7	Very high	92.3	Very high	157 Å²	157	43.3 Å²	43.3	59%	0.592	20%	0.204	S	C	*	.	H	α-helix	trans	-60.5	-39.7	173	-71.4	-169.2	-64.8	-93	7.4	112.4	A998 P999 S1000 G1006	A998-R1002 PolarHBondContact O-N 2.76Å; A998-R1002 VanDerWaalsContact O-N 3.08Å; P999-R1002 PolarHBondContact O-N 3.08Å; S1000-R1002 PolarHBondContact O-N 3.08Å; R1002-G1006 PolarHBondContact O-N 3.2Å; R1002-G1006 VanDerWaalsContact O-N 3.16Å
1003	F	88.4	Confident	92.3	Very high	46 Å²	46	40.8 Å²	40.8	20%	0.202	19%	0.192	C	C	.	.	H	α-helix	trans	-68.1	-41.8	176.7	-174.8	-99	0	0	0	111.8	L550 R937 P999 S1000 L1001 G1006 L1007	L550-F1003 HydrophobicContact CD1-CD2 3.92Å; L550-F1003 HydrophobicContact CD1-CE2 3.76Å; L550-F1003 HydrophobicContact CD1-CZ 4.47Å; R937-F1003 HydrophobicContact CB-CD1 3.68Å; R937-F1003 HydrophobicContact CB-CE1 4.02Å; R937-F1003 HydrophobicContact CG-CD1 3.79Å; R937-F1003 HydrophobicContact CG-CE1 4.48Å; P999-F1003 PolarHBondContact O-N 3.33Å; P999-F1003 VanDerWaalsContact O-N 3.09Å; S1000-F1003 CarbonylContact O-C 3.51Å; S1000-F1003 WeakPolarHBondContact O-CA 3.39Å; S1000-F1003 WeakPolarHBondContact O-CB 3.44Å; S1000-F1003 PolarHBondContact O-N 2.71Å; L1001-F1003 VanDerWaalsContact C-N 3.3Å; L1001-F1003 PolarHBondContact O-N 3.03Å; F1003-G1006 CarbonylContact O-C 3.5Å; F1003-G1006 WeakPolarHBondContact O-CA 3.41Å; F1003-G1006 PolarHBondContact O-N 3.04Å; F1003-G1006 VanDerWaalsContact O-N 3.14Å; F1003-L1007 HydrophobicContact CD1-CD1 3.92Å; F1003-L1007 HydrophobicContact CD1-CG 4.11Å; F1003-L1007 HydrophobicContact CE1-CD1 3.57Å; F1003-L1007 HydrophobicContact CE1-CD2 4.15Å; F1003-L1007 HydrophobicContact CE1-CG 3.82Å; F1003-L1007 HydrophobicContact CZ-CD1 4.41Å; F1003-L1007 HydrophobicContact CZ-CD2 4.19Å; F1003-L1007 HydrophobicContact CZ-CG 4.29Å; F1003-L1007 PolarHBondContact O-N 3.27Å
1004	I	94.2	Very high	92.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-58.5	-49.4	175.1	-72	160.4	0	0	0	110.7	R937 P939 V972 S1000 L1001 G1006 L1007 I1008	R937-I1004 HydrophobicContact CB-CG1 4.32Å; R937-I1004 HydrophobicContact CG-CG1 4.43Å; R937-I1004 WeakPolarHBondContact O-CD1 3.43Å; P939-I1004 HydrophobicContact CB-CD1 3.67Å; P939-I1004 HydrophobicContact CG-CD1 4.41Å; V972-I1004 HydrophobicContact CG2-CG2 4.34Å; S1000-I1004 VanDerWaalsContact O-CG1 3.32Å; S1000-I1004 WeakPolarHBondContact O-CG1 3.42Å; S1000-I1004 PolarHBondContact O-N 3.18Å; L1001-I1004 HydrophobicContact CD2-CD1 4.46Å; L1001-I1004 PolarHBondContact O-N 3.36Å; I1004-G1006 PolarHBondContact O-N 3.35Å; I1004-L1007 WeakPolarHBondContact O-CA 3.26Å; I1004-L1007 WeakPolarHBondContact O-CB 3.4Å; I1004-L1007 PolarHBondContact O-N 2.89Å; I1004-I1008 HydrophobicContact CG2-CD1 4.03Å; I1004-I1008 WeakPolarHBondContact O-CG1 3.39Å; I1004-I1008 PolarHBondContact O-N 2.59Å
1005	H	94.3	Very high	92.3	Very high	50 Å²	50	33.4 Å²	33.4	23%	0.231	16%	0.157	C	C	.	.	H	α-helix	trans	-59	-37.6	175	-69.4	174.2	0	0	0	112.4	W975 E976 L1001 I1008 K1009	W975-H1005 AromaticContact CD1-CE1 3.48Å; W975-H1005 VanDerWaalsContact CD1-CE1 3.48Å; W975-H1005 AromaticContact CD1-NE2 3.73Å; W975-H1005 AromaticContact NE1-CE1 3.62Å; E976-H1005 IonicContact OE1-NE2 3.14Å; L1001-H1005 PolarHBondContact O-N 2.84Å; H1005-I1008 PolarHBondContact O-N 3.4Å; H1005-K1009 PolarHBondContact O-N 2.84Å; H1005-K1009 VanDerWaalsContact O-N 3.09Å
1006	G	92	Very high	92.3	Very high	20 Å²	20	36.9 Å²	36.9	21%	0.206	17%	0.168	C	C	.	.	H	α-helix	trans	-62.3	-42.6	173	0	0	0	0	0	112.8	L550 R1002 F1003 I1004 K1009 Q1010	L550-G1006 WeakPolarHBondContact CD2-O 3.4Å; R1002-G1006 PolarHBondContact O-N 3.2Å; R1002-G1006 VanDerWaalsContact O-N 3.16Å; F1003-G1006 CarbonylContact O-C 3.5Å; F1003-G1006 WeakPolarHBondContact O-CA 3.41Å; F1003-G1006 PolarHBondContact O-N 3.04Å; F1003-G1006 VanDerWaalsContact O-N 3.14Å; I1004-G1006 PolarHBondContact O-N 3.35Å; G1006-K1009 PolarHBondContact O-N 2.95Å; G1006-Q1010 PolarHBondContact O-N 2.77Å
1007	L	93.2	Very high	92.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.8	-45.1	175.3	-72.9	-178.2	0	0	0	112.1	L550 T936 F1003 I1004 K1009 Q1010 F1011	L550-L1007 HydrophobicContact CD1-CD2 4.46Å; T936-L1007 HydrophobicContact CG2-CD1 3.79Å; F1003-L1007 HydrophobicContact CD1-CD1 3.92Å; F1003-L1007 HydrophobicContact CD1-CG 4.11Å; F1003-L1007 HydrophobicContact CE1-CD1 3.57Å; F1003-L1007 HydrophobicContact CE1-CD2 4.15Å; F1003-L1007 HydrophobicContact CE1-CG 3.82Å; F1003-L1007 HydrophobicContact CZ-CD1 4.41Å; F1003-L1007 HydrophobicContact CZ-CD2 4.19Å; F1003-L1007 HydrophobicContact CZ-CG 4.29Å; F1003-L1007 PolarHBondContact O-N 3.27Å; I1004-L1007 WeakPolarHBondContact O-CA 3.26Å; I1004-L1007 WeakPolarHBondContact O-CB 3.4Å; I1004-L1007 PolarHBondContact O-N 2.89Å; L1007-K1009 VanDerWaalsContact C-N 3.3Å; L1007-K1009 PolarHBondContact O-N 2.97Å; L1007-Q1010 PolarHBondContact O-N 2.58Å; L1007-Q1010 VanDerWaalsContact O-N 3.13Å; L1007-F1011 HydrophobicContact CB-CD2 4.28Å; L1007-F1011 HydrophobicContact CB-CE2 3.97Å; L1007-F1011 WeakPolarHBondContact O-CD2 3.44Å; L1007-F1011 WeakPolarHBondContact O-CG 3.39Å; L1007-F1011 PolarHBondContact O-N 3.36Å
1008	I	96.2	Very high	92.2	Very high	6 Å²	6	37.3 Å²	37.3	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-55.3	-49.3	176.5	-67.1	169	0	0	0	109.6	V930 S933 I1004 H1005 Q1010 F1011 S1012 T1028	V930-I1008 HydrophobicContact CG2-CD1 3.88Å; S933-I1008 WeakPolarHBondContact OG-CG1 3.44Å; I1004-I1008 HydrophobicContact CG2-CD1 4.03Å; I1004-I1008 WeakPolarHBondContact O-CG1 3.39Å; I1004-I1008 PolarHBondContact O-N 2.59Å; H1005-I1008 PolarHBondContact O-N 3.4Å; I1008-Q1010 PolarHBondContact O-N 3.43Å; I1008-F1011 PolarHBondContact O-N 3.48Å; I1008-S1012 PolarHBondContact O-N 3.43Å; I1008-S1012 PolarHBondContact O-OG 3.45Å; I1008-T1028 HydrophobicContact CG2-CG2 3.68Å
1009	K	94.3	Very high	92.3	Very high	140 Å²	140	40.1 Å²	40.1	61%	0.609	18%	0.181	S	C	*	.	H	α-helix	trans	-58.4	-45.4	176.7	-176.2	-178.8	175.2	-176.4	0	112.7	H1005 G1006 L1007 S1012 E1013	H1005-K1009 PolarHBondContact O-N 2.84Å; H1005-K1009 VanDerWaalsContact O-N 3.09Å; G1006-K1009 PolarHBondContact O-N 2.95Å; L1007-K1009 VanDerWaalsContact C-N 3.3Å; L1007-K1009 PolarHBondContact O-N 2.97Å; K1009-S1012 WeakPolarHBondContact O-CB 3.37Å; K1009-S1012 PolarHBondContact O-N 3.47Å; K1009-E1013 WeakPolarHBondContact CE-OE1 3.36Å; K1009-E1013 PolarHBondContact O-N 3.39Å; K1009-E1013 VanDerWaalsContact O-N 3.08Å
1010	Q	91.4	Very high	92.6	Very high	18 Å²	18	39.2 Å²	39.2	8%	0.084	18%	0.175	C	C	.	.	H	α-helix	trans	-63.8	-42.1	178.3	-177.4	-170.4	-18.5	0	0	111.8	R549 L550 S907 G1006 L1007 I1008 S1012 E1013 N1014	R549-Q1010 VanDerWaalsContact CG-OE1 3.25Å; L550-Q1010 HydrophobicContact CD2-CB 3.74Å; L550-Q1010 HydrophobicContact CD2-CG 4.38Å; S907-Q1010 PolarHBondContact OG-NE2 3.1Å; S907-Q1010 VanDerWaalsContact OG-NE2 3.13Å; G1006-Q1010 PolarHBondContact O-N 2.77Å; L1007-Q1010 PolarHBondContact O-N 2.58Å; L1007-Q1010 VanDerWaalsContact O-N 3.13Å; I1008-Q1010 PolarHBondContact O-N 3.43Å; Q1010-S1012 VanDerWaalsContact C-N 3.31Å; Q1010-E1013 PolarHBondContact O-N 2.91Å; Q1010-N1014 PolarHBondContact O-N 3.44Å
1011	F	95.5	Very high	92.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65	-38.8	176.1	-66.9	-46.3	0	0	0	110.9	I906 T908 I916 L929 V932 L1007 I1008 E1013 N1014 I1015	I906-F1011 HydrophobicContact CG2-CD1 4.16Å; I906-F1011 HydrophobicContact CG2-CE1 4.49Å; T908-F1011 HydrophobicContact CG2-CE1 4.38Å; I916-F1011 HydrophobicContact CD1-CG 4.5Å; L929-F1011 HydrophobicContact CD2-CB 3.52Å; L929-F1011 HydrophobicContact CD2-CD2 4.38Å; L929-F1011 HydrophobicContact CD2-CG 4.29Å; V932-F1011 HydrophobicContact CG1-CE2 3.83Å; V932-F1011 HydrophobicContact CG1-CZ 3.93Å; L1007-F1011 HydrophobicContact CB-CD2 4.28Å; L1007-F1011 HydrophobicContact CB-CE2 3.97Å; L1007-F1011 WeakPolarHBondContact O-CD2 3.44Å; L1007-F1011 WeakPolarHBondContact O-CG 3.39Å; L1007-F1011 PolarHBondContact O-N 3.36Å; I1008-F1011 PolarHBondContact O-N 3.48Å; F1011-E1013 VanDerWaalsContact C-N 3.29Å; F1011-E1013 PolarHBondContact O-N 3.3Å; F1011-N1014 PolarHBondContact O-N 3.1Å; F1011-N1014 VanDerWaalsContact O-N 3.15Å; F1011-I1015 HydrophobicContact CB-CD1 4.48Å; F1011-I1015 WeakPolarHBondContact O-CB 3.27Å; F1011-I1015 WeakPolarHBondContact O-CD1 3.42Å; F1011-I1015 WeakPolarHBondContact O-CG1 3.43Å; F1011-I1015 PolarHBondContact O-N 2.79Å
1012	S	96.3	Very high	92.7	Very high	4 Å²	4	40.8 Å²	40.8	3%	0.028	19%	0.191	C	C	.	.	H	α-helix	trans	-58.5	-39.7	173.2	-58.9	0	0	0	0	113.2	I1008 K1009 Q1010 Y1016 P1024 C1027	I1008-S1012 PolarHBondContact O-N 3.43Å; I1008-S1012 PolarHBondContact O-OG 3.45Å; K1009-S1012 WeakPolarHBondContact O-CB 3.37Å; K1009-S1012 PolarHBondContact O-N 3.47Å; Q1010-S1012 VanDerWaalsContact C-N 3.31Å; S1012-Y1016 PolarHBondContact O-N 3.5Å; S1012-Y1016 VanDerWaalsContact O-N 3.13Å; S1012-P1024 VanDerWaalsContact CB-O 3.28Å; S1012-P1024 WeakPolarHBondContact CB-O 3.4Å; S1012-C1027 WeakPolarHBondContact OG-CB 3.32Å
1013	E	92.8	Very high	92.8	Very high	88 Å²	88	39.5 Å²	39.5	41%	0.411	19%	0.189	S	C	.	.	H	α-helix	trans	-64.3	-47.6	172.9	-70	170.8	-172.9	0	0	111.1	K1009 Q1010 F1011 I1015 Y1016 E1017	K1009-E1013 WeakPolarHBondContact CE-OE1 3.36Å; K1009-E1013 PolarHBondContact O-N 3.39Å; K1009-E1013 VanDerWaalsContact O-N 3.08Å; Q1010-E1013 PolarHBondContact O-N 2.91Å; F1011-E1013 VanDerWaalsContact C-N 3.29Å; F1011-E1013 PolarHBondContact O-N 3.3Å; E1013-I1015 VanDerWaalsContact C-N 3.33Å; E1013-I1015 PolarHBondContact O-N 2.69Å; E1013-Y1016 WeakPolarHBondContact O-CB 3.24Å; E1013-Y1016 PolarHBondContact O-N 3.4Å; E1013-E1017 WeakPolarHBondContact O-CG 3.45Å; E1013-E1017 PolarHBondContact O-N 2.85Å
1014	N	92.4	Very high	93.1	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.011	19%	0.194	C	C	.	.	H	α-helix	trans	-61.3	-37.5	177.3	-67.4	-16	0	0	0	112.8	R571 H905 I906 S907 Q1010 F1011 E1017 A1018	R571-N1014 PolarHBondContact NH2-OD1 3.4Å; H905-N1014 WeakPolarHBondContact O-CB 3.49Å; H905-N1014 VanDerWaalsContact O-CG 3.28Å; I906-N1014 HydrophobicContact CG1-CB 4.47Å; S907-N1014 PolarHBondContact N-ND2 3.39Å; S907-N1014 PolarHBondContact OG-ND2 3.49Å; Q1010-N1014 PolarHBondContact O-N 3.44Å; F1011-N1014 PolarHBondContact O-N 3.1Å; F1011-N1014 VanDerWaalsContact O-N 3.15Å; N1014-E1017 PolarHBondContact O-N 2.84Å; N1014-A1018 WeakPolarHBondContact O-CB 3.32Å; N1014-A1018 PolarHBondContact O-N 3.18Å
1015	I	94.8	Very high	93.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-70.4	-37	-179.8	-69.5	162.4	0	0	0	110.8	I906 I916 L925 L929 F1011 E1013 A1018 F1019 L1020 V1021	I906-I1015 HydrophobicContact CD1-CG1 4.46Å; I916-I1015 HydrophobicContact CG2-CD1 3.42Å; I916-I1015 VanDerWaalsContact CG2-CD1 3.42Å; I916-I1015 HydrophobicContact CG2-CG1 3.6Å; L925-I1015 HydrophobicContact CD1-CD1 4.04Å; L925-I1015 HydrophobicContact CD2-CD1 4.29Å; L925-I1015 HydrophobicContact CD2-CG2 4.29Å; L929-I1015 HydrophobicContact CD1-CD1 4.13Å; L929-I1015 HydrophobicContact CD2-CD1 3.54Å; L929-I1015 HydrophobicContact CG-CD1 4.24Å; F1011-I1015 HydrophobicContact CB-CD1 4.48Å; F1011-I1015 WeakPolarHBondContact O-CB 3.27Å; F1011-I1015 WeakPolarHBondContact O-CD1 3.42Å; F1011-I1015 WeakPolarHBondContact O-CG1 3.43Å; F1011-I1015 PolarHBondContact O-N 2.79Å; E1013-I1015 VanDerWaalsContact C-N 3.33Å; E1013-I1015 PolarHBondContact O-N 2.69Å; I1015-A1018 CarbonylContact O-C 3.21Å; I1015-A1018 WeakPolarHBondContact O-CB 3.3Å; I1015-A1018 PolarHBondContact O-N 3.42Å; I1015-F1019 PolarHBondContact O-N 3.23Å; I1015-L1020 HydrophobicContact CG2-CB 3.63Å; I1015-L1020 HydrophobicContact CG2-CD1 4.19Å; I1015-L1020 PolarHBondContact O-N 3.49Å; I1015-L1020 VanDerWaalsContact O-N 3.1Å; I1015-V1021 HydrophobicContact CG2-CB 4.45Å; I1015-V1021 HydrophobicContact CG2-CG1 3.83Å; I1015-V1021 HydrophobicContact CG2-CG2 3.93Å
1016	Y	93.1	Very high	93.2	Very high	113 Å²	113	42.2 Å²	42.2	44%	0.443	22%	0.215	S	C	.	.	H	α-helix	trans	-63.6	-45.7	170.6	170.6	-102.4	0	0	0	111.1	S1012 E1013 A1018 F1019 V1021 G1022 P1024	S1012-Y1016 PolarHBondContact O-N 3.5Å; S1012-Y1016 VanDerWaalsContact O-N 3.13Å; E1013-Y1016 WeakPolarHBondContact O-CB 3.24Å; E1013-Y1016 PolarHBondContact O-N 3.4Å; Y1016-A1018 PolarHBondContact O-N 3.44Å; Y1016-F1019 WeakPolarHBondContact O-CA 3.21Å; Y1016-F1019 PolarHBondContact O-N 2.84Å; Y1016-V1021 WeakPolarHBondContact CD2-O 3.4Å; Y1016-G1022 WeakPolarHBondContact CE2-O 3.49Å; Y1016-P1024 HydrophobicContact CD1-CG 4.29Å; Y1016-P1024 HydrophobicContact CG-CG 4Å
1017	E	88.2	Confident	93.4	Very high	93 Å²	93	41.2 Å²	41.2	44%	0.435	21%	0.205	S	C	.	.	H	α-helix	trans	-62.5	-27.9	173.7	-70	177.9	-180	0	0	112.7	E1013 N1014 F1019	E1013-E1017 WeakPolarHBondContact O-CG 3.45Å; E1013-E1017 PolarHBondContact O-N 2.85Å; N1014-E1017 PolarHBondContact O-N 2.84Å; E1017-F1019 VanDerWaalsContact O-CD2 3.29Å; E1017-F1019 WeakPolarHBondContact O-CD2 3.45Å; E1017-F1019 VanDerWaalsContact O-CE2 3.29Å; E1017-F1019 WeakPolarHBondContact O-CE2 3.44Å; E1017-F1019 PolarHBondContact O-N 2.88Å
1018	A	91	Very high	93.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	0.2	171.8	0	0	0	0	0	113.5	R902 H905 N1014 I1015 Y1016 L1020	R902-A1018 WeakPolarHBondContact CD-O 3.41Å; R902-A1018 PolarHBondContact NH1-O 2.92Å; R902-A1018 WeakPolarHBondContact O-CB 3.36Å; H905-A1018 HydrophobicContact CB-CB 4.03Å; N1014-A1018 WeakPolarHBondContact O-CB 3.32Å; N1014-A1018 PolarHBondContact O-N 3.18Å; I1015-A1018 CarbonylContact O-C 3.21Å; I1015-A1018 WeakPolarHBondContact O-CB 3.3Å; I1015-A1018 PolarHBondContact O-N 3.42Å; Y1016-A1018 PolarHBondContact O-N 3.44Å; A1018-L1020 VanDerWaalsContact C-N 3.26Å; A1018-L1020 HydrophobicContact CB-CD1 3.89Å; A1018-L1020 HydrophobicContact CB-CG 4.02Å; A1018-L1020 PolarHBondContact O-N 2.9Å
1019	F	91.3	Very high	93.3	Very high	79 Å²	79	47.9 Å²	47.9	35%	0.346	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	34.5	-176.1	-43.5	-98.8	0	0	0	114.4	L415 R902 I1015 Y1016 E1017 E1185 L1186	L415-F1019 HydrophobicContact CD1-CD2 4.02Å; L415-F1019 HydrophobicContact CD1-CE2 4Å; L415-F1019 HydrophobicContact CD2-CD2 3.95Å; L415-F1019 HydrophobicContact CD2-CE2 3.94Å; L415-F1019 HydrophobicContact CG-CD2 4.1Å; L415-F1019 HydrophobicContact CG-CE2 3.77Å; R902-F1019 VanDerWaalsContact NH1-CB 3.34Å; R902-F1019 VanDerWaalsContact NH1-CD2 3.3Å; I1015-F1019 PolarHBondContact O-N 3.23Å; Y1016-F1019 WeakPolarHBondContact O-CA 3.21Å; Y1016-F1019 PolarHBondContact O-N 2.84Å; E1017-F1019 VanDerWaalsContact O-CD2 3.29Å; E1017-F1019 WeakPolarHBondContact O-CD2 3.45Å; E1017-F1019 VanDerWaalsContact O-CE2 3.29Å; E1017-F1019 WeakPolarHBondContact O-CE2 3.44Å; E1017-F1019 PolarHBondContact O-N 2.88Å; F1019-E1185 HydrophobicContact CB-CB 4.14Å; F1019-E1185 HydrophobicContact CB-CG 3.99Å; F1019-L1186 PolarHBondContact O-N 2.95Å; F1019-L1186 VanDerWaalsContact O-N 3.14Å
1020	L	92.6	Very high	93.3	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.016	25%	0.248	C	C	.	.	S	Bend	trans	-95.1	-14.9	177.1	-64.6	170.2	0	0	0	112.5	V917 A920 I1015 A1018 L1186	V917-L1020 HydrophobicContact CB-CD1 4.3Å; V917-L1020 HydrophobicContact CG1-CD1 4.26Å; V917-L1020 HydrophobicContact CG1-CD2 4.21Å; V917-L1020 HydrophobicContact CG2-CD1 3.99Å; A920-L1020 HydrophobicContact CB-CB 4.05Å; A920-L1020 HydrophobicContact CB-CD1 4.43Å; I1015-L1020 HydrophobicContact CG2-CB 3.63Å; I1015-L1020 HydrophobicContact CG2-CD1 4.19Å; I1015-L1020 PolarHBondContact O-N 3.49Å; I1015-L1020 VanDerWaalsContact O-N 3.1Å; A1018-L1020 VanDerWaalsContact C-N 3.26Å; A1018-L1020 HydrophobicContact CB-CD1 3.89Å; A1018-L1020 HydrophobicContact CB-CG 4.02Å; A1018-L1020 PolarHBondContact O-N 2.9Å; L1020-L1186 WeakPolarHBondContact O-CD2 3.32Å
1021	V	93.5	Very high	93.4	Very high	6 Å²	6	50.4 Å²	50.4	4%	0.036	28%	0.278	C	S	.	.	S	Bend	trans	-141.6	154.5	176.9	-63.4	0	0	0	0	110.3	L925 I1015 Y1016 K1023 C1034	L925-V1021 HydrophobicContact CD2-CG1 4.09Å; I1015-V1021 HydrophobicContact CG2-CB 4.45Å; I1015-V1021 HydrophobicContact CG2-CG1 3.83Å; I1015-V1021 HydrophobicContact CG2-CG2 3.93Å; Y1016-V1021 WeakPolarHBondContact CD2-O 3.4Å; V1021-K1023 WeakPolarHBondContact CG2-O 3.34Å; V1021-C1034 HydrophobicContact CG1-CB 4.28Å
1022	G	90.5	Very high	93.4	Very high	31 Å²	31	51 Å²	51	32%	0.32	28%	0.283	S	S	.	.	S	Bend	trans	-76	-29.3	178.4	0	0	0	0	0	113.5	Y1016	Y1016-G1022 WeakPolarHBondContact CE2-O 3.49Å
1023	K	93.2	Very high	93.2	Very high	131 Å²	131	54.7 Å²	54.7	57%	0.57	30%	0.3	S	S	*	.	S	Bend	trans	-145.5	149.3	175.2	-60.5	173.6	-172.6	163.6	0	110.9	V1021 S1025 D1026	V1021-K1023 WeakPolarHBondContact CG2-O 3.34Å; K1023-S1025 PolarHBondContact O-N 2.96Å; K1023-S1025 VanDerWaalsContact O-N 3.15Å; K1023-D1026 PolarHBondContact N-OD2 3.41Å; K1023-D1026 VanDerWaalsContact O-CB 3.32Å; K1023-D1026 WeakPolarHBondContact O-CB 3.27Å; K1023-D1026 PolarHBondContact O-N 3.27Å
1024	P	94.2	Very high	93.3	Very high	47 Å²	47	51.1 Å²	51.1	31%	0.305	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-29.2	175	-25.4	33.8	0	0	0	114.2	S1012 Y1016 D1026	S1012-P1024 VanDerWaalsContact CB-O 3.28Å; S1012-P1024 WeakPolarHBondContact CB-O 3.4Å; Y1016-P1024 HydrophobicContact CD1-CG 4.29Å; Y1016-P1024 HydrophobicContact CG-CG 4Å; P1024-D1026 PolarHBondContact O-N 2.82Å
1025	S	94.9	Very high	93.5	Very high	65 Å²	65	51.4 Å²	51.4	46%	0.455	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-26.6	177.7	50.9	0	0	0	0	113.5	K1023 C1027 T1028 L1029	K1023-S1025 PolarHBondContact O-N 2.96Å; K1023-S1025 VanDerWaalsContact O-N 3.15Å; S1025-C1027 PolarHBondContact O-N 3.1Å; S1025-T1028 PolarHBondContact O-N 2.94Å; S1025-T1028 PolarHBondContact O-OG1 3.19Å; S1025-L1029 WeakPolarHBondContact O-CB 3.4Å; S1025-L1029 PolarHBondContact O-N 3.24Å
1026	D	95.5	Very high	93.6	Very high	40 Å²	40	56.2 Å²	56.2	21%	0.214	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-64.9	-34	-175.7	-59.8	-14.3	0	0	0	110.3	K1023 P1024 T1028 L1029 A1032 C1034 N1035	K1023-D1026 PolarHBondContact N-OD2 3.41Å; K1023-D1026 VanDerWaalsContact O-CB 3.32Å; K1023-D1026 WeakPolarHBondContact O-CB 3.27Å; K1023-D1026 PolarHBondContact O-N 3.27Å; P1024-D1026 PolarHBondContact O-N 2.82Å; D1026-T1028 PolarHBondContact O-N 3.38Å; D1026-T1028 VanDerWaalsContact O-N 3.1Å; D1026-L1029 PolarHBondContact O-N 3.46Å; D1026-L1029 VanDerWaalsContact O-N 3.14Å; D1026-A1032 HydrophobicContact CB-CB 3.87Å; D1026-A1032 WeakPolarHBondContact O-CB 3.44Å; D1026-C1034 PolarHBondContact O-SG 3.47Å; D1026-N1035 PolarHBondContact O-ND2 3.04Å
1027	C	96.1	Very high	93.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-56.2	-28.3	177.5	-62.3	0	0	0	0	114.5	L925 H926 L929 S1012 S1025 N1035	L925-C1027 HydrophobicContact CD2-CB 4.11Å; H926-C1027 WeakPolarHBondContact CB-O 3.28Å; L929-C1027 HydrophobicContact CD1-CB 3.77Å; S1012-C1027 WeakPolarHBondContact OG-CB 3.32Å; S1025-C1027 PolarHBondContact O-N 3.1Å; C1027-N1035 PolarHBondContact O-ND2 2.88Å
1028	T	94	Very high	94.2	Very high	66 Å²	66	48.3 Å²	48.3	41%	0.405	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-111.2	-3.6	-178.9	53.5	0	0	0	0	113	I1008 S1025 D1026 P1030	I1008-T1028 HydrophobicContact CG2-CG2 3.68Å; S1025-T1028 PolarHBondContact O-N 2.94Å; S1025-T1028 PolarHBondContact O-OG1 3.19Å; D1026-T1028 PolarHBondContact O-N 3.38Å; D1026-T1028 VanDerWaalsContact O-N 3.1Å; T1028-P1030 WeakPolarHBondContact O-CD 3.33Å
1029	L	94.7	Very high	94.4	Very high	79 Å²	79	56.5 Å²	56.5	41%	0.414	32%	0.315	S	S	.	.			trans	-88.3	118.9	-178	-174.3	70	0	0	0	109.1	S1025 D1026 S1031 A1032 N1035	S1025-L1029 WeakPolarHBondContact O-CB 3.4Å; S1025-L1029 PolarHBondContact O-N 3.24Å; D1026-L1029 PolarHBondContact O-N 3.46Å; D1026-L1029 VanDerWaalsContact O-N 3.14Å; L1029-S1031 WeakPolarHBondContact CD2-OG 3.4Å; L1029-S1031 WeakPolarHBondContact CG-OG 3.5Å; L1029-S1031 PolarHBondContact O-N 3.36Å; L1029-A1032 HydrophobicContact CB-CB 4.13Å; L1029-A1032 HydrophobicContact CD2-CB 4.49Å; L1029-A1032 WeakPolarHBondContact O-CB 3.22Å; L1029-A1032 PolarHBondContact O-N 2.93Å; L1029-N1035 PolarHBondContact O-ND2 2.96Å
1030	P	93.1	Very high	94.6	Very high	110 Å²	110	54.7 Å²	54.7	71%	0.714	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-28.5	-179	-25.8	35.8	0	0	0	113.7	T1028 A1032	T1028-P1030 WeakPolarHBondContact O-CD 3.33Å; P1030-A1032 VanDerWaalsContact C-N 3.31Å
1031	S	94.4	Very high	94.7	Very high	101 Å²	101	58.1 Å²	58.1	71%	0.706	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-3	178.1	58.8	0	0	0	0	114.4	L1029	L1029-S1031 WeakPolarHBondContact CD2-OG 3.4Å; L1029-S1031 WeakPolarHBondContact CG-OG 3.5Å; L1029-S1031 PolarHBondContact O-N 3.36Å
1032	A	94.8	Very high	94.7	Very high	14 Å²	14	60.1 Å²	60.1	12%	0.116	33%	0.332	C	S	.	.	S	Bend	trans	-74.4	145.7	176.3	0	0	0	0	0	111.2	D1026 L1029 P1030 C1034 N1035	D1026-A1032 HydrophobicContact CB-CB 3.87Å; D1026-A1032 WeakPolarHBondContact O-CB 3.44Å; L1029-A1032 HydrophobicContact CB-CB 4.13Å; L1029-A1032 HydrophobicContact CD2-CB 4.49Å; L1029-A1032 WeakPolarHBondContact O-CB 3.22Å; L1029-A1032 PolarHBondContact O-N 2.93Å; P1030-A1032 VanDerWaalsContact C-N 3.31Å; A1032-C1034 PolarHBondContact O-N 2.73Å; A1032-N1035 PolarHBondContact O-N 3.45Å
1033	Q	92.8	Very high	95	Very high	81 Å²	81	58.7 Å²	58.7	38%	0.379	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-57.5	-34.8	-178.8	-173.6	179.7	43.6	0	0	112.8	R923 N1035 E1036	R923-Q1033 VanDerWaalsContact CB-O 3.23Å; R923-Q1033 WeakPolarHBondContact CB-O 3.32Å; R923-Q1033 VanDerWaalsContact CD-O 3.32Å; R923-Q1033 WeakPolarHBondContact CD-O 3.23Å; R923-Q1033 VanDerWaalsContact CG-O 3.26Å; R923-Q1033 WeakPolarHBondContact CG-O 3.31Å; Q1033-N1035 PolarHBondContact O-N 3.35Å; Q1033-N1035 VanDerWaalsContact O-N 3.08Å; Q1033-E1036 PolarHBondContact O-N 3.02Å
1034	C	94.4	Very high	95.3	Very high	13 Å²	13	52.6 Å²	52.6	9%	0.088	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-67.4	-5.5	177.6	61.3	0	0	0	0	114.3	R923 C924 L925 V1021 D1026 A1032	R923-C1034 CarbonylContact C-O 3.59Å; R923-C1034 WeakPolarHBondContact CA-O 3.35Å; C924-C1034 PolarHBondContact N-O 2.87Å; L925-C1034 HydrophobicContact CB-CB 4.34Å; L925-C1034 VanDerWaalsContact CB-O 3.3Å; L925-C1034 WeakPolarHBondContact CB-O 3.27Å; L925-C1034 HydrophobicContact CD2-CB 4.2Å; L925-C1034 PolarHBondContact N-O 3.26Å; V1021-C1034 HydrophobicContact CG1-CB 4.28Å; D1026-C1034 PolarHBondContact O-SG 3.47Å; A1032-C1034 PolarHBondContact O-N 2.73Å
1035	N	96.8	Very high	95.4	Very high	8 Å²	8	50.6 Å²	50.6	4%	0.043	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-120.2	6.5	-179.3	-68.5	-36.4	0	0	0	113.8	R923 H926 D1026 C1027 L1029 A1032 Q1033 Y1037 S1038	R923-N1035 CarbonylContact O-C 3.54Å; R923-N1035 WeakPolarHBondContact O-CA 3.4Å; H926-N1035 WeakPolarHBondContact CB-OD1 3.41Å; H926-N1035 PolarHBondContact N-OD1 3.46Å; D1026-N1035 PolarHBondContact O-ND2 3.04Å; C1027-N1035 PolarHBondContact O-ND2 2.88Å; L1029-N1035 PolarHBondContact O-ND2 2.96Å; A1032-N1035 PolarHBondContact O-N 3.45Å; Q1033-N1035 PolarHBondContact O-N 3.35Å; Q1033-N1035 VanDerWaalsContact O-N 3.08Å; N1035-Y1037 PolarHBondContact O-N 3.45Å; N1035-Y1037 VanDerWaalsContact O-N 3.13Å; N1035-S1038 WeakPolarHBondContact CA-OG 2.98Å; N1035-S1038 WeakPolarHBondContact CB-OG 3.44Å; N1035-S1038 WeakPolarHBondContact O-CB 3.38Å; N1035-S1038 PolarHBondContact O-N 3.38Å; N1035-S1038 PolarHBondContact O-OG 2.82Å
1036	E	96.5	Very high	95.5	Very high	101 Å²	101	47.5 Å²	47.5	47%	0.472	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-36.8	-176.3	-174.7	176.5	-171.7	0	0	114.5	R923 Q1033	R923-E1036 HydrophobicContact CB-CB 4.18Å; R923-E1036 VanDerWaalsContact CD-OE2 3.26Å; R923-E1036 WeakPolarHBondContact CD-OE2 3.47Å; R923-E1036 IonicContact CZ-OE2 2.75Å; R923-E1036 IonicContact NE-OE2 3.06Å; R923-E1036 IonicContact NH1-OE2 3.91Å; R923-E1036 PolarHBondContact NH1-OE2 2.84Å; R923-E1036 PolarHBondContact O-N 3.49Å; R923-E1036 VanDerWaalsContact O-N 3.15Å; Q1033-E1036 PolarHBondContact O-N 3.02Å
1037	Y	97.1	Very high	95.6	Very high	22 Å²	22	45.6 Å²	45.6	9%	0.086	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	25.9	-179.6	-58	-75.5	0	0	0	113	R923 N1035 E1039 E1040 L1043 G1198 L1201 A1202 A1205	R923-Y1037 HydrophobicContact CB-CD2 4Å; R923-Y1037 PolarHBondContact O-N 3.28Å; N1035-Y1037 PolarHBondContact O-N 3.45Å; N1035-Y1037 VanDerWaalsContact O-N 3.13Å; Y1037-E1039 PolarHBondContact O-N 3.42Å; Y1037-E1040 HydrophobicContact CD1-CG 3.98Å; Y1037-E1040 HydrophobicContact CG-CG 4.48Å; Y1037-E1040 WeakPolarHBondContact O-CB 3.29Å; Y1037-E1040 PolarHBondContact O-N 2.97Å; Y1037-E1040 VanDerWaalsContact O-N 3.1Å; Y1037-L1043 HydrophobicContact CG-CD2 4.16Å; Y1037-G1198 PolarHBondContact OH-O 3.43Å; Y1037-L1201 HydrophobicContact CD2-CB 4.07Å; Y1037-L1201 HydrophobicContact CD2-CD1 4.3Å; Y1037-L1201 HydrophobicContact CE2-CB 3.38Å; Y1037-L1201 HydrophobicContact CE2-CD1 3.96Å; Y1037-L1201 HydrophobicContact CE2-CG 4.29Å; Y1037-A1202 WeakPolarHBondContact OH-CA 3.45Å; Y1037-A1202 PolarHBondContact OH-N 3.07Å; Y1037-A1205 HydrophobicContact CD1-CB 4.08Å; Y1037-A1205 HydrophobicContact CE1-CB 4.2Å
1038	S	96.8	Very high	95.7	Very high	17 Å²	17	45.7 Å²	45.7	12%	0.119	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-25.9	-179.3	-61	0	0	0	0	113.6	P927 N1035 E1040	P927-S1038 VanDerWaalsContact CG-O 3.31Å; P927-S1038 WeakPolarHBondContact CG-O 3.32Å; N1035-S1038 WeakPolarHBondContact CA-OG 2.98Å; N1035-S1038 WeakPolarHBondContact CB-OG 3.44Å; N1035-S1038 WeakPolarHBondContact O-CB 3.38Å; N1035-S1038 PolarHBondContact O-N 3.38Å; N1035-S1038 PolarHBondContact O-OG 2.82Å; S1038-E1040 VanDerWaalsContact C-N 3.34Å
1039	E	94.7	Very high	95.9	Very high	173 Å²	173	42.6 Å²	42.6	81%	0.808	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-9.3	177.5	-57.9	-57.9	144.3	0	0	112.7	Y1037 E1041	Y1037-E1039 PolarHBondContact O-N 3.42Å; E1039-E1041 PolarHBondContact O-N 2.92Å
1040	E	95.7	Very high	96	Very high	40 Å²	40	38.9 Å²	38.9	19%	0.187	21%	0.208	C	C	.	.			trans	-80.4	87.3	178.9	-62.4	-62	152.5	0	0	110.5	Y1037 S1038 E1042 L1043 V1044 A1205 R1209	Y1037-E1040 HydrophobicContact CD1-CG 3.98Å; Y1037-E1040 HydrophobicContact CG-CG 4.48Å; Y1037-E1040 WeakPolarHBondContact O-CB 3.29Å; Y1037-E1040 PolarHBondContact O-N 2.97Å; Y1037-E1040 VanDerWaalsContact O-N 3.1Å; S1038-E1040 VanDerWaalsContact C-N 3.34Å; E1040-E1042 VanDerWaalsContact C-N 3.34Å; E1040-E1042 PolarHBondContact O-N 2.88Å; E1040-L1043 HydrophobicContact CB-CB 3.87Å; E1040-L1043 HydrophobicContact CB-CD2 4.49Å; E1040-L1043 WeakPolarHBondContact O-CB 3.49Å; E1040-L1043 PolarHBondContact O-N 3.31Å; E1040-V1044 PolarHBondContact O-N 2.9Å; E1040-A1205 HydrophobicContact CG-CB 4.12Å; E1040-R1209 IonicContact OE1-CZ 3.08Å; E1040-R1209 IonicContact OE1-NE 3.88Å; E1040-R1209 PolarHBondContact OE1-NE 2.76Å; E1040-R1209 IonicContact OE1-NH2 3.48Å; E1040-R1209 PolarHBondContact OE1-NH2 2.78Å; E1040-R1209 IonicContact OE2-CZ 2.68Å; E1040-R1209 IonicContact OE2-NE 2.85Å; E1040-R1209 PolarHBondContact OE2-NE 2.84Å; E1040-R1209 IonicContact OE2-NH2 3.62Å
1041	E	94.8	Very high	96.1	Very high	75 Å²	75	33.6 Å²	33.6	35%	0.35	17%	0.174	S	C	.	.	H	α-helix	trans	-54.6	-42.8	-173.2	-65.7	-171.4	-172.3	0	0	114.3	L966 R970 E1039 L1043 V1044 K1045	L966-E1041 HydrophobicContact CD1-CB 3.86Å; L966-E1041 HydrophobicContact CD1-CG 3.99Å; R970-E1041 IonicContact CZ-OE1 3.71Å; R970-E1041 IonicContact NH2-OE1 3.33Å; R970-E1041 PolarHBondContact NH2-OE1 3.36Å; R970-E1041 IonicContact NH2-OE2 3.84Å; R970-E1041 PolarHBondContact NH2-OE2 2.97Å; E1039-E1041 PolarHBondContact O-N 2.92Å; E1041-L1043 VanDerWaalsContact C-N 3.31Å; E1041-L1043 PolarHBondContact O-N 2.91Å; E1041-V1044 PolarHBondContact O-N 3.12Å; E1041-K1045 WeakPolarHBondContact O-CB 3.49Å; E1041-K1045 VanDerWaalsContact O-CG 3.29Å; E1041-K1045 WeakPolarHBondContact O-CG 3.4Å; E1041-K1045 PolarHBondContact O-N 3.34Å
1042	E	94.6	Very high	96.2	Very high	48 Å²	48	28.8 Å²	28.8	22%	0.224	14%	0.14	C	C	.	.	H	α-helix	trans	-68.4	-32.3	179.4	-65.6	-56.6	146.4	0	0	112.1	E1040 K1045 G1046 L1208	E1040-E1042 VanDerWaalsContact C-N 3.34Å; E1040-E1042 PolarHBondContact O-N 2.88Å; E1042-K1045 VanDerWaalsContact CD-CE 3.44Å; E1042-K1045 VanDerWaalsContact OE1-CE 3.32Å; E1042-K1045 WeakPolarHBondContact OE1-CE 3.35Å; E1042-K1045 IonicContact OE1-NZ 2.85Å; E1042-K1045 PolarHBondContact OE1-NZ 3.29Å; E1042-K1045 VanDerWaalsContact OE2-CE 3.22Å; E1042-K1045 WeakPolarHBondContact OE2-CE 3.46Å; E1042-K1045 IonicContact OE2-NZ 3.72Å; E1042-K1045 PolarHBondContact OE2-NZ 3.44Å; E1042-K1045 VanDerWaalsContact OE2-NZ 3.08Å; E1042-G1046 PolarHBondContact O-N 3.06Å; E1042-L1208 HydrophobicContact CB-CB 3.94Å
1043	L	96.9	Very high	96.2	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-69.6	-47.2	172.8	179.2	63.4	0	0	0	110.6	F922 Y1037 E1040 E1041 K1045 G1046 V1047 L1131 L1204 L1208	F922-L1043 HydrophobicContact CD1-CD1 4.31Å; Y1037-L1043 HydrophobicContact CG-CD2 4.16Å; E1040-L1043 HydrophobicContact CB-CB 3.87Å; E1040-L1043 HydrophobicContact CB-CD2 4.49Å; E1040-L1043 WeakPolarHBondContact O-CB 3.49Å; E1040-L1043 PolarHBondContact O-N 3.31Å; E1041-L1043 VanDerWaalsContact C-N 3.31Å; E1041-L1043 PolarHBondContact O-N 2.91Å; L1043-K1045 VanDerWaalsContact C-N 3.33Å; L1043-K1045 PolarHBondContact O-N 2.93Å; L1043-G1046 CarbonylContact O-C 3.53Å; L1043-G1046 WeakPolarHBondContact O-CA 3.31Å; L1043-G1046 PolarHBondContact O-N 3.42Å; L1043-G1046 VanDerWaalsContact O-N 3.07Å; L1043-V1047 HydrophobicContact CD1-CG2 3.94Å; L1043-V1047 HydrophobicContact CG-CG2 4.26Å; L1043-V1047 WeakPolarHBondContact O-CG2 3.5Å; L1043-V1047 PolarHBondContact O-N 3.47Å; L1043-L1131 HydrophobicContact CD1-CD1 4.42Å; L1043-L1204 HydrophobicContact CD1-CD2 3.6Å; L1043-L1204 HydrophobicContact CD1-CG 4.15Å; L1043-L1208 HydrophobicContact CB-CD1 4.21Å; L1043-L1208 HydrophobicContact CD1-CD1 4.19Å
1044	V	97.8	Very high	96.1	Very high	4 Å²	4	25.7 Å²	25.7	2%	0.024	12%	0.124	C	C	.	.	H	α-helix	trans	-55	-48.1	176.9	165.5	0	0	0	0	111	C924 P927 L928 L966 E1040 E1041 V1047 L1048	C924-V1044 HydrophobicContact CB-CG2 3.96Å; P927-V1044 HydrophobicContact CB-CG1 3.97Å; P927-V1044 HydrophobicContact CB-CG2 4.13Å; P927-V1044 HydrophobicContact CG-CG2 4.08Å; L928-V1044 HydrophobicContact CD2-CB 4.39Å; L928-V1044 HydrophobicContact CD2-CG1 3.79Å; L928-V1044 HydrophobicContact CD2-CG2 4.49Å; L966-V1044 HydrophobicContact CD2-CG1 3.87Å; E1040-V1044 PolarHBondContact O-N 2.9Å; E1041-V1044 PolarHBondContact O-N 3.12Å; V1044-V1047 PolarHBondContact O-N 2.98Å; V1044-L1048 WeakPolarHBondContact O-CB 3.35Å; V1044-L1048 PolarHBondContact O-N 3.4Å
1045	K	97.1	Very high	96.1	Very high	5 Å²	5	25.9 Å²	25.9	2%	0.022	13%	0.125	C	C	.	.	H	α-helix	trans	-65.4	-38.4	176.2	-68.2	-178	-57	166.3	0	112.2	S961 L966 E1041 E1042 L1043 M1049 Q1122	S961-K1045 PolarHBondContact O-NZ 3.1Å; L966-K1045 HydrophobicContact CD1-CD 3.85Å; L966-K1045 HydrophobicContact CD1-CG 4.07Å; L966-K1045 HydrophobicContact CG-CG 4.35Å; E1041-K1045 WeakPolarHBondContact O-CB 3.49Å; E1041-K1045 VanDerWaalsContact O-CG 3.29Å; E1041-K1045 WeakPolarHBondContact O-CG 3.4Å; E1041-K1045 PolarHBondContact O-N 3.34Å; E1042-K1045 VanDerWaalsContact CD-CE 3.44Å; E1042-K1045 VanDerWaalsContact OE1-CE 3.32Å; E1042-K1045 WeakPolarHBondContact OE1-CE 3.35Å; E1042-K1045 IonicContact OE1-NZ 2.85Å; E1042-K1045 PolarHBondContact OE1-NZ 3.29Å; E1042-K1045 VanDerWaalsContact OE2-CE 3.22Å; E1042-K1045 WeakPolarHBondContact OE2-CE 3.46Å; E1042-K1045 IonicContact OE2-NZ 3.72Å; E1042-K1045 PolarHBondContact OE2-NZ 3.44Å; E1042-K1045 VanDerWaalsContact OE2-NZ 3.08Å; L1043-K1045 VanDerWaalsContact C-N 3.33Å; L1043-K1045 PolarHBondContact O-N 2.93Å; K1045-M1049 WeakPolarHBondContact O-CB 3.08Å; K1045-M1049 PolarHBondContact O-N 3.17Å; K1045-Q1122 VanDerWaalsContact CD-O 3.23Å; K1045-Q1122 WeakPolarHBondContact CD-O 3.19Å; K1045-Q1122 VanDerWaalsContact CE-O 3.31Å; K1045-Q1122 WeakPolarHBondContact CE-O 3.23Å; K1045-Q1122 PolarHBondContact NZ-O 3.46Å
1046	G	97	Very high	96	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-62.3	-46.7	175.5	0	0	0	0	0	113.2	E1042 L1043 M1049 A1050 L1131	E1042-G1046 PolarHBondContact O-N 3.06Å; L1043-G1046 CarbonylContact O-C 3.53Å; L1043-G1046 WeakPolarHBondContact O-CA 3.31Å; L1043-G1046 PolarHBondContact O-N 3.42Å; L1043-G1046 VanDerWaalsContact O-N 3.07Å; G1046-M1049 WeakPolarHBondContact O-CE 3.21Å; G1046-M1049 PolarHBondContact O-N 3.27Å; G1046-A1050 PolarHBondContact O-N 2.79Å; G1046-L1131 VanDerWaalsContact C-CD1 3.43Å
1047	V	98.3	Very high	95.9	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-68.9	-39.7	178.4	173.1	0	0	0	0	111.1	L918 A919 F922 L1043 V1044 M1049 A1050 G1051 L1131	L918-V1047 HydrophobicContact CB-CG1 3.82Å; A919-V1047 HydrophobicContact CB-CG1 3.98Å; F922-V1047 HydrophobicContact CB-CG2 3.66Å; F922-V1047 HydrophobicContact CD1-CG2 4.38Å; F922-V1047 HydrophobicContact CD2-CG2 3.9Å; F922-V1047 HydrophobicContact CG-CG2 3.73Å; L1043-V1047 HydrophobicContact CD1-CG2 3.94Å; L1043-V1047 HydrophobicContact CG-CG2 4.26Å; L1043-V1047 WeakPolarHBondContact O-CG2 3.5Å; L1043-V1047 PolarHBondContact O-N 3.47Å; V1044-V1047 PolarHBondContact O-N 2.98Å; V1047-M1049 VanDerWaalsContact C-N 3.32Å; V1047-M1049 PolarHBondContact O-N 3.42Å; V1047-A1050 PolarHBondContact O-N 2.88Å; V1047-G1051 PolarHBondContact O-N 3.24Å; V1047-L1131 HydrophobicContact CG2-CD1 4.26Å
1048	L	98.2	Very high	95.6	Very high	2 Å²	2	20.7 Å²	20.7	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-56.5	-49.2	171.2	-177.9	59	0	0	0	110.8	A915 L928 V931 H965 V1044 A1050 G1051 L1052	A915-L1048 HydrophobicContact CB-CD1 4.43Å; L928-L1048 HydrophobicContact CD1-CB 3.79Å; L928-L1048 HydrophobicContact CD1-CD1 3.66Å; L928-L1048 HydrophobicContact CD1-CG 4.22Å; V931-L1048 HydrophobicContact CG1-CD1 4.12Å; V931-L1048 HydrophobicContact CG1-CD2 4.23Å; H965-L1048 HydrophobicContact CB-CD2 3.74Å; H965-L1048 VanDerWaalsContact ND1-CD2 3.3Å; H965-L1048 WeakPolarHBondContact ND1-CD2 3.28Å; V1044-L1048 WeakPolarHBondContact O-CB 3.35Å; V1044-L1048 PolarHBondContact O-N 3.4Å; L1048-A1050 VanDerWaalsContact C-N 3.34Å; L1048-A1050 PolarHBondContact O-N 3.09Å; L1048-G1051 PolarHBondContact O-N 2.92Å; L1048-L1052 HydrophobicContact CD1-CD1 3.73Å; L1048-L1052 HydrophobicContact CD1-CG 4.08Å; L1048-L1052 HydrophobicContact CG-CD1 3.81Å; L1048-L1052 HydrophobicContact CG-CG 4.42Å; L1048-L1052 WeakPolarHBondContact O-CB 3.46Å; L1048-L1052 VanDerWaalsContact O-CG 3.26Å; L1048-L1052 WeakPolarHBondContact O-CG 3.01Å; L1048-L1052 PolarHBondContact O-N 2.86Å
1049	M	97	Very high	95.3	Very high	1 Å²	1	20 Å²	20	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-60.6	-42.4	177.6	179	-77.5	-47.3	0	0	112	K1045 G1046 V1047 G1051 L1052 Y1053 L1056 T1104 V1123 A1127 V1128 T1132	K1045-M1049 WeakPolarHBondContact O-CB 3.08Å; K1045-M1049 PolarHBondContact O-N 3.17Å; G1046-M1049 WeakPolarHBondContact O-CE 3.21Å; G1046-M1049 PolarHBondContact O-N 3.27Å; V1047-M1049 VanDerWaalsContact C-N 3.32Å; V1047-M1049 PolarHBondContact O-N 3.42Å; M1049-G1051 VanDerWaalsContact C-N 3.31Å; M1049-G1051 PolarHBondContact O-N 3.22Å; M1049-L1052 CarbonylContact O-C 3.55Å; M1049-L1052 PolarHBondContact O-N 3.44Å; M1049-Y1053 WeakPolarHBondContact O-CB 3.25Å; M1049-Y1053 PolarHBondContact O-N 3.01Å; M1049-Y1053 HydrophobicContact SD-CD2 4.3Å; M1049-L1056 HydrophobicContact CG-CD1 4.23Å; M1049-T1104 WeakPolarHBondContact CA-OG1 3.35Å; M1049-T1104 HydrophobicContact CB-CG2 3.92Å; M1049-V1123 HydrophobicContact CB-CG1 4Å; M1049-V1123 HydrophobicContact CB-CG2 3.85Å; M1049-V1123 HydrophobicContact CE-CG1 4.38Å; M1049-V1123 HydrophobicContact CG-CG1 4.11Å; M1049-V1123 HydrophobicContact CG-CG2 4.06Å; M1049-A1127 WeakPolarHBondContact CE-O 3.44Å; M1049-V1128 VanDerWaalsContact CE-CA 3.48Å; M1049-V1128 HydrophobicContact CE-CB 4.29Å; M1049-V1128 HydrophobicContact CE-CG2 4.25Å; M1049-V1128 HydrophobicContact SD-CG1 4.33Å; M1049-V1128 HydrophobicContact SD-CG2 4.44Å; M1049-T1132 HydrophobicContact CE-CG2 3.91Å; M1049-T1132 HydrophobicContact SD-CG2 3.66Å
1050	A	96.7	Very high	94.8	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-62.2	-38.1	177.2	0	0	0	0	0	112.6	K914 L918 G1046 V1047 L1048 L1131	K914-A1050 WeakPolarHBondContact CE-O 3.35Å; L918-A1050 HydrophobicContact CD1-CB 3.79Å; G1046-A1050 PolarHBondContact O-N 2.79Å; V1047-A1050 PolarHBondContact O-N 2.88Å; L1048-A1050 VanDerWaalsContact C-N 3.34Å; L1048-A1050 PolarHBondContact O-N 3.09Å; A1050-L1131 HydrophobicContact CB-CB 3.85Å; A1050-L1131 VanDerWaalsContact CB-O 3.26Å; A1050-L1131 WeakPolarHBondContact CB-O 3.49Å
1051	G	96.8	Very high	94	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-69.7	-35.2	173.8	0	0	0	0	0	113.7	R911 V1047 L1048 M1049	R911-G1051 CarbonylContact C-O 2.99Å; R911-G1051 WeakPolarHBondContact CA-O 3.32Å; R911-G1051 WeakPolarHBondContact CB-O 3.49Å; R911-G1051 CarbonylContact O-C 3.56Å; R911-G1051 VanDerWaalsContact O-O 3.04Å; V1047-G1051 PolarHBondContact O-N 3.24Å; L1048-G1051 PolarHBondContact O-N 2.92Å; M1049-G1051 VanDerWaalsContact C-N 3.31Å; M1049-G1051 PolarHBondContact O-N 3.22Å
1052	L	96	Very high	93.1	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-86.6	-13	-179.4	-65.8	-179.4	0	0	0	114.2	R911 L912 L1048 M1049 N1055 F1106	R911-L1052 HydrophobicContact CB-CD2 4.04Å; L912-L1052 HydrophobicContact CD2-CD2 3.83Å; L1048-L1052 HydrophobicContact CD1-CD1 3.73Å; L1048-L1052 HydrophobicContact CD1-CG 4.08Å; L1048-L1052 HydrophobicContact CG-CD1 3.81Å; L1048-L1052 HydrophobicContact CG-CG 4.42Å; L1048-L1052 WeakPolarHBondContact O-CB 3.46Å; L1048-L1052 VanDerWaalsContact O-CG 3.26Å; L1048-L1052 WeakPolarHBondContact O-CG 3.01Å; L1048-L1052 PolarHBondContact O-N 2.86Å; M1049-L1052 CarbonylContact O-C 3.55Å; M1049-L1052 PolarHBondContact O-N 3.44Å; L1052-N1055 HydrophobicContact CB-CB 4.34Å; L1052-N1055 WeakPolarHBondContact O-CB 3.44Å; L1052-N1055 VanDerWaalsContact O-CG 3.28Å; L1052-N1055 PolarHBondContact O-N 3.46Å; L1052-F1106 HydrophobicContact CD1-CB 4.18Å; L1052-F1106 HydrophobicContact CD2-CB 4.11Å; L1052-F1106 HydrophobicContact CD2-CD2 3.65Å; L1052-F1106 HydrophobicContact CD2-CG 4.29Å
1053	Y	94.3	Very high	92.3	Very high	10 Å²	10	8.8 Å²	8.8	4%	0.039	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	130.9	178.8	-168.7	-94.6	0	0	0	110.2	M1049 T1132 L1149 D1151	M1049-Y1053 WeakPolarHBondContact O-CB 3.25Å; M1049-Y1053 PolarHBondContact O-N 3.01Å; M1049-Y1053 HydrophobicContact SD-CD2 4.3Å; Y1053-T1132 HydrophobicContact CD2-CG2 3.54Å; Y1053-T1132 HydrophobicContact CE2-CG2 3.83Å; Y1053-T1132 HydrophobicContact CG-CG2 4Å; Y1053-L1149 HydrophobicContact CE2-CD1 4.35Å; Y1053-D1151 WeakPolarHBondContact CE1-OD2 3.49Å; Y1053-D1151 VanDerWaalsContact CZ-OD2 3.29Å; Y1053-D1151 PolarHBondContact OH-OD1 3.08Å; Y1053-D1151 PolarHBondContact OH-OD2 3.25Å
1054	P	91.5	Very high	91.2	Very high	20 Å²	20	8.8 Å²	8.8	13%	0.13	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	cis	-92.3	21.7	19	37.6	-38.8	0	0	0	116.6	L1056 K1080	P1054-L1056 PolarHBondContact O-N 2.82Å; P1054-K1080 HydrophobicContact CB-CD 4.37Å
1055	N	93.5	Very high	90	Very high	17 Å²	17	9 Å²	9	9%	0.091	4%	0.043	C	C	.	.			trans	-72	61.9	178	-65	-0.3	0	0	0	113.3	L1052 T1104 Y1105	L1052-N1055 HydrophobicContact CB-CB 4.34Å; L1052-N1055 WeakPolarHBondContact O-CB 3.44Å; L1052-N1055 VanDerWaalsContact O-CG 3.28Å; L1052-N1055 PolarHBondContact O-N 3.46Å; N1055-T1104 WeakPolarHBondContact O-CA 3.32Å; N1055-T1104 PolarHBondContact O-OG1 2.83Å; N1055-Y1105 HydrophobicContact CB-CD1 4.06Å; N1055-Y1105 HydrophobicContact CB-CD2 4.46Å; N1055-Y1105 HydrophobicContact CB-CE1 3.83Å; N1055-Y1105 HydrophobicContact CB-CE2 4.22Å; N1055-Y1105 HydrophobicContact CB-CG 4.38Å; N1055-Y1105 WeakPolarHBondContact CB-O 3.45Å; N1055-Y1105 PolarHBondContact ND2-O 3.18Å; N1055-Y1105 WeakPolarHBondContact O-CD1 3.5Å; N1055-Y1105 PolarHBondContact O-N 3.08Å
1056	L	94.5	Very high	88.5	Confident	0 Å²	0	18 Å²	18	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	134.1	178.7	-172.9	71.2	0	0	0	110.1	M1049 P1054 W1102 V1128 L1154	M1049-L1056 HydrophobicContact CG-CD1 4.23Å; P1054-L1056 PolarHBondContact O-N 2.82Å; L1056-W1102 HydrophobicContact CD1-CB 4.17Å; L1056-V1128 HydrophobicContact CD1-CG1 4.06Å; L1056-V1128 HydrophobicContact CD1-CG2 4.12Å; L1056-V1128 HydrophobicContact CD2-CG1 3.71Å; L1056-L1154 HydrophobicContact CB-CD1 4.23Å; L1056-L1154 HydrophobicContact CD2-CB 4.11Å; L1056-L1154 HydrophobicContact CD2-CD1 4.26Å; L1056-L1154 HydrophobicContact CG-CD1 4.41Å
1057	I	94.1	Very high	87.2	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	128.6	173.1	-62.6	159.2	0	0	0	108.5	Y1077 R1078 T1079 I1084 L1086 W1102 L1103 Y1105 V1117	I1057-Y1077 HydrophobicContact CG2-CD1 3.87Å; I1057-Y1077 HydrophobicContact CG2-CG 4.29Å; I1057-R1078 CarbonylContact C-O 3.52Å; I1057-R1078 WeakPolarHBondContact CA-O 3.26Å; I1057-T1079 HydrophobicContact CG1-CG2 3.79Å; I1057-I1084 HydrophobicContact CD1-CD1 3.97Å; I1057-I1084 HydrophobicContact CG1-CD1 4.33Å; I1057-I1084 HydrophobicContact CG1-CG1 4.42Å; I1057-L1086 HydrophobicContact CD1-CD2 4.26Å; I1057-W1102 VanDerWaalsContact O-CA 3.3Å; I1057-W1102 WeakPolarHBondContact O-CA 3.41Å; I1057-L1103 HydrophobicContact CB-CB 4.05Å; I1057-L1103 HydrophobicContact CD1-CB 4.17Å; I1057-L1103 HydrophobicContact CD1-CD1 4.47Å; I1057-L1103 HydrophobicContact CG2-CD1 4.29Å; I1057-L1103 PolarHBondContact N-O 3.44Å; I1057-L1103 PolarHBondContact O-N 3.42Å; I1057-Y1105 HydrophobicContact CD1-CD1 3.42Å; I1057-Y1105 VanDerWaalsContact CD1-CD1 3.42Å; I1057-Y1105 HydrophobicContact CD1-CE1 3.91Å; I1057-Y1105 HydrophobicContact CD1-CG 4.19Å; I1057-Y1105 HydrophobicContact CG1-CD1 3.63Å; I1057-Y1105 HydrophobicContact CG1-CE1 3.65Å; I1057-V1117 HydrophobicContact CD1-CG1 4.34Å; I1057-V1117 HydrophobicContact CD1-CG2 4.27Å
1058	Q	91.7	Very high	85.8	Confident	21 Å²	21	24.7 Å²	24.7	10%	0.098	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	123.4	163.8	-171.1	-173.2	39.6	0	0	109.5	R1060 R1078 L1154	Q1058-R1060 HydrophobicContact CG-CG 4.46Å; Q1058-R1078 PolarHBondContact N-O 2.82Å; Q1058-R1078 PolarHBondContact O-N 2.93Å; Q1058-L1154 HydrophobicContact CB-CB 4.29Å; Q1058-L1154 HydrophobicContact CB-CD2 3.84Å; Q1058-L1154 PolarHBondContact NE2-O 3.49Å
1059	V	89.4	Confident	84.8	Confident	3 Å²	3	29.2 Å²	29.2	2%	0.018	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	123.6	175.4	-177.6	0	0	0	0	108.9	V1075 Y1077 L1098 R1101 L1103 M1217	V1059-V1075 HydrophobicContact CG1-CG1 3.29Å; V1059-Y1077 HydrophobicContact CG1-CE1 4.38Å; V1059-Y1077 HydrophobicContact CG2-CD1 4.04Å; V1059-Y1077 HydrophobicContact CG2-CE1 4.06Å; V1059-L1098 HydrophobicContact CB-CD1 4.39Å; V1059-L1098 HydrophobicContact CG1-CD1 3.58Å; V1059-L1098 HydrophobicContact CG2-CD1 4.08Å; V1059-R1101 WeakPolarHBondContact CB-O 3.44Å; V1059-R1101 VanDerWaalsContact CG2-O 3.32Å; V1059-R1101 WeakPolarHBondContact CG2-O 3.5Å; V1059-R1101 PolarHBondContact N-O 3.39Å; V1059-L1103 HydrophobicContact CG2-CD1 3.94Å; V1059-L1103 HydrophobicContact CG2-CG 4.14Å; V1059-M1217 HydrophobicContact CB-CE 4.18Å; V1059-M1217 HydrophobicContact CG1-CE 3.58Å
1060	R	85.3	Confident	83.9	Confident	16 Å²	16	29.6 Å²	29.6	6%	0.06	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	149.2	179.4	-70	179.9	179.4	-165	-2.9	110.7	D232 T234 Q371 Q1058 V1075 T1076 R1078	D232-R1060 IonicContact OD2-CZ 3.69Å; D232-R1060 IonicContact OD2-NH1 3.46Å; D232-R1060 PolarHBondContact OD2-NH1 3.26Å; T234-R1060 PolarHBondContact OG1-NH1 3.34Å; Q371-R1060 HydrophobicContact CG-CB 4.47Å; Q371-R1060 HydrophobicContact CG-CG 4.46Å; Q1058-R1060 HydrophobicContact CG-CG 4.46Å; R1060-V1075 CarbonylContact O-C 3.52Å; R1060-V1075 VanDerWaalsContact O-CA 3.28Å; R1060-V1075 WeakPolarHBondContact O-CA 3.44Å; R1060-T1076 WeakPolarHBondContact CB-OG1 3.32Å; R1060-T1076 PolarHBondContact N-O 3.41Å; R1060-T1076 PolarHBondContact O-N 3.18Å; R1060-R1078 VanDerWaalsContact NH2-CD 3.35Å
1061	Q	79.4	Confident	83.1	Confident	58 Å²	58	33.7 Å²	33.7	27%	0.271	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	137.7	177.3	-71.6	-177.5	-10.4	0	0	111	L367 Q371 M1217	L367-Q1061 HydrophobicContact CD1-CB 4.31Å; L367-Q1061 VanDerWaalsContact CD2-O 3.27Å; L367-Q1061 WeakPolarHBondContact CD2-O 3.41Å; L367-Q1061 WeakPolarHBondContact CG-O 3.15Å; Q371-Q1061 PolarHBondContact NE2-O 2.71Å; Q1061-M1217 HydrophobicContact CG-CE 3.69Å; Q1061-M1217 HydrophobicContact CG-SD 3.82Å; Q1061-M1217 PolarHBondContact NE2-SD 2.91Å
1062	G	74.8	Confident	82	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	99.1	131.5	-178	0	0	0	0	0	112.8	K1071 P1072 S1074 T1076	G1062-K1071 WeakPolarHBondContact CA-O 3.18Å; G1062-P1072 WeakPolarHBondContact CA-O 3.31Å; G1062-P1072 PolarHBondContact N-O 2.84Å; G1062-P1072 VanDerWaalsContact N-O 3.15Å; G1062-S1074 WeakPolarHBondContact CA-O 3.19Å; G1062-S1074 PolarHBondContact N-O 3.05Å; G1062-T1076 WeakPolarHBondContact O-CG2 3.49Å
1063	K	77.8	Confident	80.9	Confident	27 Å²	27	44.2 Å²	44.2	12%	0.117	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	148.8	168.4	85.8	-161	169.8	173	0	111.7	E227 T230 K1071 S1074 T1076	E227-K1063 IonicContact OE1-NZ 3.63Å; T230-K1063 HydrophobicContact CG2-CD 4.13Å; T230-K1063 HydrophobicContact CG2-CG 4.34Å; K1063-K1071 HydrophobicContact CG-CB 4.17Å; K1063-K1071 HydrophobicContact CG-CD 4.34Å; K1063-K1071 PolarHBondContact N-O 2.93Å; K1063-K1071 PolarHBondContact O-N 3.33Å; K1063-S1074 WeakPolarHBondContact CD-OG 3.2Å; K1063-S1074 WeakPolarHBondContact CE-OG 3.21Å; K1063-S1074 WeakPolarHBondContact CG-OG 3.18Å; K1063-S1074 PolarHBondContact N-OG 3.35Å; K1063-T1076 HydrophobicContact CB-CG2 3.57Å
1064	V	73.5	Confident	80.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121.8	171.4	-177.8	0	0	0	0	108.1	I231 F236 A357 L364 K1069 F1070	I231-V1064 PolarHBondContact N-O 3.32Å; I231-V1064 PolarHBondContact O-N 3.07Å; F236-V1064 HydrophobicContact CB-CG2 4.29Å; F236-V1064 HydrophobicContact CD1-CG2 4.42Å; F236-V1064 HydrophobicContact CD2-CB 4.45Å; F236-V1064 HydrophobicContact CD2-CG1 3.86Å; F236-V1064 HydrophobicContact CE2-CG1 4.08Å; F236-V1064 HydrophobicContact CG-CB 4.41Å; F236-V1064 HydrophobicContact CG-CG1 4.21Å; F236-V1064 HydrophobicContact CG-CG2 4.2Å; A357-V1064 HydrophobicContact CB-CG1 3.81Å; A357-V1064 HydrophobicContact CB-CG2 4.42Å; L364-V1064 HydrophobicContact CD1-CG2 4.4Å; L364-V1064 HydrophobicContact CD2-CG2 3.68Å; V1064-K1069 WeakPolarHBondContact CA-O 3.47Å; V1064-F1070 HydrophobicContact CG2-CD2 4.25Å
1065	T	73.3	Confident	79.9	Confident	8 Å²	8	46.2 Å²	46.2	5%	0.049	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	158.9	174.1	69	0	0	0	0	110.3	Q1067 G1068 K1069	T1065-Q1067 PolarHBondContact O-N 2.79Å; T1065-Q1067 VanDerWaalsContact O-N 3.14Å; T1065-G1068 WeakPolarHBondContact O-CA 3.28Å; T1065-G1068 PolarHBondContact O-N 3.44Å; T1065-K1069 HydrophobicContact CG2-CB 4.23Å; T1065-K1069 PolarHBondContact N-O 3.38Å; T1065-K1069 VanDerWaalsContact OG1-CB 3.27Å; T1065-K1069 WeakPolarHBondContact OG1-CB 3.4Å; T1065-K1069 PolarHBondContact OG1-N 2.96Å; T1065-K1069 VanDerWaalsContact OG1-N 3.09Å
1066	R	66	Low	79.4	Confident	196 Å²	196	46 Å²	46	74%	0.74	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-31.7	170.9	-100.2	169.1	-170.9	-174.3	5.5	113.9	G229 G1068	G229-R1066 WeakPolarHBondContact O-CB 3.31Å; G229-R1066 WeakPolarHBondContact O-CG 3.28Å; G229-R1066 PolarHBondContact O-N 2.92Å; G229-R1066 VanDerWaalsContact O-N 3.14Å; R1066-G1068 PolarHBondContact O-N 2.91Å; R1066-G1068 VanDerWaalsContact O-N 3.16Å
1067	Q	68.2	Low	79.3	Confident	135 Å²	135	46.9 Å²	46.9	63%	0.631	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.5	1.7	173.3	-59.8	-178.2	0	0	0	113.6	E228 T1065	E228-Q1067 PolarHBondContact OE1-NE2 2.91Å; E228-Q1067 PolarHBondContact OE2-NE2 2.93Å; T1065-Q1067 PolarHBondContact O-N 2.79Å; T1065-Q1067 VanDerWaalsContact O-N 3.14Å
1068	G	70.5	Confident	79	Confident	5 Å²	5	49.8 Å²	49.8	5%	0.052	24%	0.236	C	C	.	.			trans	73	26.5	-176.8	0	0	0	0	0	113.4	H356 A357 T1065 R1066	H356-G1068 CarbonylContact C-O 3.52Å; H356-G1068 PolarHBondContact N-O 3.39Å; A357-G1068 VanDerWaalsContact CB-O 3.23Å; A357-G1068 WeakPolarHBondContact CB-O 3.38Å; A357-G1068 PolarHBondContact N-O 3.39Å; T1065-G1068 WeakPolarHBondContact O-CA 3.28Å; T1065-G1068 PolarHBondContact O-N 3.44Å; R1066-G1068 PolarHBondContact O-N 2.91Å; R1066-G1068 VanDerWaalsContact O-N 3.16Å
1069	K	77.3	Confident	78.9	Confident	96 Å²	96	49 Å²	49	42%	0.417	23%	0.232	S	C	.	.			trans	-87.6	117.8	174.7	-168.8	175.6	-178.6	173	0	110.7	V1064 T1065	V1064-K1069 WeakPolarHBondContact CA-O 3.47Å; T1065-K1069 HydrophobicContact CG2-CB 4.23Å; T1065-K1069 PolarHBondContact N-O 3.38Å; T1065-K1069 VanDerWaalsContact OG1-CB 3.27Å; T1065-K1069 WeakPolarHBondContact OG1-CB 3.4Å; T1065-K1069 PolarHBondContact OG1-N 2.96Å; T1065-K1069 VanDerWaalsContact OG1-N 3.09Å
1070	F	78	Confident	78.8	Confident	10 Å²	10	53.4 Å²	53.4	4%	0.044	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	125.2	174.7	174.4	-130.9	0	0	0	110.7	V233 H356 A357 N360 L364 L367 V1064 P1072	V233-F1070 HydrophobicContact CG2-CE2 4.06Å; H356-F1070 PolarHBondContact CE1-O 2.87Å; H356-F1070 PolarHBondContact ND1-N 3.45Å; A357-F1070 HydrophobicContact CB-CB 4.41Å; N360-F1070 HydrophobicContact CB-CD1 3.79Å; N360-F1070 HydrophobicContact CB-CE1 4.41Å; L364-F1070 HydrophobicContact CD2-CD1 4.43Å; L364-F1070 HydrophobicContact CD2-CD2 3.28Å; L364-F1070 HydrophobicContact CD2-CE1 4.48Å; L364-F1070 HydrophobicContact CD2-CE2 3.35Å; L364-F1070 HydrophobicContact CD2-CG 3.85Å; L364-F1070 HydrophobicContact CD2-CZ 3.97Å; L364-F1070 HydrophobicContact CG-CD1 4.42Å; L364-F1070 HydrophobicContact CG-CD2 4.1Å; L364-F1070 HydrophobicContact CG-CE2 4.2Å; L364-F1070 HydrophobicContact CG-CG 4.19Å; L364-F1070 HydrophobicContact CG-CZ 4.39Å; L367-F1070 HydrophobicContact CD2-CE2 3.84Å; L367-F1070 HydrophobicContact CD2-CZ 3.69Å; V1064-F1070 HydrophobicContact CG2-CD2 4.25Å; F1070-P1072 HydrophobicContact CE1-CB 3.87Å; F1070-P1072 HydrophobicContact CE1-CG 4.22Å; F1070-P1072 HydrophobicContact CE2-CB 4.28Å; F1070-P1072 HydrophobicContact CZ-CB 3.65Å; F1070-P1072 HydrophobicContact CZ-CG 4.44Å
1071	K	78.7	Confident	78.6	Confident	86 Å²	86	56.7 Å²	56.7	37%	0.374	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	98.2	173.7	-65.1	176.2	176.9	-179.8	0	107.8	G1062 K1063 S1074	G1062-K1071 WeakPolarHBondContact CA-O 3.18Å; K1063-K1071 HydrophobicContact CG-CB 4.17Å; K1063-K1071 HydrophobicContact CG-CD 4.34Å; K1063-K1071 PolarHBondContact N-O 2.93Å; K1063-K1071 PolarHBondContact O-N 3.33Å; K1071-S1074 WeakPolarHBondContact CB-OG 3.28Å; K1071-S1074 PolarHBondContact O-OG 2.83Å
1072	P	73.7	Confident	78.8	Confident	63 Å²	63	55.2 Å²	55.2	41%	0.409	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	-38.5	-176.3	21.9	-31.6	0	0	0	113.1	G1062 F1070 S1074	G1062-P1072 WeakPolarHBondContact CA-O 3.31Å; G1062-P1072 PolarHBondContact N-O 2.84Å; G1062-P1072 VanDerWaalsContact N-O 3.15Å; F1070-P1072 HydrophobicContact CE1-CB 3.87Å; F1070-P1072 HydrophobicContact CE1-CG 4.22Å; F1070-P1072 HydrophobicContact CE2-CB 4.28Å; F1070-P1072 HydrophobicContact CZ-CB 3.65Å; F1070-P1072 HydrophobicContact CZ-CG 4.44Å; P1072-S1074 VanDerWaalsContact C-N 3.3Å; P1072-S1074 PolarHBondContact O-N 2.95Å
1073	N	73.8	Confident	79.4	Confident	158 Å²	158	58 Å²	58	85%	0.845	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	0.7	-173.7	-62.9	-13	0	0	0	114.4
1074	S	80.1	Confident	80	Confident	21 Å²	21	57.1 Å²	57.1	15%	0.147	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	150.7	177.4	58.5	0	0	0	0	111.1	G1062 K1063 K1071 P1072	G1062-S1074 WeakPolarHBondContact CA-O 3.19Å; G1062-S1074 PolarHBondContact N-O 3.05Å; K1063-S1074 WeakPolarHBondContact CD-OG 3.2Å; K1063-S1074 WeakPolarHBondContact CE-OG 3.21Å; K1063-S1074 WeakPolarHBondContact CG-OG 3.18Å; K1063-S1074 PolarHBondContact N-OG 3.35Å; K1071-S1074 WeakPolarHBondContact CB-OG 3.28Å; K1071-S1074 PolarHBondContact O-OG 2.83Å; P1072-S1074 VanDerWaalsContact C-N 3.3Å; P1072-S1074 PolarHBondContact O-N 2.95Å
1075	V	83.3	Confident	80.8	Confident	50 Å²	50	58.4 Å²	58.4	30%	0.303	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	145.2	-177.4	172.7	0	0	0	0	111.2	V1059 R1060 Y1077	V1059-V1075 HydrophobicContact CG1-CG1 3.29Å; R1060-V1075 CarbonylContact O-C 3.52Å; R1060-V1075 VanDerWaalsContact O-CA 3.28Å; R1060-V1075 WeakPolarHBondContact O-CA 3.44Å; V1075-Y1077 HydrophobicContact CG1-CD1 4.37Å; V1075-Y1077 HydrophobicContact CG1-CE1 3.85Å; V1075-Y1077 HydrophobicContact CG1-CE2 4.16Å
1076	T	84.8	Confident	81.7	Confident	12 Å²	12	58.1 Å²	58.1	7%	0.074	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	150	167.7	55	0	0	0	0	109.8	R1060 G1062 K1063	R1060-T1076 WeakPolarHBondContact CB-OG1 3.32Å; R1060-T1076 PolarHBondContact N-O 3.41Å; R1060-T1076 PolarHBondContact O-N 3.18Å; G1062-T1076 WeakPolarHBondContact O-CG2 3.49Å; K1063-T1076 HydrophobicContact CB-CG2 3.57Å
1077	Y	90.6	Very high	82.7	Confident	19 Å²	19	50.2 Å²	50.2	8%	0.075	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	118.1	-177.6	-57.7	-80.8	0	0	0	109	I1057 V1059 V1075 N1083 I1084 L1086 L1103	I1057-Y1077 HydrophobicContact CG2-CD1 3.87Å; I1057-Y1077 HydrophobicContact CG2-CG 4.29Å; V1059-Y1077 HydrophobicContact CG1-CE1 4.38Å; V1059-Y1077 HydrophobicContact CG2-CD1 4.04Å; V1059-Y1077 HydrophobicContact CG2-CE1 4.06Å; V1075-Y1077 HydrophobicContact CG1-CD1 4.37Å; V1075-Y1077 HydrophobicContact CG1-CE1 3.85Å; V1075-Y1077 HydrophobicContact CG1-CE2 4.16Å; Y1077-N1083 WeakPolarHBondContact O-CA 3.42Å; Y1077-I1084 HydrophobicContact CG-CD1 4.28Å; Y1077-I1084 PolarHBondContact O-N 2.89Å; Y1077-L1086 HydrophobicContact CD1-CD1 4.18Å; Y1077-L1086 HydrophobicContact CD1-CD2 4.5Å; Y1077-L1086 HydrophobicContact CD1-CG 4.12Å; Y1077-L1086 HydrophobicContact CD2-CG 4Å; Y1077-L1086 HydrophobicContact CE1-CD1 3.53Å; Y1077-L1086 HydrophobicContact CE1-CG 3.89Å; Y1077-L1086 HydrophobicContact CE2-CB 4.36Å; Y1077-L1086 HydrophobicContact CE2-CD1 4.01Å; Y1077-L1086 HydrophobicContact CE2-CG 3.76Å; Y1077-L1086 HydrophobicContact CG-CG 4.17Å; Y1077-L1086 VanDerWaalsContact CZ-CD1 3.43Å; Y1077-L1103 HydrophobicContact CD1-CD1 4.12Å; Y1077-L1103 HydrophobicContact CE1-CD1 4.03Å
1078	R	88.7	Confident	83.5	Confident	62 Å²	62	49.7 Å²	49.7	23%	0.234	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	132.6	-176.8	-177.1	-176.2	176.6	94.6	-0.6	110.9	I1057 Q1058 R1060 L1154	I1057-R1078 CarbonylContact C-O 3.52Å; I1057-R1078 WeakPolarHBondContact CA-O 3.26Å; Q1058-R1078 PolarHBondContact N-O 2.82Å; Q1058-R1078 PolarHBondContact O-N 2.93Å; R1060-R1078 VanDerWaalsContact NH2-CD 3.35Å; R1078-L1154 HydrophobicContact CG-CD2 4.13Å
1079	T	90.5	Very high	84.2	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.018	26%	0.264	C	S	.	.			trans	-112	179.8	170.3	68.9	0	0	0	0	110.1	I1057 S1081 G1082 I1084 Y1105	I1057-T1079 HydrophobicContact CG1-CG2 3.79Å; T1079-S1081 PolarHBondContact O-N 2.94Å; T1079-S1081 PolarHBondContact OG1-N 2.87Å; T1079-S1081 PolarHBondContact OG1-OG 2.81Å; T1079-G1082 PolarHBondContact N-O 3.19Å; T1079-G1082 PolarHBondContact O-N 2.75Å; T1079-G1082 PolarHBondContact OG1-N 2.64Å; T1079-G1082 PolarHBondContact OG1-O 2.88Å; T1079-I1084 HydrophobicContact CG2-CG1 3.82Å; T1079-I1084 HydrophobicContact CG2-CG2 3.94Å; T1079-Y1105 HydrophobicContact CG2-CE1 3.99Å
1080	K	85.5	Confident	84.9	Confident	97 Å²	97	45.9 Å²	45.9	42%	0.422	25%	0.245	S	C	.	.	S	Bend	trans	-60.9	-31.1	172	-172.4	175.3	-178.5	174.6	0	112.3	E886 P1054 D1151	E886-K1080 IonicContact OE1-NZ 3.3Å; E886-K1080 PolarHBondContact OE1-NZ 3.35Å; P1054-K1080 HydrophobicContact CB-CD 4.37Å; K1080-D1151 WeakPolarHBondContact CE-O 3.49Å; K1080-D1151 PolarHBondContact NZ-O 3.14Å; K1080-D1151 IonicContact NZ-OD2 2.74Å
1081	S	82.2	Confident	85.4	Confident	84 Å²	84	47 Å²	47	59%	0.587	25%	0.251	S	S	*	.	S	Bend	trans	-90.7	-12.5	-177.4	54.8	0	0	0	0	114.6	T1079	T1079-S1081 PolarHBondContact O-N 2.94Å; T1079-S1081 PolarHBondContact OG1-N 2.87Å; T1079-S1081 PolarHBondContact OG1-OG 2.81Å
1082	G	84	Confident	86	Confident	28 Å²	28	43 Å²	43	29%	0.289	23%	0.234	S	C	.	.			trans	144.4	-163.7	177.4	0	0	0	0	0	113.3	T1079	T1079-G1082 PolarHBondContact N-O 3.19Å; T1079-G1082 PolarHBondContact O-N 2.75Å; T1079-G1082 PolarHBondContact OG1-N 2.64Å; T1079-G1082 PolarHBondContact OG1-O 2.88Å
1083	N	87.3	Confident	86.7	Confident	58 Å²	58	43.2 Å²	43.2	31%	0.31	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	139.9	176.4	-64.6	-26.7	0	0	0	110.6	E235 Y1077	E235-N1083 PolarHBondContact OE2-ND2 3.27Å; Y1077-N1083 WeakPolarHBondContact O-CA 3.42Å
1084	I	90	Very high	86.7	Confident	8 Å²	8	44 Å²	44	4%	0.041	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	166.2	178.3	66.4	82.7	0	0	0	110.3	I1057 Y1077 T1079 L1086 V1115 V1117	I1057-I1084 HydrophobicContact CD1-CD1 3.97Å; I1057-I1084 HydrophobicContact CG1-CD1 4.33Å; I1057-I1084 HydrophobicContact CG1-CG1 4.42Å; Y1077-I1084 HydrophobicContact CG-CD1 4.28Å; Y1077-I1084 PolarHBondContact O-N 2.89Å; T1079-I1084 HydrophobicContact CG2-CG1 3.82Å; T1079-I1084 HydrophobicContact CG2-CG2 3.94Å; I1084-L1086 HydrophobicContact CD1-CD2 4.01Å; I1084-V1115 HydrophobicContact CB-CB 4.5Å; I1084-V1115 HydrophobicContact CB-CG1 4.48Å; I1084-V1115 HydrophobicContact CG2-CB 4.03Å; I1084-V1115 HydrophobicContact CG2-CG1 3.92Å; I1084-V1117 HydrophobicContact CB-CG2 4.46Å; I1084-V1117 HydrophobicContact CD1-CB 4.14Å; I1084-V1117 HydrophobicContact CD1-CG2 3.61Å; I1084-V1117 HydrophobicContact CG1-CG2 4.08Å
1085	L	90.3	Very high	86.2	Confident	28 Å²	28	44.7 Å²	44.7	15%	0.147	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	141.8	172.2	-61.7	178.6	0	0	0	109.6	E227 V1115 F1116 V1117	E227-L1085 WeakPolarHBondContact OE2-CD2 3.37Å; L1085-V1115 PolarHBondContact N-O 3.37Å; L1085-F1116 HydrophobicContact CB-CD1 3.8Å; L1085-F1116 HydrophobicContact CB-CE1 3.85Å; L1085-F1116 HydrophobicContact CD1-CE1 3.75Å; L1085-F1116 HydrophobicContact CD1-CZ 4.02Å; L1085-F1116 HydrophobicContact CG-CE1 4.45Å; L1085-F1116 CarbonylContact O-C 3.51Å; L1085-F1116 VanDerWaalsContact O-CA 3.25Å; L1085-F1116 WeakPolarHBondContact O-CA 3.12Å; L1085-V1117 PolarHBondContact O-N 3.29Å
1086	L	91.3	Very high	85.4	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	132.5	166.9	-63.2	-170.6	0	0	0	109.1	I1057 Y1077 I1084 T1090 N1092 R1093 L1103 V1117	I1057-L1086 HydrophobicContact CD1-CD2 4.26Å; Y1077-L1086 HydrophobicContact CD1-CD1 4.18Å; Y1077-L1086 HydrophobicContact CD1-CD2 4.5Å; Y1077-L1086 HydrophobicContact CD1-CG 4.12Å; Y1077-L1086 HydrophobicContact CD2-CG 4Å; Y1077-L1086 HydrophobicContact CE1-CD1 3.53Å; Y1077-L1086 HydrophobicContact CE1-CG 3.89Å; Y1077-L1086 HydrophobicContact CE2-CB 4.36Å; Y1077-L1086 HydrophobicContact CE2-CD1 4.01Å; Y1077-L1086 HydrophobicContact CE2-CG 3.76Å; Y1077-L1086 HydrophobicContact CG-CG 4.17Å; Y1077-L1086 VanDerWaalsContact CZ-CD1 3.43Å; I1084-L1086 HydrophobicContact CD1-CD2 4.01Å; L1086-T1090 HydrophobicContact CB-CG2 3.83Å; L1086-T1090 HydrophobicContact CD1-CG2 4.38Å; L1086-T1090 HydrophobicContact CD2-CG2 4.37Å; L1086-T1090 HydrophobicContact CG-CG2 4.41Å; L1086-N1092 HydrophobicContact CD1-CB 3.93Å; L1086-R1093 HydrophobicContact CB-CB 4.22Å; L1086-R1093 VanDerWaalsContact O-CD 3.27Å; L1086-R1093 WeakPolarHBondContact O-CD 3.32Å; L1086-R1093 PolarHBondContact O-NH1 3.45Å; L1086-L1103 HydrophobicContact CD1-CD1 4.18Å; L1086-V1117 HydrophobicContact CD2-CB 3.98Å; L1086-V1117 HydrophobicContact CD2-CG1 4.08Å
1087	H	88.7	Confident	84.7	Confident	31 Å²	31	55.5 Å²	55.5	14%	0.144	28%	0.281	C	S	.	.			trans	-76.2	156.8	174.7	-174.2	-124.5	0	0	0	110.5	R947 S1089 T1090 F1116 V1117 R1118	R947-H1087 PolarHBondContact NH2-CE1 3.44Å; R947-H1087 PolarHBondContact NH2-ND1 2.93Å; R947-H1087 VanDerWaalsContact NH2-ND1 3.16Å; R947-H1087 PolarHBondContact NH2-NE2 3.43Å; H1087-S1089 WeakPolarHBondContact ND1-CB 3.2Å; H1087-S1089 PolarHBondContact ND1-OG 2.97Å; H1087-S1089 PolarHBondContact O-N 3.26Å; H1087-T1090 WeakPolarHBondContact O-CG2 3.46Å; H1087-T1090 PolarHBondContact O-N 2.96Å; H1087-F1116 HydrophobicContact CB-CB 4.24Å; H1087-V1117 WeakPolarHBondContact CB-O 3.02Å; H1087-V1117 PolarHBondContact N-O 2.75Å; H1087-R1118 HydrophobicContact CB-CG 4.34Å
1088	K	84.8	Confident	83.9	Confident	123 Å²	123	55.3 Å²	55.3	54%	0.535	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-17.3	179.6	-59.5	179	-179.3	175.4	0	114.1	T1090	K1088-T1090 VanDerWaalsContact C-N 3.33Å
1089	S	85	Confident	83.3	Confident	19 Å²	19	58.4 Å²	58.4	13%	0.133	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-13	-179.4	61.1	0	0	0	0	115.1	H1087 R1118	H1087-S1089 WeakPolarHBondContact ND1-CB 3.2Å; H1087-S1089 PolarHBondContact ND1-OG 2.97Å; H1087-S1089 PolarHBondContact O-N 3.26Å; S1089-R1118 PolarHBondContact OG-O 3.27Å
1090	T	91.5	Very high	83	Confident	3 Å²	3	58.4 Å²	58.4	2%	0.018	29%	0.293	C	S	.	.	S	Bend	trans	-96.5	133	176.4	174	0	0	0	0	109.7	D964 L1086 H1087 K1088 N1092 R1093 S1120	D964-T1090 WeakPolarHBondContact OD2-CA 3.49Å; D964-T1090 WeakPolarHBondContact OD2-CB 3.34Å; D964-T1090 PolarHBondContact OD2-OG1 3.25Å; L1086-T1090 HydrophobicContact CB-CG2 3.83Å; L1086-T1090 HydrophobicContact CD1-CG2 4.38Å; L1086-T1090 HydrophobicContact CD2-CG2 4.37Å; L1086-T1090 HydrophobicContact CG-CG2 4.41Å; H1087-T1090 WeakPolarHBondContact O-CG2 3.46Å; H1087-T1090 PolarHBondContact O-N 2.96Å; K1088-T1090 VanDerWaalsContact C-N 3.33Å; T1090-N1092 PolarHBondContact O-N 3.17Å; T1090-N1092 PolarHBondContact OG1-N 2.95Å; T1090-R1093 HydrophobicContact CG2-CB 4.46Å; T1090-R1093 WeakPolarHBondContact O-CB 3.44Å; T1090-R1093 PolarHBondContact O-N 3.4Å; T1090-R1093 VanDerWaalsContact O-N 3.09Å; T1090-S1120 PolarHBondContact OG1-OG 3.48Å
1091	I	89.8	Confident	83.1	Confident	32 Å²	32	55.4 Å²	55.4	16%	0.164	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-58.4	-23.4	179.5	62.9	-179	0	0	0	113.3	K954 A955 S958 D964 R1093	K954-I1091 HydrophobicContact CB-CG2 3.75Å; A955-I1091 HydrophobicContact CB-CG2 4.37Å; S958-I1091 WeakPolarHBondContact OG-CD1 3.38Å; D964-I1091 WeakPolarHBondContact OD1-CG1 3.34Å; D964-I1091 WeakPolarHBondContact OD1-CG2 3.49Å; D964-I1091 PolarHBondContact OD1-N 2.9Å; I1091-R1093 VanDerWaalsContact C-N 3.28Å; I1091-R1093 PolarHBondContact O-N 2.67Å
1092	N	91.3	Very high	83.6	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.016	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-79.4	-5.7	-178.6	-70.2	-50.2	0	0	0	113.4	G962 L1086 T1090 S1120 Q1122	G962-N1092 PolarHBondContact O-ND2 2.74Å; G962-N1092 PolarHBondContact O-OD1 3.49Å; L1086-N1092 HydrophobicContact CD1-CB 3.93Å; T1090-N1092 PolarHBondContact O-N 3.17Å; T1090-N1092 PolarHBondContact OG1-N 2.95Å; N1092-S1120 WeakPolarHBondContact CB-OG 3.26Å; N1092-S1120 PolarHBondContact ND2-OG 3.45Å; N1092-Q1122 PolarHBondContact OD1-NE2 3.01Å
1093	R	86.9	Confident	84.1	Confident	68 Å²	68	50.2 Å²	50.2	26%	0.257	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-63.7	-42.3	177.1	175.9	58.4	177.3	-163.7	17.7	112.6	E227 L1086 T1090 I1091	E227-R1093 VanDerWaalsContact CD-NH2 3.31Å; E227-R1093 IonicContact OE1-NH2 2.9Å; E227-R1093 PolarHBondContact OE1-NH2 3.37Å; E227-R1093 VanDerWaalsContact OE1-NH2 3.17Å; E227-R1093 IonicContact OE2-CZ 2.68Å; E227-R1093 IonicContact OE2-NH1 3.27Å; E227-R1093 IonicContact OE2-NH2 3.82Å; E227-R1093 PolarHBondContact OE2-NH2 2.91Å; L1086-R1093 HydrophobicContact CB-CB 4.22Å; L1086-R1093 VanDerWaalsContact O-CD 3.27Å; L1086-R1093 WeakPolarHBondContact O-CD 3.32Å; L1086-R1093 PolarHBondContact O-NH1 3.45Å; T1090-R1093 HydrophobicContact CG2-CB 4.46Å; T1090-R1093 WeakPolarHBondContact O-CB 3.44Å; T1090-R1093 PolarHBondContact O-N 3.4Å; T1090-R1093 VanDerWaalsContact O-N 3.09Å; I1091-R1093 VanDerWaalsContact C-N 3.28Å; I1091-R1093 PolarHBondContact O-N 2.67Å
1094	E	74.4	Confident	84.6	Confident	173 Å²	173	47.5 Å²	47.5	81%	0.808	22%	0.223	S	C	*	.	S	Bend	trans	-102.4	7.2	-177.5	-62.1	-172.4	171.2	0	0	113	T1096	E1094-T1096 PolarHBondContact O-N 3.25Å
1095	A	70.7	Confident	84.9	Confident	37 Å²	37	47.9 Å²	47.9	31%	0.306	22%	0.224	S	C	.	.			trans	-63.9	111	-177.4	0	0	0	0	0	111.3	R1097 L1098	A1095-R1097 VanDerWaalsContact C-N 3.28Å; A1095-R1097 PolarHBondContact O-N 2.86Å; A1095-L1098 HydrophobicContact CB-CD2 3.74Å; A1095-L1098 HydrophobicContact CB-CG 4.48Å
1096	T	65.4	Low	85.1	Confident	128 Å²	128	48.1 Å²	48.1	79%	0.785	22%	0.224	S	C	*	.	S	Bend	trans	-74.7	-18.7	177.4	59.3	0	0	0	0	113.3	E1094	E1094-T1096 PolarHBondContact O-N 3.25Å
1097	R	69.2	Low	85	Confident	160 Å²	160	51.2 Å²	51.2	60%	0.604	24%	0.24	S	C	*	.			trans	-136.1	116.4	177	-64.7	-173.3	-169.9	-164.9	3.1	109.4	A1095 R1218	A1095-R1097 VanDerWaalsContact C-N 3.28Å; A1095-R1097 PolarHBondContact O-N 2.86Å; R1097-R1218 VanDerWaalsContact NE-NH2 3.17Å
1098	L	75.6	Confident	85	Confident	15 Å²	15	50.5 Å²	50.5	8%	0.079	24%	0.239	C	C	.	.			trans	-100.7	122.1	172	-63.6	170	0	0	0	108	V1059 A1095 S1100 Q1122	V1059-L1098 HydrophobicContact CB-CD1 4.39Å; V1059-L1098 HydrophobicContact CG1-CD1 3.58Å; V1059-L1098 HydrophobicContact CG2-CD1 4.08Å; A1095-L1098 HydrophobicContact CB-CD2 3.74Å; A1095-L1098 HydrophobicContact CB-CG 4.48Å; L1098-S1100 PolarHBondContact O-N 3.37Å; L1098-Q1122 HydrophobicContact CD2-CG 4.35Å; L1098-Q1122 VanDerWaalsContact CD2-NE2 3.33Å
1099	R	76.1	Confident	84.9	Confident	127 Å²	127	46.1 Å²	46.1	48%	0.479	22%	0.222	S	C	.	.	S	Bend	trans	-71.2	-22.5	177.3	-67.9	-178.8	170.1	-173.9	-4.2	112.1	D960	D960-R1099 VanDerWaalsContact CB-CZ 3.42Å; D960-R1099 VanDerWaalsContact O-CZ 3.26Å; D960-R1099 PolarHBondContact O-NE 3.12Å; D960-R1099 PolarHBondContact O-NH1 3.46Å; D960-R1099 IonicContact OD2-NH2 3.79Å; D960-R1099 PolarHBondContact OD2-NH2 3.2Å
1100	S	83.8	Confident	84.6	Confident	4 Å²	4	48 Å²	48	3%	0.028	23%	0.228	C	C	.	.			trans	-134.4	147.4	176	179.1	0	0	0	0	110.9	L1098 W1102 V1123	L1098-S1100 PolarHBondContact O-N 3.37Å; S1100-W1102 PolarHBondContact O-N 3.26Å; S1100-W1102 PolarHBondContact OG-N 3.06Å; S1100-W1102 VanDerWaalsContact OG-N 3.1Å; S1100-V1123 VanDerWaalsContact CB-O 3.28Å; S1100-V1123 WeakPolarHBondContact CB-O 3.3Å; S1100-V1123 PolarHBondContact OG-O 2.92Å
1101	R	86.6	Confident	83.7	Confident	33 Å²	33	50.1 Å²	50.1	13%	0.125	24%	0.243	C	C	.	.	S	Bend	trans	-79.4	-3.6	171.6	-62.9	-175.7	178.2	-169.4	-2.9	113.1	V1059 M1217 T1220	V1059-R1101 WeakPolarHBondContact CB-O 3.44Å; V1059-R1101 VanDerWaalsContact CG2-O 3.32Å; V1059-R1101 WeakPolarHBondContact CG2-O 3.5Å; V1059-R1101 PolarHBondContact N-O 3.39Å; R1101-M1217 HydrophobicContact CG-CE 4.16Å; R1101-M1217 HydrophobicContact CG-CG 3.91Å; R1101-M1217 HydrophobicContact CG-SD 3.97Å; R1101-M1217 PolarHBondContact NE-SD 3Å; R1101-M1217 VanDerWaalsContact NE-SD 3.38Å; R1101-T1220 PolarHBondContact NH2-OG1 3.42Å
1102	W	93.3	Very high	82.8	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.015	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	130.2	-176.4	-62.6	-85.7	0	0	0	111.1	C375 L1056 I1057 S1100 V1123 P1125 V1128 L1154 L1155 L1157	C375-W1102 HydrophobicContact CB-CH2 4.16Å; L1056-W1102 HydrophobicContact CD1-CB 4.17Å; I1057-W1102 VanDerWaalsContact O-CA 3.3Å; I1057-W1102 WeakPolarHBondContact O-CA 3.41Å; S1100-W1102 PolarHBondContact O-N 3.26Å; S1100-W1102 PolarHBondContact OG-N 3.06Å; S1100-W1102 VanDerWaalsContact OG-N 3.1Å; W1102-V1123 PolarHBondContact O-N 3.36Å; W1102-P1125 HydrophobicContact CE3-CB 3.77Å; W1102-P1125 HydrophobicContact CE3-CG 4.27Å; W1102-P1125 HydrophobicContact CH2-CB 4.13Å; W1102-P1125 HydrophobicContact CZ3-CB 3.51Å; W1102-P1125 HydrophobicContact CZ3-CG 3.91Å; W1102-V1128 HydrophobicContact CB-CG2 4.21Å; W1102-V1128 HydrophobicContact CG-CG2 4.46Å; W1102-L1154 PolarHBondContact NE1-O 3.17Å; W1102-L1155 HydrophobicContact CD2-CD1 4.14Å; W1102-L1155 VanDerWaalsContact CE2-CD1 3.43Å; W1102-L1155 HydrophobicContact CH2-CD1 3.97Å; W1102-L1155 HydrophobicContact CZ2-CD1 3.34Å; W1102-L1157 HydrophobicContact CH2-CD2 4.26Å
1103	L	95.5	Very high	81.8	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	150.1	172.9	-51.4	160.4	0	0	0	109.6	I1057 V1059 Y1077 L1086 S1121 Q1122	I1057-L1103 HydrophobicContact CB-CB 4.05Å; I1057-L1103 HydrophobicContact CD1-CB 4.17Å; I1057-L1103 HydrophobicContact CD1-CD1 4.47Å; I1057-L1103 HydrophobicContact CG2-CD1 4.29Å; I1057-L1103 PolarHBondContact N-O 3.44Å; I1057-L1103 PolarHBondContact O-N 3.42Å; V1059-L1103 HydrophobicContact CG2-CD1 3.94Å; V1059-L1103 HydrophobicContact CG2-CG 4.14Å; Y1077-L1103 HydrophobicContact CD1-CD1 4.12Å; Y1077-L1103 HydrophobicContact CE1-CD1 4.03Å; L1086-L1103 HydrophobicContact CD1-CD1 4.18Å; L1103-S1121 CarbonylContact C-O 3.43Å; L1103-S1121 WeakPolarHBondContact CA-O 3.12Å; L1103-Q1122 HydrophobicContact CD2-CB 4.15Å; L1103-Q1122 HydrophobicContact CD2-CG 3.35Å
1104	T	96.6	Very high	81.4	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	154.4	165	-168	0	0	0	0	110.3	M1049 N1055 S1120 S1121 V1123	M1049-T1104 WeakPolarHBondContact CA-OG1 3.35Å; M1049-T1104 HydrophobicContact CB-CG2 3.92Å; N1055-T1104 WeakPolarHBondContact O-CA 3.32Å; N1055-T1104 PolarHBondContact O-OG1 2.83Å; T1104-S1120 CarbonylContact O-C 3.5Å; T1104-S1120 VanDerWaalsContact O-CA 3.25Å; T1104-S1120 WeakPolarHBondContact O-CA 3.47Å; T1104-S1121 PolarHBondContact N-O 3.46Å; T1104-S1121 PolarHBondContact O-N 3.2Å; T1104-V1123 HydrophobicContact CG2-CG2 3.66Å
1105	Y	96.3	Very high	82	Confident	17 Å²	17	49.3 Å²	49.3	7%	0.067	27%	0.268	C	S	.	.			trans	-150.5	156.4	179.3	67.6	-81.4	0	0	0	112.4	N1055 I1057 T1079 A1108 V1117 D1119	N1055-Y1105 HydrophobicContact CB-CD1 4.06Å; N1055-Y1105 HydrophobicContact CB-CD2 4.46Å; N1055-Y1105 HydrophobicContact CB-CE1 3.83Å; N1055-Y1105 HydrophobicContact CB-CE2 4.22Å; N1055-Y1105 HydrophobicContact CB-CG 4.38Å; N1055-Y1105 WeakPolarHBondContact CB-O 3.45Å; N1055-Y1105 PolarHBondContact ND2-O 3.18Å; N1055-Y1105 WeakPolarHBondContact O-CD1 3.5Å; N1055-Y1105 PolarHBondContact O-N 3.08Å; I1057-Y1105 HydrophobicContact CD1-CD1 3.42Å; I1057-Y1105 VanDerWaalsContact CD1-CD1 3.42Å; I1057-Y1105 HydrophobicContact CD1-CE1 3.91Å; I1057-Y1105 HydrophobicContact CD1-CG 4.19Å; I1057-Y1105 HydrophobicContact CG1-CD1 3.63Å; I1057-Y1105 HydrophobicContact CG1-CE1 3.65Å; T1079-Y1105 HydrophobicContact CG2-CE1 3.99Å; Y1105-A1108 HydrophobicContact CD2-CB 4.24Å; Y1105-A1108 HydrophobicContact CE2-CB 3.76Å; Y1105-V1117 VanDerWaalsContact CB-CG1 3.44Å; Y1105-V1117 HydrophobicContact CD1-CG1 4.48Å; Y1105-V1117 HydrophobicContact CD1-CG2 4.32Å; Y1105-V1117 HydrophobicContact CD2-CG1 4.03Å; Y1105-V1117 HydrophobicContact CD2-CG2 3.8Å; Y1105-V1117 HydrophobicContact CE1-CG2 4.46Å; Y1105-V1117 HydrophobicContact CE2-CG2 3.99Å; Y1105-V1117 HydrophobicContact CG-CG1 3.74Å; Y1105-V1117 HydrophobicContact CG-CG2 3.98Å; Y1105-D1119 WeakPolarHBondContact CB-O 3.47Å
1106	F	94.6	Very high	82.9	Confident	32 Å²	32	49.8 Å²	49.8	14%	0.14	26%	0.264	C	S	.	.	S	Bend	trans	-105.1	-54.7	172.1	178.9	-117.2	0	0	0	112.1	D909 L912 L935 L1052 D1119	D909-F1106 HydrophobicContact CB-CE2 4.02Å; D909-F1106 HydrophobicContact CB-CZ 3.89Å; L912-F1106 HydrophobicContact CD1-CD1 4.23Å; L912-F1106 HydrophobicContact CD1-CD2 4.34Å; L912-F1106 HydrophobicContact CD1-CE1 3.71Å; L912-F1106 HydrophobicContact CD1-CE2 3.82Å; L912-F1106 HydrophobicContact CD1-CZ 3.48Å; L912-F1106 VanDerWaalsContact CD1-CZ 3.48Å; L912-F1106 HydrophobicContact CD2-CD1 4.35Å; L912-F1106 HydrophobicContact CD2-CD2 3.68Å; L912-F1106 HydrophobicContact CD2-CE2 3.9Å; L912-F1106 HydrophobicContact CD2-CG 3.94Å; L912-F1106 HydrophobicContact CD2-CZ 4.34Å; L912-F1106 HydrophobicContact CG-CD2 3.91Å; L912-F1106 HydrophobicContact CG-CE1 4.33Å; L912-F1106 HydrophobicContact CG-CE2 3.57Å; L912-F1106 HydrophobicContact CG-CG 4.44Å; L912-F1106 HydrophobicContact CG-CZ 3.81Å; L935-F1106 HydrophobicContact CB-CD1 4.2Å; L935-F1106 HydrophobicContact CD1-CB 3.94Å; L935-F1106 HydrophobicContact CD1-CD1 3.97Å; L935-F1106 HydrophobicContact CD1-CG 4.09Å; L935-F1106 HydrophobicContact CD2-CB 4.41Å; L935-F1106 HydrophobicContact CD2-CD1 4.24Å; L935-F1106 HydrophobicContact CG-CD1 4.37Å; L1052-F1106 HydrophobicContact CD1-CB 4.18Å; L1052-F1106 HydrophobicContact CD2-CB 4.11Å; L1052-F1106 HydrophobicContact CD2-CD2 3.65Å; L1052-F1106 HydrophobicContact CD2-CG 4.29Å; F1106-D1119 PolarHBondContact N-OD2 3.4Å
1107	M	88.9	Confident	84.1	Confident	67 Å²	67	43.7 Å²	43.7	33%	0.33	23%	0.226	S	C	.	.			trans	-93.8	123	-174.3	-55.7	-178.5	-76.2	0	0	112.3	L935 V1117 R1118 D1119	L935-M1107 HydrophobicContact CD2-CE 4.2Å; M1107-V1117 WeakPolarHBondContact O-CA 3.22Å; M1107-R1118 HydrophobicContact CB-CB 4.2Å; M1107-R1118 HydrophobicContact CE-CB 4.24Å; M1107-R1118 PolarHBondContact O-N 3.3Å; M1107-D1119 WeakPolarHBondContact CA-OD1 3.38Å; M1107-D1119 WeakPolarHBondContact CB-OD1 3.33Å; M1107-D1119 HydrophobicContact CE-CB 4.32Å; M1107-D1119 VanDerWaalsContact CE-OD1 3.26Å; M1107-D1119 WeakPolarHBondContact CE-OD1 3.35Å; M1107-D1119 WeakPolarHBondContact CG-OD1 3.48Å; M1107-D1119 PolarHBondContact N-OD1 2.91Å
1108	A	88.4	Confident	85.1	Confident	16 Å²	16	41.4 Å²	41.4	13%	0.132	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	138.6	166.5	0	0	0	0	0	110.3	V792 Y1105 V1115 F1116 V1117	V792-A1108 HydrophobicContact CG1-CB 3.76Å; Y1105-A1108 HydrophobicContact CD2-CB 4.24Å; Y1105-A1108 HydrophobicContact CE2-CB 3.76Å; A1108-V1115 HydrophobicContact CB-CG1 4.03Å; A1108-F1116 CarbonylContact C-O 3.51Å; A1108-F1116 VanDerWaalsContact CA-O 3.3Å; A1108-F1116 WeakPolarHBondContact CA-O 3.45Å; A1108-V1117 HydrophobicContact CB-CG2 4.21Å
1109	V	83.5	Confident	85.9	Confident	30 Å²	30	40.8 Å²	40.8	18%	0.182	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	137.1	-177.5	-179.7	0	0	0	0	109.4	S793 F1116	S793-V1109 WeakPolarHBondContact O-CA 3.21Å; V1109-F1116 PolarHBondContact N-O 3.34Å; V1109-F1116 PolarHBondContact O-N 3.3Å
1110	K	79.5	Confident	86.9	Confident	60 Å²	60	34.8 Å²	34.8	26%	0.261	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	128.3	172.1	-164.2	178.1	-174	-177.3	0	110.5	D787 T790 V792 C794 S1114 V1115	D787-K1110 IonicContact OD2-NZ 2.88Å; D787-K1110 PolarHBondContact OD2-NZ 2.94Å; T790-K1110 HydrophobicContact CG2-CD 4.31Å; V792-K1110 HydrophobicContact CG2-CB 3.78Å; C794-K1110 WeakPolarHBondContact CB-O 3.5Å; K1110-S1114 WeakPolarHBondContact CA-O 3.31Å; K1110-V1115 HydrophobicContact CG-CG2 4.47Å
1111	S	72.6	Confident	87.4	Confident	46 Å²	46	34.6 Å²	34.6	32%	0.322	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	136	172	-172.8	0	0	0	0	109.4	G1113 S1114	S1111-G1113 PolarHBondContact O-N 3.13Å; S1111-S1114 PolarHBondContact N-O 2.94Å; S1111-S1114 PolarHBondContact O-N 2.98Å; S1111-S1114 VanDerWaalsContact O-O 3.08Å
1112	N	70.8	Confident	87.8	Confident	131 Å²	131	33.4 Å²	33.4	70%	0.701	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.8	37.4	177.3	-61.2	-14.8	0	0	0	114.4	S1114	N1112-S1114 VanDerWaalsContact C-N 3.32Å; N1112-S1114 PolarHBondContact O-N 3.4Å
1113	G	70.1	Confident	87.8	Confident	61 Å²	61	33.2 Å²	33.2	63%	0.629	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.8	-9.8	179.3	0	0	0	0	0	116	S1111	S1111-G1113 PolarHBondContact O-N 3.13Å
1114	S	78.4	Confident	87.7	Confident	46 Å²	46	33.5 Å²	33.5	32%	0.322	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	149.1	179.9	-67.3	0	0	0	0	111.9	K1110 S1111 N1112	K1110-S1114 WeakPolarHBondContact CA-O 3.31Å; S1111-S1114 PolarHBondContact N-O 2.94Å; S1111-S1114 PolarHBondContact O-N 2.98Å; S1111-S1114 VanDerWaalsContact O-O 3.08Å; N1112-S1114 VanDerWaalsContact C-N 3.32Å; N1112-S1114 PolarHBondContact O-N 3.4Å
1115	V	86.1	Confident	87.4	Confident	22 Å²	22	33.5 Å²	33.5	13%	0.133	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	124.3	177.1	179.5	0	0	0	0	109.8	T790 V792 I1084 L1085 A1108 K1110	T790-V1115 HydrophobicContact CG2-CG2 4.34Å; V792-V1115 HydrophobicContact CG1-CG1 4.06Å; V792-V1115 HydrophobicContact CG2-CG1 4.49Å; V792-V1115 HydrophobicContact CG2-CG2 4.14Å; I1084-V1115 HydrophobicContact CB-CB 4.5Å; I1084-V1115 HydrophobicContact CB-CG1 4.48Å; I1084-V1115 HydrophobicContact CG2-CB 4.03Å; I1084-V1115 HydrophobicContact CG2-CG1 3.92Å; L1085-V1115 PolarHBondContact N-O 3.37Å; A1108-V1115 HydrophobicContact CB-CG1 4.03Å; K1110-V1115 HydrophobicContact CG-CG2 4.47Å
1116	F	89.4	Confident	87.2	Confident	47 Å²	47	33 Å²	33	21%	0.206	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	125.5	-178.5	-66.8	-86.5	0	0	0	111.6	L1085 H1087 A1108 V1109	L1085-F1116 HydrophobicContact CB-CD1 3.8Å; L1085-F1116 HydrophobicContact CB-CE1 3.85Å; L1085-F1116 HydrophobicContact CD1-CE1 3.75Å; L1085-F1116 HydrophobicContact CD1-CZ 4.02Å; L1085-F1116 HydrophobicContact CG-CE1 4.45Å; L1085-F1116 CarbonylContact O-C 3.51Å; L1085-F1116 VanDerWaalsContact O-CA 3.25Å; L1085-F1116 WeakPolarHBondContact O-CA 3.12Å; H1087-F1116 HydrophobicContact CB-CB 4.24Å; A1108-F1116 CarbonylContact C-O 3.51Å; A1108-F1116 VanDerWaalsContact CA-O 3.3Å; A1108-F1116 WeakPolarHBondContact CA-O 3.45Å; V1109-F1116 PolarHBondContact N-O 3.34Å; V1109-F1116 PolarHBondContact O-N 3.3Å
1117	V	91.8	Very high	87.2	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	124.5	174	168.4	0	0	0	0	109.8	I1057 I1084 L1085 L1086 H1087 Y1105 M1107 A1108 D1119	I1057-V1117 HydrophobicContact CD1-CG1 4.34Å; I1057-V1117 HydrophobicContact CD1-CG2 4.27Å; I1084-V1117 HydrophobicContact CB-CG2 4.46Å; I1084-V1117 HydrophobicContact CD1-CB 4.14Å; I1084-V1117 HydrophobicContact CD1-CG2 3.61Å; I1084-V1117 HydrophobicContact CG1-CG2 4.08Å; L1085-V1117 PolarHBondContact O-N 3.29Å; L1086-V1117 HydrophobicContact CD2-CB 3.98Å; L1086-V1117 HydrophobicContact CD2-CG1 4.08Å; H1087-V1117 WeakPolarHBondContact CB-O 3.02Å; H1087-V1117 PolarHBondContact N-O 2.75Å; Y1105-V1117 VanDerWaalsContact CB-CG1 3.44Å; Y1105-V1117 HydrophobicContact CD1-CG1 4.48Å; Y1105-V1117 HydrophobicContact CD1-CG2 4.32Å; Y1105-V1117 HydrophobicContact CD2-CG1 4.03Å; Y1105-V1117 HydrophobicContact CD2-CG2 3.8Å; Y1105-V1117 HydrophobicContact CE1-CG2 4.46Å; Y1105-V1117 HydrophobicContact CE2-CG2 3.99Å; Y1105-V1117 HydrophobicContact CG-CG1 3.74Å; Y1105-V1117 HydrophobicContact CG-CG2 3.98Å; M1107-V1117 WeakPolarHBondContact O-CA 3.22Å; A1108-V1117 HydrophobicContact CB-CG2 4.21Å; V1117-D1119 WeakPolarHBondContact CG1-O 3.47Å
1118	R	89	Confident	87.4	Confident	111 Å²	111	28.3 Å²	28.3	42%	0.419	16%	0.163	S	C	.	.			trans	-91.6	-29.6	-172.4	-72	-168.5	167.8	178.3	-0.3	114.8	H1087 S1089 M1107	H1087-R1118 HydrophobicContact CB-CG 4.34Å; S1089-R1118 PolarHBondContact OG-O 3.27Å; M1107-R1118 HydrophobicContact CB-CB 4.2Å; M1107-R1118 HydrophobicContact CE-CB 4.24Å; M1107-R1118 PolarHBondContact O-N 3.3Å
1119	D	93.2	Very high	87.7	Confident	3 Å²	3	27.6 Å²	27.6	2%	0.016	16%	0.157	C	C	.	.			trans	-129.3	145.4	177.8	58.7	-82.9	0	0	0	109.5	L935 H965 Y1105 F1106 M1107 V1117	L935-D1119 HydrophobicContact CD2-CB 4.42Å; H965-D1119 IonicContact CE1-OD2 3.82Å; H965-D1119 PolarHBondContact CE1-OD2 3.39Å; H965-D1119 IonicContact NE2-OD2 3.38Å; H965-D1119 PolarHBondContact NE2-OD2 2.87Å; H965-D1119 VanDerWaalsContact NE2-OD2 3.12Å; Y1105-D1119 WeakPolarHBondContact CB-O 3.47Å; F1106-D1119 PolarHBondContact N-OD2 3.4Å; M1107-D1119 WeakPolarHBondContact CA-OD1 3.38Å; M1107-D1119 WeakPolarHBondContact CB-OD1 3.33Å; M1107-D1119 HydrophobicContact CE-CB 4.32Å; M1107-D1119 VanDerWaalsContact CE-OD1 3.26Å; M1107-D1119 WeakPolarHBondContact CE-OD1 3.35Å; M1107-D1119 WeakPolarHBondContact CG-OD1 3.48Å; M1107-D1119 PolarHBondContact N-OD1 2.91Å; V1117-D1119 WeakPolarHBondContact CG1-O 3.47Å
1120	S	95.8	Very high	88.2	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.149	C	C	.	.			trans	-152.9	160.5	175.6	72	0	0	0	0	113.5	D964 T1090 N1092 T1104	D964-S1120 PolarHBondContact N-O 2.74Å; D964-S1120 PolarHBondContact OD2-N 3.43Å; T1090-S1120 PolarHBondContact OG1-OG 3.48Å; N1092-S1120 WeakPolarHBondContact CB-OG 3.26Å; N1092-S1120 PolarHBondContact ND2-OG 3.45Å; T1104-S1120 CarbonylContact O-C 3.5Å; T1104-S1120 VanDerWaalsContact O-CA 3.25Å; T1104-S1120 WeakPolarHBondContact O-CA 3.47Å
1121	S	96.1	Very high	89	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	133.9	171.7	-68.8	0	0	0	0	112.4	G962 S963 H965 L1103 T1104 V1123	G962-S1121 WeakPolarHBondContact O-CA 3.25Å; S963-S1121 WeakPolarHBondContact CA-OG 3.2Å; S963-S1121 VanDerWaalsContact CB-OG 3.32Å; S963-S1121 WeakPolarHBondContact CB-OG 3.35Å; S963-S1121 WeakPolarHBondContact OG-CB 3.49Å; S963-S1121 PolarHBondContact OG-OG 2.96Å; H965-S1121 PolarHBondContact ND1-OG 3.07Å; L1103-S1121 CarbonylContact C-O 3.43Å; L1103-S1121 WeakPolarHBondContact CA-O 3.12Å; T1104-S1121 PolarHBondContact N-O 3.46Å; T1104-S1121 PolarHBondContact O-N 3.2Å; S1121-V1123 WeakPolarHBondContact O-CG2 3.5Å; S1121-V1123 PolarHBondContact O-N 3.32Å
1122	Q	94.2	Very high	89.8	Confident	8 Å²	8	21.8 Å²	21.8	4%	0.037	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	123.9	172.8	-68	178.9	46.9	0	0	111	G962 K1045 N1092 L1098 L1103	G962-Q1122 PolarHBondContact O-N 2.87Å; K1045-Q1122 VanDerWaalsContact CD-O 3.23Å; K1045-Q1122 WeakPolarHBondContact CD-O 3.19Å; K1045-Q1122 VanDerWaalsContact CE-O 3.31Å; K1045-Q1122 WeakPolarHBondContact CE-O 3.23Å; K1045-Q1122 PolarHBondContact NZ-O 3.46Å; N1092-Q1122 PolarHBondContact OD1-NE2 3.01Å; L1098-Q1122 HydrophobicContact CD2-CG 4.35Å; L1098-Q1122 VanDerWaalsContact CD2-NE2 3.33Å; L1103-Q1122 HydrophobicContact CD2-CB 4.15Å; L1103-Q1122 HydrophobicContact CD2-CG 3.35Å
1123	V	93.8	Very high	90.4	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.113	C	C	.	.			trans	-114.4	135.7	-174.6	-173.5	0	0	0	0	110.1	M1049 S1100 W1102 T1104 S1121 A1127 V1128	M1049-V1123 HydrophobicContact CB-CG1 4Å; M1049-V1123 HydrophobicContact CB-CG2 3.85Å; M1049-V1123 HydrophobicContact CE-CG1 4.38Å; M1049-V1123 HydrophobicContact CG-CG1 4.11Å; M1049-V1123 HydrophobicContact CG-CG2 4.06Å; S1100-V1123 VanDerWaalsContact CB-O 3.28Å; S1100-V1123 WeakPolarHBondContact CB-O 3.3Å; S1100-V1123 PolarHBondContact OG-O 2.92Å; W1102-V1123 PolarHBondContact O-N 3.36Å; T1104-V1123 HydrophobicContact CG2-CG2 3.66Å; S1121-V1123 WeakPolarHBondContact O-CG2 3.5Å; S1121-V1123 PolarHBondContact O-N 3.32Å; V1123-A1127 HydrophobicContact CG1-CB 4.06Å; V1123-V1128 HydrophobicContact CB-CG2 4.23Å; V1123-V1128 HydrophobicContact CG1-CG2 3.78Å
1124	H	92	Very high	91	Very high	6 Å²	6	17.4 Å²	17.4	3%	0.028	9%	0.09	C	C	.	.			trans	-60.6	133.6	174.3	-166.5	-81.8	0	0	0	111.8	L1126 A1127 V1128 L1208 C1212	H1124-L1126 VanDerWaalsContact C-N 3.3Å; H1124-L1126 WeakPolarHBondContact ND1-CB 3.45Å; H1124-L1126 PolarHBondContact ND1-N 2.74Å; H1124-L1126 PolarHBondContact O-N 3.13Å; H1124-A1127 HydrophobicContact CB-CB 4.2Å; H1124-A1127 WeakPolarHBondContact O-CA 3.28Å; H1124-A1127 WeakPolarHBondContact O-CB 3.47Å; H1124-A1127 PolarHBondContact O-N 2.98Å; H1124-V1128 PolarHBondContact O-N 3.28Å; H1124-V1128 VanDerWaalsContact O-N 3.15Å; H1124-L1208 HydrophobicContact CB-CD2 4.23Å; H1124-C1212 PolarHBondContact CD2-SG 3.26Å
1125	P	90.9	Very high	91.3	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-57.5	-38.1	-178.8	15.1	-26.9	0	0	0	114.1	W1102 A1127 V1128 L1129 L1155 L1157 F1215	W1102-P1125 HydrophobicContact CE3-CB 3.77Å; W1102-P1125 HydrophobicContact CE3-CG 4.27Å; W1102-P1125 HydrophobicContact CH2-CB 4.13Å; W1102-P1125 HydrophobicContact CZ3-CB 3.51Å; W1102-P1125 HydrophobicContact CZ3-CG 3.91Å; P1125-A1127 VanDerWaalsContact C-N 3.29Å; P1125-A1127 PolarHBondContact O-N 2.67Å; P1125-V1128 WeakPolarHBondContact O-CB 3.41Å; P1125-V1128 PolarHBondContact O-N 2.85Å; P1125-L1129 PolarHBondContact O-N 2.6Å; P1125-L1155 HydrophobicContact CB-CD1 4.5Å; P1125-L1157 HydrophobicContact CB-CD1 4.48Å; P1125-L1157 HydrophobicContact CB-CD2 4.21Å; P1125-F1215 HydrophobicContact CB-CD1 4.35Å; P1125-F1215 HydrophobicContact CB-CE1 4.3Å; P1125-F1215 HydrophobicContact CG-CB 4.4Å; P1125-F1215 HydrophobicContact CG-CD1 3.56Å; P1125-F1215 HydrophobicContact CG-CD2 3.75Å; P1125-F1215 HydrophobicContact CG-CE1 3.68Å; P1125-F1215 HydrophobicContact CG-CE2 3.84Å; P1125-F1215 HydrophobicContact CG-CG 3.63Å; P1125-F1215 HydrophobicContact CG-CZ 3.83Å
1126	L	92.6	Very high	91.5	Very high	7 Å²	7	21.1 Å²	21.1	4%	0.037	11%	0.107	C	C	.	.	H	α-helix	trans	-65.7	-31.6	174.4	-63.1	177.2	0	0	0	112.3	I377 V379 H1124 V1128 L1129 L1130 L1167 L1207 L1208	I377-L1126 HydrophobicContact CG2-CD2 4.3Å; V379-L1126 HydrophobicContact CG2-CD1 4.41Å; H1124-L1126 VanDerWaalsContact C-N 3.3Å; H1124-L1126 WeakPolarHBondContact ND1-CB 3.45Å; H1124-L1126 PolarHBondContact ND1-N 2.74Å; H1124-L1126 PolarHBondContact O-N 3.13Å; L1126-V1128 VanDerWaalsContact C-N 3.34Å; L1126-L1129 HydrophobicContact CD2-CD2 4.49Å; L1126-L1129 PolarHBondContact O-N 2.83Å; L1126-L1130 HydrophobicContact CB-CD1 4.33Å; L1126-L1130 WeakPolarHBondContact O-CB 3.46Å; L1126-L1130 WeakPolarHBondContact O-CG 3.31Å; L1126-L1130 PolarHBondContact O-N 3.28Å; L1126-L1167 HydrophobicContact CD2-CD1 3.98Å; L1126-L1207 HydrophobicContact CD1-CD1 3.8Å; L1126-L1207 HydrophobicContact CD1-CD2 4.25Å; L1126-L1207 HydrophobicContact CD1-CG 3.81Å; L1126-L1208 HydrophobicContact CB-CD2 4.08Å
1127	A	94.4	Very high	91.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-67.2	-39.3	173.5	0	0	0	0	0	110.9	M1049 V1123 H1124 P1125 L1130 L1131 L1208	M1049-A1127 WeakPolarHBondContact CE-O 3.44Å; V1123-A1127 HydrophobicContact CG1-CB 4.06Å; H1124-A1127 HydrophobicContact CB-CB 4.2Å; H1124-A1127 WeakPolarHBondContact O-CA 3.28Å; H1124-A1127 WeakPolarHBondContact O-CB 3.47Å; H1124-A1127 PolarHBondContact O-N 2.98Å; P1125-A1127 VanDerWaalsContact C-N 3.29Å; P1125-A1127 PolarHBondContact O-N 2.67Å; A1127-L1130 PolarHBondContact O-N 3.17Å; A1127-L1131 HydrophobicContact CB-CD1 4.15Å; A1127-L1131 VanDerWaalsContact O-CB 3.3Å; A1127-L1131 WeakPolarHBondContact O-CB 3.35Å; A1127-L1131 PolarHBondContact O-N 3.45Å; A1127-L1208 HydrophobicContact CB-CD1 4.3Å; A1127-L1208 HydrophobicContact CB-CD2 3.88Å
1128	V	93.3	Very high	91.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.5	-44.6	172.2	-169.6	0	0	0	0	111.2	M1049 L1056 W1102 V1123 H1124 P1125 L1126 T1132 L1149 L1155	M1049-V1128 VanDerWaalsContact CE-CA 3.48Å; M1049-V1128 HydrophobicContact CE-CB 4.29Å; M1049-V1128 HydrophobicContact CE-CG2 4.25Å; M1049-V1128 HydrophobicContact SD-CG1 4.33Å; M1049-V1128 HydrophobicContact SD-CG2 4.44Å; L1056-V1128 HydrophobicContact CD1-CG1 4.06Å; L1056-V1128 HydrophobicContact CD1-CG2 4.12Å; L1056-V1128 HydrophobicContact CD2-CG1 3.71Å; W1102-V1128 HydrophobicContact CB-CG2 4.21Å; W1102-V1128 HydrophobicContact CG-CG2 4.46Å; V1123-V1128 HydrophobicContact CB-CG2 4.23Å; V1123-V1128 HydrophobicContact CG1-CG2 3.78Å; H1124-V1128 PolarHBondContact O-N 3.28Å; H1124-V1128 VanDerWaalsContact O-N 3.15Å; P1125-V1128 WeakPolarHBondContact O-CB 3.41Å; P1125-V1128 PolarHBondContact O-N 2.85Å; L1126-V1128 VanDerWaalsContact C-N 3.34Å; V1128-T1132 HydrophobicContact CG1-CG2 4.28Å; V1128-T1132 WeakPolarHBondContact O-CB 3.42Å; V1128-T1132 WeakPolarHBondContact O-CG2 3.25Å; V1128-T1132 PolarHBondContact O-OG1 3.01Å; V1128-L1149 HydrophobicContact CG1-CD1 4.29Å; V1128-L1155 HydrophobicContact CB-CD2 3.95Å; V1128-L1155 HydrophobicContact CG1-CD2 3.76Å
1129	L	93.7	Very high	91.4	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-67.8	-39.7	178.5	177.1	63.9	0	0	0	113.2	P1125 L1126 V1136 I1147 L1155 L1157 L1167 R1171	P1125-L1129 PolarHBondContact O-N 2.6Å; L1126-L1129 HydrophobicContact CD2-CD2 4.49Å; L1126-L1129 PolarHBondContact O-N 2.83Å; L1129-V1136 HydrophobicContact CD1-CG1 4.02Å; L1129-I1147 HydrophobicContact CD1-CD1 3.7Å; L1129-I1147 HydrophobicContact CD1-CG1 3.78Å; L1129-I1147 HydrophobicContact CD1-CG2 4.19Å; L1129-I1147 HydrophobicContact CD2-CD1 4.17Å; L1129-I1147 HydrophobicContact CD2-CG2 3.95Å; L1129-I1147 HydrophobicContact CG-CD1 4.46Å; L1129-L1155 HydrophobicContact CB-CD2 4.08Å; L1129-L1157 HydrophobicContact CB-CD1 4.03Å; L1129-L1157 HydrophobicContact CD2-CD1 4.01Å; L1129-L1157 HydrophobicContact CG-CD1 4.5Å; L1129-L1167 HydrophobicContact CD2-CB 4.47Å; L1129-L1167 HydrophobicContact CD2-CD1 4.31Å; L1129-R1171 WeakPolarHBondContact O-CD 3.48Å; L1129-R1171 PolarHBondContact O-NE 3.39Å; L1129-R1171 PolarHBondContact O-NH1 3Å
1130	L	94.8	Very high	91.3	Very high	4 Å²	4	34.9 Å²	34.9	2%	0.021	17%	0.171	C	C	.	.	H	α-helix	trans	-93.2	-30	-166.9	-67.2	173.7	0	0	0	113.6	L1126 A1127 L1167 F1170 R1171 L1174 L1204 L1207	L1126-L1130 HydrophobicContact CB-CD1 4.33Å; L1126-L1130 WeakPolarHBondContact O-CB 3.46Å; L1126-L1130 WeakPolarHBondContact O-CG 3.31Å; L1126-L1130 PolarHBondContact O-N 3.28Å; A1127-L1130 PolarHBondContact O-N 3.17Å; L1130-L1167 HydrophobicContact CD2-CD2 4.44Å; L1130-F1170 HydrophobicContact CD1-CD1 4.03Å; L1130-F1170 HydrophobicContact CD1-CE1 4.18Å; L1130-F1170 HydrophobicContact CD2-CD1 4.05Å; L1130-R1171 HydrophobicContact CD2-CB 3.93Å; L1130-R1171 PolarHBondContact O-NH1 3.37Å; L1130-L1174 HydrophobicContact CB-CD1 4.04Å; L1130-L1204 HydrophobicContact CD1-CD1 3.97Å; L1130-L1207 HydrophobicContact CD1-CD2 3.51Å
1131	L	95.4	Very high	90.8	Very high	7 Å²	7	40.6 Å²	40.6	4%	0.037	20%	0.201	C	C	.	.	H	α-helix	trans	-105.2	-14.8	-170.4	-56.1	178.1	0	0	0	114.8	F922 L1043 G1046 V1047 A1050 A1127 L1174 L1204	F922-L1131 HydrophobicContact CD1-CD2 4.22Å; F922-L1131 HydrophobicContact CE1-CD2 3.39Å; F922-L1131 HydrophobicContact CE2-CD2 4.31Å; F922-L1131 HydrophobicContact CZ-CD2 3.46Å; F922-L1131 VanDerWaalsContact CZ-CD2 3.46Å; L1043-L1131 HydrophobicContact CD1-CD1 4.42Å; G1046-L1131 VanDerWaalsContact C-CD1 3.43Å; V1047-L1131 HydrophobicContact CG2-CD1 4.26Å; A1050-L1131 HydrophobicContact CB-CB 3.85Å; A1050-L1131 VanDerWaalsContact CB-O 3.26Å; A1050-L1131 WeakPolarHBondContact CB-O 3.49Å; A1127-L1131 HydrophobicContact CB-CD1 4.15Å; A1127-L1131 VanDerWaalsContact O-CB 3.3Å; A1127-L1131 WeakPolarHBondContact O-CB 3.35Å; A1127-L1131 PolarHBondContact O-N 3.45Å; L1131-L1174 HydrophobicContact CD2-CD1 4.42Å; L1131-L1204 HydrophobicContact CD2-CD2 3.95Å
1132	T	90.8	Very high	90	Very high	4 Å²	4	43.4 Å²	43.4	3%	0.025	23%	0.23	C	C	.	.			trans	-66.6	154.7	173.8	50	0	0	0	0	110.6	M1049 Y1053 V1128 R1171	M1049-T1132 HydrophobicContact CE-CG2 3.91Å; M1049-T1132 HydrophobicContact SD-CG2 3.66Å; Y1053-T1132 HydrophobicContact CD2-CG2 3.54Å; Y1053-T1132 HydrophobicContact CE2-CG2 3.83Å; Y1053-T1132 HydrophobicContact CG-CG2 4Å; V1128-T1132 HydrophobicContact CG1-CG2 4.28Å; V1128-T1132 WeakPolarHBondContact O-CB 3.42Å; V1128-T1132 WeakPolarHBondContact O-CG2 3.25Å; V1128-T1132 PolarHBondContact O-OG1 3.01Å; T1132-R1171 PolarHBondContact O-NH1 2.64Å; T1132-R1171 PolarHBondContact O-NH2 2.96Å; T1132-R1171 PolarHBondContact OG1-NH2 3.4Å
1133	D	83.2	Confident	89.5	Confident	86 Å²	86	53.5 Å²	53.5	46%	0.46	27%	0.268	S	S	.	.			trans	-92.1	-4	179.5	-56	-31.1	0	0	0	113.1	K914	K914-D1133 WeakPolarHBondContact CE-OD2 3.25Å; K914-D1133 IonicContact NZ-OD2 3.48Å; K914-D1133 PolarHBondContact NZ-OD2 3.22Å
1134	G	81.8	Confident	89.3	Confident	14 Å²	14	60.3 Å²	60.3	14%	0.144	29%	0.294	C	S	.	.	S	Bend	trans	-68.8	149.1	-178.4	0	0	0	0	0	113.2	R1171	G1134-R1171 PolarHBondContact O-NH2 3.14Å
1135	D	84.8	Confident	89.2	Confident	114 Å²	114	60.1 Å²	60.1	61%	0.61	29%	0.293	S	S	*	.			trans	-61.9	158.4	171.9	-74.4	-40.3	0	0	0	111.3	S1150	D1135-S1150 VanDerWaalsContact C-OG 3.24Å; D1135-S1150 WeakPolarHBondContact CB-OG 3.48Å; D1135-S1150 VanDerWaalsContact O-CB 3.31Å; D1135-S1150 WeakPolarHBondContact O-CB 3.43Å; D1135-S1150 PolarHBondContact O-N 3.37Å; D1135-S1150 PolarHBondContact O-OG 2.72Å
1136	V	89.6	Confident	89.2	Confident	32 Å²	32	61.9 Å²	61.9	19%	0.194	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	135.3	177.6	-67.6	0	0	0	0	110.8	L1129 I1147 S1148 L1149 S1150	L1129-V1136 HydrophobicContact CD1-CG1 4.02Å; V1136-I1147 HydrophobicContact CB-CD1 4.23Å; V1136-I1147 HydrophobicContact CB-CG1 4.09Å; V1136-I1147 HydrophobicContact CG1-CG1 4.48Å; V1136-I1147 HydrophobicContact CG2-CD1 4.2Å; V1136-S1148 CarbonylContact C-O 3.59Å; V1136-S1148 VanDerWaalsContact CA-O 3.28Å; V1136-S1148 WeakPolarHBondContact CA-O 3.26Å; V1136-L1149 HydrophobicContact CG1-CD2 4.16Å; V1136-S1150 PolarHBondContact N-OG 3.13Å
1137	H	89.8	Confident	89.1	Confident	111 Å²	111	61.6 Å²	61.6	51%	0.514	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	134.1	170.7	-68.7	-47.9	0	0	0	110.3	I1147 S1148 S1150	H1137-I1147 WeakPolarHBondContact O-CA 3.4Å; H1137-S1148 PolarHBondContact N-O 2.59Å; H1137-S1148 PolarHBondContact O-N 3.25Å; H1137-S1150 PolarHBondContact CD2-OG 3.32Å; H1137-S1150 PolarHBondContact CE1-OG 3.42Å; H1137-S1150 VanDerWaalsContact CE1-OG 3.24Å; H1137-S1150 WeakPolarHBondContact NE2-CB 3.33Å; H1137-S1150 PolarHBondContact NE2-OG 2.76Å
1138	I	90.4	Very high	89	Confident	51 Å²	51	62.9 Å²	62.9	26%	0.262	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.9	175.3	-60.2	179.6	0	0	0	109	D1140 A1145 T1146 I1147 V1164 R1168	I1138-D1140 HydrophobicContact CG2-CB 4.45Å; I1138-A1145 HydrophobicContact CG2-CB 4.25Å; I1138-T1146 VanDerWaalsContact CA-O 3.31Å; I1138-T1146 WeakPolarHBondContact CA-O 3.47Å; I1138-I1147 HydrophobicContact CD1-CD1 4.09Å; I1138-I1147 HydrophobicContact CG1-CB 4.32Å; I1138-I1147 HydrophobicContact CG1-CD1 4.03Å; I1138-I1147 HydrophobicContact CG1-CG1 3.98Å; I1138-V1164 HydrophobicContact CD1-CG1 4Å; I1138-V1164 HydrophobicContact CG1-CG1 4.31Å; I1138-V1164 HydrophobicContact CG2-CG1 4.03Å; I1138-R1168 HydrophobicContact CD1-CB 3.91Å; I1138-R1168 HydrophobicContact CD1-CG 4.07Å
1139	R	89.8	Confident	88.7	Confident	207 Å²	207	63.1 Å²	63.1	78%	0.781	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	113.9	168	-64.3	-177.8	179.3	-175.3	-1.3	107.5	A1145 T1146	R1139-A1145 CarbonylContact O-C 3.53Å; R1139-A1145 VanDerWaalsContact O-CA 3.24Å; R1139-A1145 WeakPolarHBondContact O-CA 3.32Å; R1139-T1146 PolarHBondContact N-O 2.83Å; R1139-T1146 PolarHBondContact O-N 3.18Å
1140	D	89.4	Confident	88.2	Confident	81 Å²	81	65 Å²	65	43%	0.433	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	123	-176.3	-169.7	-5.2	0	0	0	109.1	I1138 G1142 A1145 S1161	I1138-D1140 HydrophobicContact CG2-CB 4.45Å; D1140-G1142 WeakPolarHBondContact OD1-CA 3.16Å; D1140-G1142 PolarHBondContact OD1-N 3.16Å; D1140-A1145 HydrophobicContact CB-CB 4.08Å; D1140-S1161 VanDerWaalsContact OD1-CB 3.31Å; D1140-S1161 WeakPolarHBondContact OD1-CB 3.4Å; D1140-S1161 PolarHBondContact OD1-OG 3.26Å; D1140-S1161 WeakPolarHBondContact OD2-CB 3.42Å
1141	D	86.3	Confident	87.6	Confident	120 Å²	120	67.4 Å²	67.4	64%	0.642	34%	0.338	S	S	*	.			trans	-95.1	4	175.8	70.9	23.1	0	0	0	112.8	R1143 R1144	D1141-R1143 PolarHBondContact OD1-N 3.44Å; D1141-R1144 VanDerWaalsContact CG-O 3.25Å; D1141-R1144 PolarHBondContact N-O 3.06Å; D1141-R1144 PolarHBondContact OD1-N 3.49Å
1142	G	79.6	Confident	87	Confident	59 Å²	59	67.6 Å²	67.6	61%	0.608	34%	0.341	S	S	*	.	S	Bend	trans	93.7	-22.7	-179.3	0	0	0	0	0	114.4	D1140	D1140-G1142 WeakPolarHBondContact OD1-CA 3.16Å; D1140-G1142 PolarHBondContact OD1-N 3.16Å
1143	R	84.1	Confident	86.6	Confident	219 Å²	219	70.8 Å²	70.8	83%	0.826	36%	0.357	S	S	*	.	S	Bend	trans	-111.7	-40.5	172.9	-70.2	-175.5	177.3	-176.4	-0.2	111.8	D1141 S1161	D1141-R1143 PolarHBondContact OD1-N 3.44Å; R1143-S1161 VanDerWaalsContact C-OG 3.26Å; R1143-S1161 PolarHBondContact O-N 3.22Å; R1143-S1161 PolarHBondContact O-OG 2.78Å
1144	R	88.4	Confident	86.8	Confident	144 Å²	144	66.7 Å²	66.7	54%	0.543	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	145.6	178.4	-58.4	-166.4	-174.9	-173.5	-0.3	109.4	D1141 E1158 G1159 S1161	D1141-R1144 VanDerWaalsContact CG-O 3.25Å; D1141-R1144 PolarHBondContact N-O 3.06Å; D1141-R1144 PolarHBondContact OD1-N 3.49Å; R1144-E1158 WeakPolarHBondContact CD-OE1 3.45Å; R1144-E1158 IonicContact CZ-OE1 2.63Å; R1144-E1158 IonicContact NE-OE1 2.99Å; R1144-E1158 IonicContact NH1-OE1 2.67Å; R1144-E1158 PolarHBondContact NH1-OE1 3.19Å; R1144-G1159 CarbonylContact C-O 3.55Å; R1144-G1159 WeakPolarHBondContact CA-O 3.35Å; R1144-S1161 PolarHBondContact N-OG 3.13Å
1145	A	91.1	Very high	87.2	Confident	1 Å²	1	66 Å²	66	1%	0.008	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	140.4	173.1	0	0	0	0	0	109.8	I1138 R1139 D1140 E1158 G1159 V1164	I1138-A1145 HydrophobicContact CG2-CB 4.25Å; R1139-A1145 CarbonylContact O-C 3.53Å; R1139-A1145 VanDerWaalsContact O-CA 3.24Å; R1139-A1145 WeakPolarHBondContact O-CA 3.32Å; D1140-A1145 HydrophobicContact CB-CB 4.08Å; A1145-E1158 WeakPolarHBondContact O-CA 3.37Å; A1145-G1159 PolarHBondContact N-O 2.63Å; A1145-G1159 PolarHBondContact O-N 2.99Å; A1145-V1164 HydrophobicContact CB-CB 3.74Å; A1145-V1164 HydrophobicContact CB-CG1 3.78Å; A1145-V1164 HydrophobicContact CB-CG2 3.88Å; A1145-V1164 WeakPolarHBondContact O-CG2 3.28Å
1146	T	90.5	Very high	87.4	Confident	38 Å²	38	65.4 Å²	65.4	23%	0.233	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	131.7	170.3	-54.9	0	0	0	0	108.9	P374 I1138 R1139 L1157	P374-T1146 HydrophobicContact CB-CG2 4.06Å; P374-T1146 HydrophobicContact CG-CG2 3.76Å; I1138-T1146 VanDerWaalsContact CA-O 3.31Å; I1138-T1146 WeakPolarHBondContact CA-O 3.47Å; R1139-T1146 PolarHBondContact N-O 2.83Å; R1139-T1146 PolarHBondContact O-N 3.18Å; T1146-L1157 CarbonylContact C-O 3.46Å; T1146-L1157 VanDerWaalsContact CA-O 3.27Å; T1146-L1157 WeakPolarHBondContact CA-O 3.01Å; T1146-L1157 WeakPolarHBondContact CG2-O 3.16Å
1147	I	91	Very high	87.5	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132.1	173.4	-170.1	162.8	0	0	0	110.2	L1129 V1136 H1137 I1138 L1157 V1164	L1129-I1147 HydrophobicContact CD1-CD1 3.7Å; L1129-I1147 HydrophobicContact CD1-CG1 3.78Å; L1129-I1147 HydrophobicContact CD1-CG2 4.19Å; L1129-I1147 HydrophobicContact CD2-CD1 4.17Å; L1129-I1147 HydrophobicContact CD2-CG2 3.95Å; L1129-I1147 HydrophobicContact CG-CD1 4.46Å; V1136-I1147 HydrophobicContact CB-CD1 4.23Å; V1136-I1147 HydrophobicContact CB-CG1 4.09Å; V1136-I1147 HydrophobicContact CG1-CG1 4.48Å; V1136-I1147 HydrophobicContact CG2-CD1 4.2Å; H1137-I1147 WeakPolarHBondContact O-CA 3.4Å; I1138-I1147 HydrophobicContact CD1-CD1 4.09Å; I1138-I1147 HydrophobicContact CG1-CB 4.32Å; I1138-I1147 HydrophobicContact CG1-CD1 4.03Å; I1138-I1147 HydrophobicContact CG1-CG1 3.98Å; I1147-L1157 HydrophobicContact CG2-CB 3.84Å; I1147-L1157 PolarHBondContact N-O 3.05Å; I1147-L1157 PolarHBondContact O-N 2.89Å; I1147-V1164 HydrophobicContact CB-CG1 3.94Å; I1147-V1164 HydrophobicContact CD1-CG1 4.35Å; I1147-V1164 HydrophobicContact CG2-CG1 4.35Å
1148	S	90.4	Very high	87.5	Confident	26 Å²	26	60.4 Å²	60.4	18%	0.182	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	153.6	178.8	63.5	0	0	0	0	111.1	V1136 H1137 L1155	V1136-S1148 CarbonylContact C-O 3.59Å; V1136-S1148 VanDerWaalsContact CA-O 3.28Å; V1136-S1148 WeakPolarHBondContact CA-O 3.26Å; H1137-S1148 PolarHBondContact N-O 2.59Å; H1137-S1148 PolarHBondContact O-N 3.25Å; S1148-L1155 WeakPolarHBondContact CA-O 3.3Å; S1148-L1155 WeakPolarHBondContact CB-O 3.36Å
1149	L	87.8	Confident	87.5	Confident	5 Å²	5	58.3 Å²	58.3	3%	0.026	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	140.5	169.7	-58.9	174.6	0	0	0	109.5	Y1053 V1128 V1136 S1152 L1155	Y1053-L1149 HydrophobicContact CE2-CD1 4.35Å; V1128-L1149 HydrophobicContact CG1-CD1 4.29Å; V1136-L1149 HydrophobicContact CG1-CD2 4.16Å; L1149-S1152 VanDerWaalsContact O-O 3.06Å; L1149-L1155 HydrophobicContact CD1-CB 4Å; L1149-L1155 HydrophobicContact CD1-CD2 4.27Å; L1149-L1155 HydrophobicContact CG-CB 4.2Å; L1149-L1155 HydrophobicContact CG-CD2 4.2Å
1150	S	82.9	Confident	87.5	Confident	41 Å²	41	51.8 Å²	51.8	29%	0.287	26%	0.264	S	S	.	.	S	Bend	trans	-76.2	-32.2	-177.6	-70.8	0	0	0	0	112.8	D1135 V1136 H1137	D1135-S1150 VanDerWaalsContact C-OG 3.24Å; D1135-S1150 WeakPolarHBondContact CB-OG 3.48Å; D1135-S1150 VanDerWaalsContact O-CB 3.31Å; D1135-S1150 WeakPolarHBondContact O-CB 3.43Å; D1135-S1150 PolarHBondContact O-N 3.37Å; D1135-S1150 PolarHBondContact O-OG 2.72Å; V1136-S1150 PolarHBondContact N-OG 3.13Å; H1137-S1150 PolarHBondContact CD2-OG 3.32Å; H1137-S1150 PolarHBondContact CE1-OG 3.42Å; H1137-S1150 VanDerWaalsContact CE1-OG 3.24Å; H1137-S1150 WeakPolarHBondContact NE2-CB 3.33Å; H1137-S1150 PolarHBondContact NE2-OG 2.76Å
1151	D	82.9	Confident	87.7	Confident	54 Å²	54	48.4 Å²	48.4	29%	0.289	25%	0.247	S	C	.	.	S	Bend	trans	-95.9	-2.2	-174.4	68.1	-42	0	0	0	113.5	Y1053 K1080	Y1053-D1151 WeakPolarHBondContact CE1-OD2 3.49Å; Y1053-D1151 VanDerWaalsContact CZ-OD2 3.29Å; Y1053-D1151 PolarHBondContact OH-OD1 3.08Å; Y1053-D1151 PolarHBondContact OH-OD2 3.25Å; K1080-D1151 WeakPolarHBondContact CE-O 3.49Å; K1080-D1151 PolarHBondContact NZ-O 3.14Å; K1080-D1151 IonicContact NZ-OD2 2.74Å
1152	S	82.8	Confident	88	Confident	12 Å²	12	46 Å²	46	8%	0.084	23%	0.229	C	C	.	.			trans	-152.9	135.2	-174.6	-175.6	0	0	0	0	112.7	L1149 L1154	L1149-S1152 VanDerWaalsContact O-O 3.06Å; S1152-L1154 VanDerWaalsContact C-N 3.28Å; S1152-L1154 WeakPolarHBondContact OG-CB 3.19Å; S1152-L1154 WeakPolarHBondContact OG-CD1 3.44Å; S1152-L1154 WeakPolarHBondContact OG-CG 3.33Å; S1152-L1154 PolarHBondContact OG-N 3.33Å
1153	D	82.8	Confident	88.6	Confident	70 Å²	70	43.3 Å²	43.3	37%	0.374	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	2.3	173.8	72.9	-30.3	0	0	0	113.5	L1155	D1153-L1155 VanDerWaalsContact C-N 3.32Å; D1153-L1155 PolarHBondContact O-N 3.34Å
1154	L	87.8	Confident	89	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.005	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-20.8	-173.7	-61.1	176.3	0	0	0	113.9	L1056 Q1058 R1078 W1102 S1152	L1056-L1154 HydrophobicContact CB-CD1 4.23Å; L1056-L1154 HydrophobicContact CD2-CB 4.11Å; L1056-L1154 HydrophobicContact CD2-CD1 4.26Å; L1056-L1154 HydrophobicContact CG-CD1 4.41Å; Q1058-L1154 HydrophobicContact CB-CB 4.29Å; Q1058-L1154 HydrophobicContact CB-CD2 3.84Å; Q1058-L1154 PolarHBondContact NE2-O 3.49Å; R1078-L1154 HydrophobicContact CG-CD2 4.13Å; W1102-L1154 PolarHBondContact NE1-O 3.17Å; S1152-L1154 VanDerWaalsContact C-N 3.28Å; S1152-L1154 WeakPolarHBondContact OG-CB 3.19Å; S1152-L1154 WeakPolarHBondContact OG-CD1 3.44Å; S1152-L1154 WeakPolarHBondContact OG-CG 3.33Å; S1152-L1154 PolarHBondContact OG-N 3.33Å
1155	L	90.1	Very high	89.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.157	C	C	.	.			trans	-128.4	120.6	179	-176.6	71.8	0	0	0	111.1	W1102 P1125 V1128 L1129 S1148 L1149 D1153 L1157	W1102-L1155 HydrophobicContact CD2-CD1 4.14Å; W1102-L1155 VanDerWaalsContact CE2-CD1 3.43Å; W1102-L1155 HydrophobicContact CH2-CD1 3.97Å; W1102-L1155 HydrophobicContact CZ2-CD1 3.34Å; P1125-L1155 HydrophobicContact CB-CD1 4.5Å; V1128-L1155 HydrophobicContact CB-CD2 3.95Å; V1128-L1155 HydrophobicContact CG1-CD2 3.76Å; L1129-L1155 HydrophobicContact CB-CD2 4.08Å; S1148-L1155 WeakPolarHBondContact CA-O 3.3Å; S1148-L1155 WeakPolarHBondContact CB-O 3.36Å; L1149-L1155 HydrophobicContact CD1-CB 4Å; L1149-L1155 HydrophobicContact CD1-CD2 4.27Å; L1149-L1155 HydrophobicContact CG-CB 4.2Å; L1149-L1155 HydrophobicContact CG-CD2 4.2Å; D1153-L1155 VanDerWaalsContact C-N 3.32Å; D1153-L1155 PolarHBondContact O-N 3.34Å; L1155-L1157 HydrophobicContact CD1-CD1 4.1Å; L1155-L1157 HydrophobicContact CD1-CD2 3.78Å; L1155-L1157 HydrophobicContact CD1-CG 3.85Å; L1155-L1157 HydrophobicContact CD2-CD1 4.22Å; L1155-L1157 HydrophobicContact CG-CD1 4.32Å; L1155-L1157 HydrophobicContact CG-CG 4.1Å
1156	R	88.6	Confident	89.3	Confident	101 Å²	101	32.6 Å²	32.6	38%	0.381	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	123.1	168.6	-62.2	-175	-174.9	161.1	2.1	108.8	P374 C375	P374-R1156 WeakPolarHBondContact CA-O 3.5Å; P374-R1156 HydrophobicContact CB-CB 4.2Å; P374-R1156 HydrophobicContact CG-CB 4.43Å; C375-R1156 PolarHBondContact N-O 2.94Å
1157	L	90.4	Very high	89.4	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	142.3	-178.3	-59.3	177.5	0	0	0	109.5	C375 I377 W1102 P1125 L1129 T1146 I1147 L1155 F1215	C375-L1157 HydrophobicContact CB-CD2 3.96Å; C375-L1157 CarbonylContact O-C 3.54Å; C375-L1157 VanDerWaalsContact O-CA 3.25Å; C375-L1157 WeakPolarHBondContact O-CA 3.32Å; I377-L1157 HydrophobicContact CG2-CB 3.73Å; I377-L1157 HydrophobicContact CG2-CD1 3.86Å; I377-L1157 HydrophobicContact CG2-CD2 3.9Å; I377-L1157 HydrophobicContact CG2-CG 4.02Å; W1102-L1157 HydrophobicContact CH2-CD2 4.26Å; P1125-L1157 HydrophobicContact CB-CD1 4.48Å; P1125-L1157 HydrophobicContact CB-CD2 4.21Å; L1129-L1157 HydrophobicContact CB-CD1 4.03Å; L1129-L1157 HydrophobicContact CD2-CD1 4.01Å; L1129-L1157 HydrophobicContact CG-CD1 4.5Å; T1146-L1157 CarbonylContact C-O 3.46Å; T1146-L1157 VanDerWaalsContact CA-O 3.27Å; T1146-L1157 WeakPolarHBondContact CA-O 3.01Å; T1146-L1157 WeakPolarHBondContact CG2-O 3.16Å; I1147-L1157 HydrophobicContact CG2-CB 3.84Å; I1147-L1157 PolarHBondContact N-O 3.05Å; I1147-L1157 PolarHBondContact O-N 2.89Å; L1155-L1157 HydrophobicContact CD1-CD1 4.1Å; L1155-L1157 HydrophobicContact CD1-CD2 3.78Å; L1155-L1157 HydrophobicContact CD1-CG 3.85Å; L1155-L1157 HydrophobicContact CD2-CD1 4.22Å; L1155-L1157 HydrophobicContact CG-CD1 4.32Å; L1155-L1157 HydrophobicContact CG-CG 4.1Å; L1157-F1215 HydrophobicContact CD2-CE1 4.47Å
1158	E	90.5	Very high	89.5	Confident	38 Å²	38	34.4 Å²	34.4	18%	0.178	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	133.1	178.7	176.7	-175.1	166.1	0	0	110.1	P374 C375 T376 I377 R1144 A1145	P374-E1158 HydrophobicContact CB-CB 3.66Å; P374-E1158 HydrophobicContact CG-CB 4.49Å; C375-E1158 PolarHBondContact O-N 3.36Å; T376-E1158 CarbonylContact C-O 3.58Å; T376-E1158 VanDerWaalsContact CA-O 3.23Å; T376-E1158 WeakPolarHBondContact CA-O 3.34Å; I377-E1158 WeakPolarHBondContact CG1-O 3.22Å; I377-E1158 PolarHBondContact N-O 3.11Å; R1144-E1158 WeakPolarHBondContact CD-OE1 3.45Å; R1144-E1158 IonicContact CZ-OE1 2.63Å; R1144-E1158 IonicContact NE-OE1 2.99Å; R1144-E1158 IonicContact NH1-OE1 2.67Å; R1144-E1158 PolarHBondContact NH1-OE1 3.19Å; A1145-E1158 WeakPolarHBondContact O-CA 3.37Å
1159	G	90	Very high	89.6	Confident	6 Å²	6	34.9 Å²	34.9	6%	0.062	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	-178.1	175.9	0	0	0	0	0	110.8	R1144 A1145	R1144-G1159 CarbonylContact C-O 3.55Å; R1144-G1159 WeakPolarHBondContact CA-O 3.35Å; A1145-G1159 PolarHBondContact N-O 2.63Å; A1145-G1159 PolarHBondContact O-N 2.99Å
1160	D	91.4	Very high	90	Very high	70 Å²	70	34.6 Å²	34.6	37%	0.374	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	151.5	167.9	68	92.3	0	0	0	110.6	R1162 T1163 V1164	D1160-R1162 PolarHBondContact O-N 3.04Å; D1160-R1162 VanDerWaalsContact O-N 3.14Å; D1160-R1162 WeakPolarHBondContact OD1-CA 3.47Å; D1160-R1162 WeakPolarHBondContact OD1-CB 3.38Å; D1160-R1162 PolarHBondContact OD1-N 3.11Å; D1160-R1162 VanDerWaalsContact OD1-N 3.13Å; D1160-T1163 VanDerWaalsContact CG-OG1 3.26Å; D1160-T1163 PolarHBondContact O-N 2.93Å; D1160-T1163 PolarHBondContact OD1-N 3.39Å; D1160-T1163 PolarHBondContact OD1-OG1 3.32Å; D1160-T1163 WeakPolarHBondContact OD2-CB 3.28Å; D1160-T1163 PolarHBondContact OD2-OG1 3.08Å; D1160-V1164 PolarHBondContact O-N 3.19Å; D1160-V1164 VanDerWaalsContact O-N 3.09Å
1161	S	91.8	Very high	90.5	Very high	10 Å²	10	34 Å²	34	7%	0.07	15%	0.153	C	C	.	.	H	α-helix	trans	-59.9	-27.6	-174.9	-52	0	0	0	0	113.3	D1140 R1143 R1144 R1165	D1140-S1161 VanDerWaalsContact OD1-CB 3.31Å; D1140-S1161 WeakPolarHBondContact OD1-CB 3.4Å; D1140-S1161 PolarHBondContact OD1-OG 3.26Å; D1140-S1161 WeakPolarHBondContact OD2-CB 3.42Å; R1143-S1161 VanDerWaalsContact C-OG 3.26Å; R1143-S1161 PolarHBondContact O-N 3.22Å; R1143-S1161 PolarHBondContact O-OG 2.78Å; R1144-S1161 PolarHBondContact N-OG 3.13Å; S1161-R1165 VanDerWaalsContact O-CB 3.28Å; S1161-R1165 WeakPolarHBondContact O-CB 3.23Å; S1161-R1165 PolarHBondContact O-N 3.1Å; S1161-R1165 PolarHBondContact O-NH2 3.18Å
1162	R	92.4	Very high	91	Very high	70 Å²	70	34.5 Å²	34.5	26%	0.264	15%	0.151	S	C	.	.	H	α-helix	trans	-71.8	-50.5	175.9	170.1	176.6	172.2	-113.4	8.3	110.7	E381 E388 D1160 V1164 R1165 L1166	E381-R1162 VanDerWaalsContact CD-NH1 3.33Å; E381-R1162 IonicContact OE1-CZ 3.95Å; E381-R1162 IonicContact OE1-NH1 3.4Å; E381-R1162 PolarHBondContact OE1-NH1 3.48Å; E381-R1162 VanDerWaalsContact OE1-NH1 3.08Å; E381-R1162 IonicContact OE1-NH2 3.97Å; E381-R1162 PolarHBondContact OE1-NH2 3.47Å; E381-R1162 VanDerWaalsContact OE1-NH2 3.13Å; E381-R1162 IonicContact OE2-CZ 3.36Å; E381-R1162 IonicContact OE2-NH1 3.52Å; E381-R1162 PolarHBondContact OE2-NH1 3.11Å; E388-R1162 IonicContact OE2-CZ 3.13Å; E388-R1162 IonicContact OE2-NE 2.8Å; E388-R1162 PolarHBondContact OE2-NE 3.34Å; E388-R1162 IonicContact OE2-NH2 2.7Å; E388-R1162 PolarHBondContact OE2-NH2 3.11Å; D1160-R1162 PolarHBondContact O-N 3.04Å; D1160-R1162 VanDerWaalsContact O-N 3.14Å; D1160-R1162 WeakPolarHBondContact OD1-CA 3.47Å; D1160-R1162 WeakPolarHBondContact OD1-CB 3.38Å; D1160-R1162 PolarHBondContact OD1-N 3.11Å; D1160-R1162 VanDerWaalsContact OD1-N 3.13Å; R1162-V1164 PolarHBondContact O-N 3.22Å; R1162-R1165 PolarHBondContact O-N 2.85Å; R1162-L1166 HydrophobicContact CG-CD1 3.93Å; R1162-L1166 HydrophobicContact CG-CG 4.44Å; R1162-L1166 WeakPolarHBondContact O-CG 3.4Å; R1162-L1166 PolarHBondContact O-N 2.84Å
1163	T	92.6	Very high	91.5	Very high	2 Å²	2	34 Å²	34	1%	0.012	15%	0.147	C	C	.	.	H	α-helix	trans	-56.5	-49	178.4	-66.6	0	0	0	0	111.5	I377 V379 L384 D1160 R1165 L1166 L1167	I377-T1163 HydrophobicContact CD1-CG2 4.03Å; V379-T1163 HydrophobicContact CB-CG2 4.28Å; V379-T1163 HydrophobicContact CG2-CG2 3.88Å; L384-T1163 VanDerWaalsContact CD1-OG1 3.32Å; L384-T1163 WeakPolarHBondContact CD1-OG1 3.45Å; L384-T1163 HydrophobicContact CD2-CG2 4.19Å; D1160-T1163 VanDerWaalsContact CG-OG1 3.26Å; D1160-T1163 PolarHBondContact O-N 2.93Å; D1160-T1163 PolarHBondContact OD1-N 3.39Å; D1160-T1163 PolarHBondContact OD1-OG1 3.32Å; D1160-T1163 WeakPolarHBondContact OD2-CB 3.28Å; D1160-T1163 PolarHBondContact OD2-OG1 3.08Å; T1163-R1165 VanDerWaalsContact C-N 3.33Å; T1163-R1165 PolarHBondContact O-N 3.21Å; T1163-L1166 PolarHBondContact O-N 3.39Å; T1163-L1167 HydrophobicContact CG2-CD1 3.96Å; T1163-L1167 HydrophobicContact CG2-CG 4.4Å; T1163-L1167 WeakPolarHBondContact O-CB 3.44Å; T1163-L1167 WeakPolarHBondContact O-CG 3.42Å; T1163-L1167 PolarHBondContact O-N 3.32Å
1164	V	92.9	Very high	92.2	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.006	13%	0.13	C	C	.	.	H	α-helix	trans	-63.4	-39.6	-179.2	171.8	0	0	0	0	111.9	I377 I1138 A1145 I1147 D1160 R1162 L1167 R1168	I377-V1164 HydrophobicContact CD1-CG2 4.12Å; I1138-V1164 HydrophobicContact CD1-CG1 4Å; I1138-V1164 HydrophobicContact CG1-CG1 4.31Å; I1138-V1164 HydrophobicContact CG2-CG1 4.03Å; A1145-V1164 HydrophobicContact CB-CB 3.74Å; A1145-V1164 HydrophobicContact CB-CG1 3.78Å; A1145-V1164 HydrophobicContact CB-CG2 3.88Å; A1145-V1164 WeakPolarHBondContact O-CG2 3.28Å; I1147-V1164 HydrophobicContact CB-CG1 3.94Å; I1147-V1164 HydrophobicContact CD1-CG1 4.35Å; I1147-V1164 HydrophobicContact CG2-CG1 4.35Å; D1160-V1164 PolarHBondContact O-N 3.19Å; D1160-V1164 VanDerWaalsContact O-N 3.09Å; R1162-V1164 PolarHBondContact O-N 3.22Å; V1164-L1167 PolarHBondContact O-N 3.39Å; V1164-R1168 PolarHBondContact O-N 3.38Å
1165	R	92.1	Very high	92.4	Very high	122 Å²	122	32.7 Å²	32.7	46%	0.46	15%	0.15	S	C	.	.	H	α-helix	trans	-63.9	-47.3	175.7	-169	-173	-48.4	114.5	8.1	111.6	S1161 R1162 T1163 L1167 R1168 E1169	S1161-R1165 VanDerWaalsContact O-CB 3.28Å; S1161-R1165 WeakPolarHBondContact O-CB 3.23Å; S1161-R1165 PolarHBondContact O-N 3.1Å; S1161-R1165 PolarHBondContact O-NH2 3.18Å; R1162-R1165 PolarHBondContact O-N 2.85Å; T1163-R1165 VanDerWaalsContact C-N 3.33Å; T1163-R1165 PolarHBondContact O-N 3.21Å; R1165-L1167 VanDerWaalsContact C-N 3.35Å; R1165-L1167 PolarHBondContact O-N 3.46Å; R1165-R1168 WeakPolarHBondContact O-CB 3.37Å; R1165-R1168 PolarHBondContact O-N 2.81Å; R1165-E1169 WeakPolarHBondContact O-CG 3.47Å; R1165-E1169 PolarHBondContact O-N 3.21Å
1166	L	93.4	Very high	92.5	Very high	17 Å²	17	34.8 Å²	34.8	9%	0.089	16%	0.158	C	C	.	.	H	α-helix	trans	-61.3	-42.5	177.5	-73	173.7	0	0	0	111.6	L384 I387 E388 L391 R1162 T1163 R1168 E1169 F1170	L384-L1166 HydrophobicContact CB-CD1 4.33Å; L384-L1166 HydrophobicContact CD2-CD1 4.15Å; I387-L1166 HydrophobicContact CG2-CB 4.46Å; E388-L1166 HydrophobicContact CB-CD1 4.31Å; E388-L1166 HydrophobicContact CB-CD2 3.92Å; E388-L1166 HydrophobicContact CG-CD2 4.13Å; L391-L1166 HydrophobicContact CD1-CD2 4.09Å; R1162-L1166 HydrophobicContact CG-CD1 3.93Å; R1162-L1166 HydrophobicContact CG-CG 4.44Å; R1162-L1166 WeakPolarHBondContact O-CG 3.4Å; R1162-L1166 PolarHBondContact O-N 2.84Å; T1163-L1166 PolarHBondContact O-N 3.39Å; L1166-R1168 VanDerWaalsContact C-N 3.34Å; L1166-R1168 PolarHBondContact O-N 3.04Å; L1166-E1169 PolarHBondContact O-N 3.13Å; L1166-F1170 VanDerWaalsContact O-CB 3.25Å; L1166-F1170 WeakPolarHBondContact O-CB 3.26Å; L1166-F1170 PolarHBondContact O-N 3.28Å
1167	L	93.6	Very high	92.7	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-64	-36.9	176	-70.9	175.2	0	0	0	112.6	I377 V379 L1126 L1129 L1130 T1163 V1164 R1165 F1170 R1171 L1207	I377-L1167 HydrophobicContact CD1-CD1 3.5Å; V379-L1167 HydrophobicContact CG2-CD1 4.4Å; L1126-L1167 HydrophobicContact CD2-CD1 3.98Å; L1129-L1167 HydrophobicContact CD2-CB 4.47Å; L1129-L1167 HydrophobicContact CD2-CD1 4.31Å; L1130-L1167 HydrophobicContact CD2-CD2 4.44Å; T1163-L1167 HydrophobicContact CG2-CD1 3.96Å; T1163-L1167 HydrophobicContact CG2-CG 4.4Å; T1163-L1167 WeakPolarHBondContact O-CB 3.44Å; T1163-L1167 WeakPolarHBondContact O-CG 3.42Å; T1163-L1167 PolarHBondContact O-N 3.32Å; V1164-L1167 PolarHBondContact O-N 3.39Å; R1165-L1167 VanDerWaalsContact C-N 3.35Å; R1165-L1167 PolarHBondContact O-N 3.46Å; L1167-F1170 PolarHBondContact O-N 2.95Å; L1167-R1171 WeakPolarHBondContact O-CB 3.49Å; L1167-R1171 PolarHBondContact O-N 3.42Å; L1167-L1207 HydrophobicContact CD2-CD2 3.95Å
1168	R	92.4	Very high	92.9	Very high	76 Å²	76	31.2 Å²	31.2	29%	0.287	15%	0.147	S	C	.	.	H	α-helix	trans	-62.4	-50.7	172.9	-176.6	-170.7	60.5	-161.2	5.1	111.1	I1138 V1164 R1165 L1166 F1170 R1171 R1172	I1138-R1168 HydrophobicContact CD1-CB 3.91Å; I1138-R1168 HydrophobicContact CD1-CG 4.07Å; V1164-R1168 PolarHBondContact O-N 3.38Å; R1165-R1168 WeakPolarHBondContact O-CB 3.37Å; R1165-R1168 PolarHBondContact O-N 2.81Å; L1166-R1168 VanDerWaalsContact C-N 3.34Å; L1166-R1168 PolarHBondContact O-N 3.04Å; R1168-F1170 VanDerWaalsContact C-N 3.29Å; R1168-F1170 PolarHBondContact O-N 3.25Å; R1168-R1171 WeakPolarHBondContact O-CB 3.29Å; R1168-R1171 PolarHBondContact O-N 2.84Å; R1168-R1172 WeakPolarHBondContact O-CG 3.44Å; R1168-R1172 PolarHBondContact O-N 2.98Å
1169	E	93	Very high	92.9	Very high	35 Å²	35	32.6 Å²	32.6	16%	0.164	15%	0.153	C	C	.	.	H	α-helix	trans	-65.3	-35.4	-179.9	-59.6	-45.1	138.6	0	0	111.5	L391 R1165 L1166 R1172 A1173	L391-E1169 HydrophobicContact CD1-CB 3.72Å; L391-E1169 HydrophobicContact CD2-CB 4.17Å; R1165-E1169 WeakPolarHBondContact O-CG 3.47Å; R1165-E1169 PolarHBondContact O-N 3.21Å; L1166-E1169 PolarHBondContact O-N 3.13Å; E1169-R1172 WeakPolarHBondContact O-CB 3.34Å; E1169-R1172 PolarHBondContact O-N 2.87Å; E1169-R1172 IonicContact OE1-CZ 3.7Å; E1169-R1172 IonicContact OE1-NH1 3.33Å; E1169-R1172 PolarHBondContact OE1-NH1 2.82Å; E1169-R1172 WeakPolarHBondContact OE2-CD 3.37Å; E1169-R1172 IonicContact OE2-CZ 2.98Å; E1169-R1172 IonicContact OE2-NE 3.91Å; E1169-R1172 IonicContact OE2-NH1 3.62Å; E1169-R1172 PolarHBondContact OE2-NH1 3.27Å; E1169-A1173 PolarHBondContact O-N 3.37Å
1170	F	95.2	Very high	92.9	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.5	-43.8	173	-168.4	-110.9	0	0	0	112.1	I387 L1130 L1166 L1167 R1168 R1172 A1173 L1174 L1200 L1203 L1204 L1207	I387-F1170 HydrophobicContact CG1-CD2 4.19Å; I387-F1170 HydrophobicContact CG1-CE2 4.19Å; I387-F1170 HydrophobicContact CG2-CB 4.11Å; I387-F1170 HydrophobicContact CG2-CD2 3.81Å; I387-F1170 HydrophobicContact CG2-CG 4.2Å; L1130-F1170 HydrophobicContact CD1-CD1 4.03Å; L1130-F1170 HydrophobicContact CD1-CE1 4.18Å; L1130-F1170 HydrophobicContact CD2-CD1 4.05Å; L1166-F1170 VanDerWaalsContact O-CB 3.25Å; L1166-F1170 WeakPolarHBondContact O-CB 3.26Å; L1166-F1170 PolarHBondContact O-N 3.28Å; L1167-F1170 PolarHBondContact O-N 2.95Å; R1168-F1170 VanDerWaalsContact C-N 3.29Å; R1168-F1170 PolarHBondContact O-N 3.25Å; F1170-R1172 VanDerWaalsContact C-N 3.29Å; F1170-R1172 PolarHBondContact O-N 3.23Å; F1170-A1173 WeakPolarHBondContact O-CB 3.29Å; F1170-A1173 PolarHBondContact O-N 2.74Å; F1170-L1174 HydrophobicContact CD1-CD1 4.04Å; F1170-L1174 HydrophobicContact CE1-CD1 3.92Å; F1170-L1174 HydrophobicContact CE1-CG 4.43Å; F1170-L1174 WeakPolarHBondContact O-CG 3.33Å; F1170-L1174 PolarHBondContact O-N 2.92Å; F1170-L1200 HydrophobicContact CD2-CD1 3.83Å; F1170-L1200 HydrophobicContact CE2-CD1 3.26Å; F1170-L1200 HydrophobicContact CZ-CD1 3.74Å; F1170-L1203 HydrophobicContact CE2-CB 3.95Å; F1170-L1203 HydrophobicContact CE2-CD1 4.3Å; F1170-L1203 HydrophobicContact CZ-CB 3.93Å; F1170-L1204 HydrophobicContact CE1-CB 4.19Å; F1170-L1204 HydrophobicContact CE1-CD1 4.16Å; F1170-L1204 HydrophobicContact CZ-CB 4.08Å; F1170-L1207 HydrophobicContact CD1-CD2 4.43Å; F1170-L1207 HydrophobicContact CE1-CD2 4.22Å
1171	R	94.3	Very high	92.9	Very high	27 Å²	27	33.7 Å²	33.7	10%	0.102	15%	0.15	C	C	.	.	H	α-helix	trans	-57.5	-41.5	171.8	177.6	176.1	179.4	72.8	-22.1	112	L1129 L1130 T1132 G1134 L1167 R1168 L1174 G1175	L1129-R1171 WeakPolarHBondContact O-CD 3.48Å; L1129-R1171 PolarHBondContact O-NE 3.39Å; L1129-R1171 PolarHBondContact O-NH1 3Å; L1130-R1171 HydrophobicContact CD2-CB 3.93Å; L1130-R1171 PolarHBondContact O-NH1 3.37Å; T1132-R1171 PolarHBondContact O-NH1 2.64Å; T1132-R1171 PolarHBondContact O-NH2 2.96Å; T1132-R1171 PolarHBondContact OG1-NH2 3.4Å; G1134-R1171 PolarHBondContact O-NH2 3.14Å; L1167-R1171 WeakPolarHBondContact O-CB 3.49Å; L1167-R1171 PolarHBondContact O-N 3.42Å; R1168-R1171 WeakPolarHBondContact O-CB 3.29Å; R1168-R1171 PolarHBondContact O-N 2.84Å; R1171-L1174 PolarHBondContact O-N 3.37Å; R1171-G1175 PolarHBondContact O-N 3.18Å
1172	R	92.6	Very high	92.9	Very high	65 Å²	65	33.9 Å²	33.9	25%	0.245	15%	0.151	C	C	.	.	H	α-helix	trans	-65.7	-39.5	176.3	-65.9	179	172.5	169.5	-10.9	112.2	V396 I401 R1168 E1169 F1170 L1174 G1175 R1176	V396-R1172 HydrophobicContact CB-CB 4.33Å; V396-R1172 HydrophobicContact CG1-CB 4.18Å; I401-R1172 HydrophobicContact CD1-CB 4.24Å; I401-R1172 HydrophobicContact CD1-CG 3.55Å; R1168-R1172 WeakPolarHBondContact O-CG 3.44Å; R1168-R1172 PolarHBondContact O-N 2.98Å; E1169-R1172 WeakPolarHBondContact O-CB 3.34Å; E1169-R1172 PolarHBondContact O-N 2.87Å; E1169-R1172 IonicContact OE1-CZ 3.7Å; E1169-R1172 IonicContact OE1-NH1 3.33Å; E1169-R1172 PolarHBondContact OE1-NH1 2.82Å; E1169-R1172 WeakPolarHBondContact OE2-CD 3.37Å; E1169-R1172 IonicContact OE2-CZ 2.98Å; E1169-R1172 IonicContact OE2-NE 3.91Å; E1169-R1172 IonicContact OE2-NH1 3.62Å; E1169-R1172 PolarHBondContact OE2-NH1 3.27Å; F1170-R1172 VanDerWaalsContact C-N 3.29Å; F1170-R1172 PolarHBondContact O-N 3.23Å; R1172-L1174 VanDerWaalsContact C-N 3.32Å; R1172-L1174 PolarHBondContact O-N 2.92Å; R1172-G1175 PolarHBondContact O-N 3.5Å; R1172-R1176 WeakPolarHBondContact O-CB 3.28Å; R1172-R1176 PolarHBondContact O-N 2.9Å
1173	A	94.5	Very high	92.7	Very high	2 Å²	2	35 Å²	35	2%	0.017	16%	0.155	C	C	.	.	H	α-helix	trans	-60.8	-42.5	174.1	0	0	0	0	0	111.4	F390 L391 V396 E1169 F1170 R1176 M1177 L1200	F390-A1173 HydrophobicContact CE1-CB 4.33Å; L391-A1173 HydrophobicContact CD2-CB 4.17Å; V396-A1173 HydrophobicContact CG2-CB 3.86Å; E1169-A1173 PolarHBondContact O-N 3.37Å; F1170-A1173 WeakPolarHBondContact O-CB 3.29Å; F1170-A1173 PolarHBondContact O-N 2.74Å; A1173-R1176 PolarHBondContact O-N 3.47Å; A1173-M1177 PolarHBondContact O-N 2.94Å; A1173-L1200 HydrophobicContact CB-CD1 4.19Å; A1173-L1200 HydrophobicContact CB-CD2 4.17Å
1174	L	95.7	Very high	92.2	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.016	17%	0.171	C	C	.	.	H	α-helix	trans	-63.3	-44	174.1	-66.8	170.6	0	0	0	112	F922 L1130 L1131 F1170 R1171 R1172 R1176 M1177 V1178 L1200 L1204	F922-L1174 HydrophobicContact CE1-CD2 4.16Å; L1130-L1174 HydrophobicContact CB-CD1 4.04Å; L1131-L1174 HydrophobicContact CD2-CD1 4.42Å; F1170-L1174 HydrophobicContact CD1-CD1 4.04Å; F1170-L1174 HydrophobicContact CE1-CD1 3.92Å; F1170-L1174 HydrophobicContact CE1-CG 4.43Å; F1170-L1174 WeakPolarHBondContact O-CG 3.33Å; F1170-L1174 PolarHBondContact O-N 2.92Å; R1171-L1174 PolarHBondContact O-N 3.37Å; R1172-L1174 VanDerWaalsContact C-N 3.32Å; R1172-L1174 PolarHBondContact O-N 2.92Å; L1174-R1176 PolarHBondContact O-N 2.99Å; L1174-M1177 HydrophobicContact CD2-CE 4.16Å; L1174-M1177 WeakPolarHBondContact O-CB 3.45Å; L1174-M1177 PolarHBondContact O-N 2.67Å; L1174-V1178 WeakPolarHBondContact O-CG2 3.46Å; L1174-V1178 PolarHBondContact O-N 3.47Å; L1174-L1200 HydrophobicContact CD2-CD1 4Å; L1174-L1200 HydrophobicContact CD2-CD2 3.88Å; L1174-L1200 HydrophobicContact CD2-CG 3.7Å; L1174-L1200 HydrophobicContact CG-CD1 4.38Å; L1174-L1200 HydrophobicContact CG-CD2 4.46Å; L1174-L1200 HydrophobicContact CG-CG 4.49Å; L1174-L1204 HydrophobicContact CD1-CD1 4.25Å; L1174-L1204 HydrophobicContact CD1-CD2 4.42Å; L1174-L1204 HydrophobicContact CD2-CD2 4.1Å
1175	G	92.9	Very high	91.7	Very high	41 Å²	41	40.5 Å²	40.5	42%	0.423	19%	0.186	S	C	.	.	H	α-helix	trans	-58.9	-45.2	175.4	0	0	0	0	0	112.5	R1171 R1172 M1177 V1178 E1179	R1171-G1175 PolarHBondContact O-N 3.18Å; R1172-G1175 PolarHBondContact O-N 3.5Å; G1175-M1177 VanDerWaalsContact C-N 3.35Å; G1175-M1177 PolarHBondContact O-N 3.33Å; G1175-V1178 PolarHBondContact O-N 2.63Å; G1175-E1179 PolarHBondContact O-N 3Å
1176	R	91.7	Very high	91.2	Very high	44 Å²	44	35.8 Å²	35.8	17%	0.166	17%	0.17	C	C	.	.	H	α-helix	trans	-61.4	-41.2	174.9	179	175.5	58.3	-172.9	-1.8	112.2	Y394 P395 R1172 A1173 L1174 E1179 R1180 E1196	Y394-R1176 PolarHBondContact O-NH2 2.97Å; Y394-R1176 VanDerWaalsContact O-NH2 3.08Å; P395-R1176 PolarHBondContact O-NH1 3.31Å; R1172-R1176 WeakPolarHBondContact O-CB 3.28Å; R1172-R1176 PolarHBondContact O-N 2.9Å; A1173-R1176 PolarHBondContact O-N 3.47Å; L1174-R1176 PolarHBondContact O-N 2.99Å; R1176-E1179 PolarHBondContact O-N 3.03Å; R1176-R1180 VanDerWaalsContact O-CB 3.26Å; R1176-R1180 WeakPolarHBondContact O-CB 3.19Å; R1176-R1180 PolarHBondContact O-N 3.4Å; R1176-E1196 IonicContact NH2-OE1 3.59Å
1177	M	94	Very high	90.5	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.015	18%	0.184	C	C	.	.	H	α-helix	trans	-59.7	-47	174.8	176.2	-171.4	78.5	0	0	111.2	I921 F922 A1173 L1174 G1175 S1181 H1197 L1200 L1201	I921-M1177 HydrophobicContact CG2-CE 4.14Å; F922-M1177 HydrophobicContact CD1-CE 3.98Å; F922-M1177 HydrophobicContact CE1-CE 3.67Å; F922-M1177 HydrophobicContact CZ-CE 4.04Å; A1173-M1177 PolarHBondContact O-N 2.94Å; L1174-M1177 HydrophobicContact CD2-CE 4.16Å; L1174-M1177 WeakPolarHBondContact O-CB 3.45Å; L1174-M1177 PolarHBondContact O-N 2.67Å; G1175-M1177 VanDerWaalsContact C-N 3.35Å; G1175-M1177 PolarHBondContact O-N 3.33Å; M1177-S1181 VanDerWaalsContact O-CB 3.26Å; M1177-S1181 WeakPolarHBondContact O-CB 3.44Å; M1177-S1181 PolarHBondContact O-N 2.82Å; M1177-S1181 PolarHBondContact O-OG 3.32Å; M1177-H1197 HydrophobicContact CG-CB 4.26Å; M1177-H1197 HydrophobicContact SD-CB 4.08Å; M1177-L1200 HydrophobicContact CB-CD2 3.98Å; M1177-L1200 HydrophobicContact CG-CD2 4.48Å; M1177-L1200 HydrophobicContact SD-CD2 3.94Å; M1177-L1200 HydrophobicContact SD-CG 4.48Å; M1177-L1201 HydrophobicContact CE-CD2 3.78Å; M1177-L1201 HydrophobicContact CE-CG 4.4Å; M1177-L1201 HydrophobicContact SD-CD2 4.1Å; M1177-L1201 HydrophobicContact SD-CG 4.07Å
1178	V	94.1	Very high	89.9	Confident	22 Å²	22	40.4 Å²	40.4	13%	0.133	21%	0.211	C	C	.	.	H	α-helix	trans	-61.2	-50.6	178.2	172.3	0	0	0	0	110.5	L918 I921 F922 L1174 G1175 R1180 S1181 L1182	L918-V1178 HydrophobicContact CD2-CG1 4.17Å; I921-V1178 HydrophobicContact CD1-CG1 4.21Å; I921-V1178 HydrophobicContact CG2-CG2 4.15Å; F922-V1178 HydrophobicContact CE2-CG2 3.83Å; F922-V1178 HydrophobicContact CZ-CG2 3.9Å; L1174-V1178 WeakPolarHBondContact O-CG2 3.46Å; L1174-V1178 PolarHBondContact O-N 3.47Å; G1175-V1178 PolarHBondContact O-N 2.63Å; V1178-R1180 PolarHBondContact O-N 3.15Å; V1178-S1181 WeakPolarHBondContact O-CB 3.25Å; V1178-S1181 PolarHBondContact O-N 3.48Å; V1178-L1182 HydrophobicContact CG1-CD1 3.92Å; V1178-L1182 HydrophobicContact CG1-CG 4.41Å; V1178-L1182 VanDerWaalsContact O-CG 3.31Å; V1178-L1182 WeakPolarHBondContact O-CG 3.49Å; V1178-L1182 PolarHBondContact O-N 3.45Å
1179	E	90.1	Very high	89.7	Confident	67 Å²	67	37.2 Å²	37.2	31%	0.313	20%	0.199	S	C	.	.	H	α-helix	trans	-60.6	-46.4	-179.4	-178.8	169.8	-149.8	0	0	112.6	G1175 R1176 S1181 L1182 R1183	G1175-E1179 PolarHBondContact O-N 3Å; R1176-E1179 PolarHBondContact O-N 3.03Å; E1179-S1181 VanDerWaalsContact C-N 3.28Å; E1179-S1181 PolarHBondContact O-N 2.89Å; E1179-L1182 PolarHBondContact O-N 3.4Å; E1179-L1182 VanDerWaalsContact O-N 3.15Å; E1179-R1183 VanDerWaalsContact CD-NH2 3.31Å; E1179-R1183 WeakPolarHBondContact O-CG 3.39Å; E1179-R1183 PolarHBondContact O-N 2.7Å; E1179-R1183 IonicContact OE1-CZ 3.33Å; E1179-R1183 IonicContact OE1-NE 2.73Å; E1179-R1183 IonicContact OE1-NH2 3.94Å; E1179-R1183 PolarHBondContact OE1-NH2 3.13Å; E1179-R1183 IonicContact OE2-NH2 3.48Å
1180	R	90.5	Very high	89.4	Confident	99 Å²	99	39 Å²	39	37%	0.374	21%	0.214	S	C	.	.	H	α-helix	trans	-60.6	-39.7	176.4	-170.1	177.5	-167.7	170.6	8.4	112	R1176 V1178 L1182 E1196	R1176-R1180 VanDerWaalsContact O-CB 3.26Å; R1176-R1180 WeakPolarHBondContact O-CB 3.19Å; R1176-R1180 PolarHBondContact O-N 3.4Å; V1178-R1180 PolarHBondContact O-N 3.15Å; R1180-L1182 VanDerWaalsContact C-N 3.31Å; R1180-L1182 PolarHBondContact O-N 3.35Å; R1180-E1196 IonicContact NH1-OE2 3.65Å; R1180-E1196 PolarHBondContact NH1-OE2 2.89Å
1181	S	92	Very high	89.1	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-68.9	-29.5	177.8	-59.4	0	0	0	0	112.7	M1177 V1178 E1179 S1184 H1197	M1177-S1181 VanDerWaalsContact O-CB 3.26Å; M1177-S1181 WeakPolarHBondContact O-CB 3.44Å; M1177-S1181 PolarHBondContact O-N 2.82Å; M1177-S1181 PolarHBondContact O-OG 3.32Å; V1178-S1181 WeakPolarHBondContact O-CB 3.25Å; V1178-S1181 PolarHBondContact O-N 3.48Å; E1179-S1181 VanDerWaalsContact C-N 3.28Å; E1179-S1181 PolarHBondContact O-N 2.89Å; S1181-S1184 VanDerWaalsContact O-O 3.04Å; S1181-H1197 PolarHBondContact OG-CE1 3.3Å
1182	L	91.4	Very high	88.8	Confident	15 Å²	15	47.7 Å²	47.7	8%	0.079	27%	0.268	C	S	.	.	H	α-helix	trans	-76.4	-38.9	176.8	-71.1	172	0	0	0	112.1	T898 L899 R902 V917 I921 V1178 E1179 R1180 S1184	T898-L1182 VanDerWaalsContact CG2-C 3.49Å; T898-L1182 HydrophobicContact CG2-CB 3.78Å; T898-L1182 VanDerWaalsContact CG2-O 3.23Å; T898-L1182 WeakPolarHBondContact CG2-O 3.47Å; L899-L1182 HydrophobicContact CB-CD1 4.02Å; L899-L1182 HydrophobicContact CD1-CD1 4.48Å; L899-L1182 HydrophobicContact CD1-CD2 4.23Å; R902-L1182 HydrophobicContact CG-CD2 3.85Å; R902-L1182 PolarHBondContact NE-O 2.99Å; R902-L1182 VanDerWaalsContact NE-O 3.13Å; R902-L1182 PolarHBondContact NH2-O 2.8Å; V917-L1182 HydrophobicContact CG1-CD2 3.7Å; I921-L1182 HydrophobicContact CD1-CD2 3.92Å; I921-L1182 HydrophobicContact CD1-CG 4.04Å; V1178-L1182 HydrophobicContact CG1-CD1 3.92Å; V1178-L1182 HydrophobicContact CG1-CG 4.41Å; V1178-L1182 VanDerWaalsContact O-CG 3.31Å; V1178-L1182 WeakPolarHBondContact O-CG 3.49Å; V1178-L1182 PolarHBondContact O-N 3.45Å; E1179-L1182 PolarHBondContact O-N 3.4Å; E1179-L1182 VanDerWaalsContact O-N 3.15Å; R1180-L1182 VanDerWaalsContact C-N 3.31Å; R1180-L1182 PolarHBondContact O-N 3.35Å; L1182-S1184 VanDerWaalsContact C-N 3.31Å; L1182-S1184 PolarHBondContact O-N 2.8Å
1183	R	87.7	Confident	88.7	Confident	92 Å²	92	44.7 Å²	44.7	35%	0.347	26%	0.257	S	S	.	.	H	α-helix	trans	-71.1	-19.6	-176.9	-70.7	-179.9	-173.7	-174.2	0.8	114.4	L413 E1179	L413-R1183 VanDerWaalsContact CD1-O 3.29Å; L413-R1183 WeakPolarHBondContact CD1-O 3.1Å; L413-R1183 WeakPolarHBondContact CG-O 3.45Å; E1179-R1183 VanDerWaalsContact CD-NH2 3.31Å; E1179-R1183 WeakPolarHBondContact O-CG 3.39Å; E1179-R1183 PolarHBondContact O-N 2.7Å; E1179-R1183 IonicContact OE1-CZ 3.33Å; E1179-R1183 IonicContact OE1-NE 2.73Å; E1179-R1183 IonicContact OE1-NH2 3.94Å; E1179-R1183 PolarHBondContact OE1-NH2 3.13Å; E1179-R1183 IonicContact OE2-NH2 3.48Å
1184	S	81.5	Confident	88.5	Confident	51 Å²	51	46.4 Å²	46.4	36%	0.357	26%	0.264	S	S	.	.	S	Bend	trans	-124.4	163.7	-178.8	-60.9	0	0	0	0	110.9	R902 S1181 L1182 L1186	R902-S1184 PolarHBondContact NH2-O 2.86Å; R902-S1184 VanDerWaalsContact NH2-O 3.07Å; S1181-S1184 VanDerWaalsContact O-O 3.04Å; L1182-S1184 VanDerWaalsContact C-N 3.31Å; L1182-S1184 PolarHBondContact O-N 2.8Å; S1184-L1186 PolarHBondContact O-N 3.08Å
1185	E	82.1	Confident	88.3	Confident	69 Å²	69	52 Å²	52	32%	0.322	29%	0.291	S	S	.	.			trans	-66	126	166.7	170.2	171.1	-171.8	0	0	109	F1019 A1187 A1188 L1189	F1019-E1185 HydrophobicContact CB-CB 4.14Å; F1019-E1185 HydrophobicContact CB-CG 3.99Å; E1185-A1187 VanDerWaalsContact C-N 3.29Å; E1185-A1187 HydrophobicContact CG-CB 4.42Å; E1185-A1187 PolarHBondContact O-N 3.31Å; E1185-A1188 HydrophobicContact CB-CB 3.89Å; E1185-A1188 HydrophobicContact CG-CB 3.97Å; E1185-A1188 PolarHBondContact O-N 3.34Å; E1185-L1189 PolarHBondContact O-N 3.33Å
1186	L	82	Confident	88.4	Confident	23 Å²	23	51.1 Å²	51.1	12%	0.12	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-62.7	-39.3	-170.3	-173.5	56.3	0	0	0	111.8	A920 I921 F1019 L1020 S1184 A1188 L1189	A920-L1186 HydrophobicContact CB-CD2 4.44Å; I921-L1186 HydrophobicContact CG1-CD2 4.5Å; F1019-L1186 PolarHBondContact O-N 2.95Å; F1019-L1186 VanDerWaalsContact O-N 3.14Å; L1020-L1186 WeakPolarHBondContact O-CD2 3.32Å; S1184-L1186 PolarHBondContact O-N 3.08Å; L1186-A1188 VanDerWaalsContact C-N 3.25Å; L1186-A1188 PolarHBondContact O-N 2.86Å; L1186-L1189 HydrophobicContact CD1-CD1 3.69Å; L1186-L1189 PolarHBondContact O-N 2.87Å
1187	A	79.3	Confident	88.5	Confident	47 Å²	47	49.3 Å²	49.3	39%	0.388	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-70.3	-19.9	177.1	0	0	0	0	0	113.5	E1185	E1185-A1187 VanDerWaalsContact C-N 3.29Å; E1185-A1187 HydrophobicContact CG-CB 4.42Å; E1185-A1187 PolarHBondContact O-N 3.31Å
1188	A	81.8	Confident	88.5	Confident	67 Å²	67	49.8 Å²	49.8	55%	0.554	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-95.8	2.3	-178.1	0	0	0	0	0	113.4	E1185 L1186	E1185-A1188 HydrophobicContact CB-CB 3.89Å; E1185-A1188 HydrophobicContact CG-CB 3.97Å; E1185-A1188 PolarHBondContact O-N 3.34Å; L1186-A1188 VanDerWaalsContact C-N 3.25Å; L1186-A1188 PolarHBondContact O-N 2.86Å
1189	L	86.3	Confident	88.6	Confident	10 Å²	10	53 Å²	53	5%	0.052	29%	0.288	C	S	.	.	S	Bend	trans	-60.3	139.5	178.1	-73.2	-179.4	0	0	0	111.3	E1185 L1186 V1193 Q1194	E1185-L1189 PolarHBondContact O-N 3.33Å; L1186-L1189 HydrophobicContact CD1-CD1 3.69Å; L1186-L1189 PolarHBondContact O-N 2.87Å; L1189-V1193 HydrophobicContact CD1-CG1 4.31Å; L1189-V1193 HydrophobicContact CD2-CG1 4.48Å; L1189-Q1194 HydrophobicContact CB-CG 4.01Å; L1189-Q1194 PolarHBondContact O-NE2 3.37Å
1190	P	88.1	Confident	88.9	Confident	73 Å²	73	49.9 Å²	49.9	47%	0.474	27%	0.274	S	S	.	.			trans	-58.1	147.6	176.5	-21.3	30.4	0	0	0	112.3	S1192 V1193 Q1194	P1190-S1192 VanDerWaalsContact C-N 3.26Å; P1190-S1192 PolarHBondContact O-N 3.38Å; P1190-V1193 HydrophobicContact CB-CG2 4.07Å; P1190-V1193 HydrophobicContact CG-CG2 4.11Å; P1190-V1193 WeakPolarHBondContact O-CB 3.46Å; P1190-V1193 PolarHBondContact O-N 3.44Å; P1190-Q1194 PolarHBondContact O-N 2.93Å
1191	L	88.5	Confident	89.2	Confident	129 Å²	129	45.2 Å²	45.2	68%	0.675	26%	0.256	S	S	*	.	H	α-helix	trans	-55.4	-38	-176.8	-71.5	170.8	0	0	0	113.6	V1193 Q1194 Q1195	L1191-V1193 VanDerWaalsContact C-N 3.3Å; L1191-V1193 PolarHBondContact O-N 2.85Å; L1191-Q1194 PolarHBondContact O-N 2.87Å; L1191-Q1195 VanDerWaalsContact O-CG 3.31Å; L1191-Q1195 WeakPolarHBondContact O-CG 3.45Å; L1191-Q1195 PolarHBondContact O-N 3.47Å
1192	S	89	Confident	89.4	Confident	79 Å²	79	47.2 Å²	47.2	55%	0.552	27%	0.272	S	S	*	.	H	α-helix	trans	-60.4	-39.7	176.6	52	0	0	0	0	112.4	P1190 Q1195 E1196	P1190-S1192 VanDerWaalsContact C-N 3.26Å; P1190-S1192 PolarHBondContact O-N 3.38Å; S1192-Q1195 PolarHBondContact O-N 3.23Å; S1192-E1196 PolarHBondContact O-N 3.2Å
1193	V	90.1	Very high	89.6	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.012	27%	0.273	C	S	.	.	H	α-helix	trans	-70.7	-41.8	177.9	-175.2	0	0	0	0	110.8	L1189 P1190 L1191 Q1195 E1196 H1197	L1189-V1193 HydrophobicContact CD1-CG1 4.31Å; L1189-V1193 HydrophobicContact CD2-CG1 4.48Å; P1190-V1193 HydrophobicContact CB-CG2 4.07Å; P1190-V1193 HydrophobicContact CG-CG2 4.11Å; P1190-V1193 WeakPolarHBondContact O-CB 3.46Å; P1190-V1193 PolarHBondContact O-N 3.44Å; L1191-V1193 VanDerWaalsContact C-N 3.3Å; L1191-V1193 PolarHBondContact O-N 2.85Å; V1193-Q1195 PolarHBondContact O-N 3.32Å; V1193-E1196 WeakPolarHBondContact O-CB 3.4Å; V1193-E1196 PolarHBondContact O-N 2.83Å; V1193-H1197 WeakPolarHBondContact CG1-NE2 3.25Å; V1193-H1197 WeakPolarHBondContact O-CB 3.42Å; V1193-H1197 PolarHBondContact O-CD2 3.11Å; V1193-H1197 VanDerWaalsContact O-CD2 3.24Å; V1193-H1197 VanDerWaalsContact O-CG 3.25Å; V1193-H1197 PolarHBondContact O-N 3.47Å
1194	Q	89.6	Confident	90	Very high	38 Å²	38	42.9 Å²	42.9	18%	0.178	26%	0.256	C	S	.	.	H	α-helix	trans	-62.1	-36.2	176.6	-64.2	-173.1	16.1	0	0	112	R923 L1189 P1190 L1191 G1198	R923-Q1194 PolarHBondContact NH2-O 3.18Å; L1189-Q1194 HydrophobicContact CB-CG 4.01Å; L1189-Q1194 PolarHBondContact O-NE2 3.37Å; P1190-Q1194 PolarHBondContact O-N 2.93Å; L1191-Q1194 PolarHBondContact O-N 2.87Å; Q1194-G1198 PolarHBondContact O-N 3.18Å
1195	Q	92.2	Very high	90.7	Very high	122 Å²	122	40.5 Å²	40.5	57%	0.57	24%	0.24	S	C	*	.	H	α-helix	trans	-68.7	-45.1	174.1	-72.9	173.9	-2.3	0	0	111.9	L1191 S1192 V1193 H1197 G1198 Q1199	L1191-Q1195 VanDerWaalsContact O-CG 3.31Å; L1191-Q1195 WeakPolarHBondContact O-CG 3.45Å; L1191-Q1195 PolarHBondContact O-N 3.47Å; S1192-Q1195 PolarHBondContact O-N 3.23Å; V1193-Q1195 PolarHBondContact O-N 3.32Å; Q1195-H1197 PolarHBondContact O-N 3.01Å; Q1195-G1198 PolarHBondContact O-N 3.44Å; Q1195-Q1199 WeakPolarHBondContact O-CG 3.44Å; Q1195-Q1199 PolarHBondContact O-N 2.89Å
1196	E	93.8	Very high	91.2	Very high	22 Å²	22	40 Å²	40	10%	0.103	24%	0.237	C	C	.	.	H	α-helix	trans	-55	-51.7	172.9	-179.7	-170.2	166.9	0	0	110.8	F390 Y394 R1176 R1180 S1192 V1193 G1198 Q1199 L1200	F390-E1196 HydrophobicContact CE2-CG 4.41Å; F390-E1196 HydrophobicContact CZ-CG 4.14Å; Y394-E1196 HydrophobicContact CD1-CG 3.89Å; Y394-E1196 HydrophobicContact CD2-CG 4.15Å; Y394-E1196 HydrophobicContact CE1-CB 4.14Å; Y394-E1196 HydrophobicContact CE1-CG 3.94Å; Y394-E1196 HydrophobicContact CE2-CB 4.48Å; Y394-E1196 HydrophobicContact CE2-CG 4.16Å; Y394-E1196 HydrophobicContact CG-CG 4Å; R1176-E1196 IonicContact NH2-OE1 3.59Å; R1180-E1196 IonicContact NH1-OE2 3.65Å; R1180-E1196 PolarHBondContact NH1-OE2 2.89Å; S1192-E1196 PolarHBondContact O-N 3.2Å; V1193-E1196 WeakPolarHBondContact O-CB 3.4Å; V1193-E1196 PolarHBondContact O-N 2.83Å; E1196-G1198 VanDerWaalsContact C-N 3.32Å; E1196-G1198 PolarHBondContact O-N 2.87Å; E1196-Q1199 PolarHBondContact O-N 3.26Å; E1196-L1200 WeakPolarHBondContact O-CB 3.36Å; E1196-L1200 PolarHBondContact O-N 3.44Å
1197	H	94.3	Very high	91.7	Very high	5 Å²	5	39.1 Å²	39.1	2%	0.023	23%	0.233	C	C	.	.	H	α-helix	trans	-61.5	-40.1	178.8	-67.3	-167.9	0	0	0	111.6	M1177 S1181 V1193 Q1195 L1200 L1201	M1177-H1197 HydrophobicContact CG-CB 4.26Å; M1177-H1197 HydrophobicContact SD-CB 4.08Å; S1181-H1197 PolarHBondContact OG-CE1 3.3Å; V1193-H1197 WeakPolarHBondContact CG1-NE2 3.25Å; V1193-H1197 WeakPolarHBondContact O-CB 3.42Å; V1193-H1197 PolarHBondContact O-CD2 3.11Å; V1193-H1197 VanDerWaalsContact O-CD2 3.24Å; V1193-H1197 VanDerWaalsContact O-CG 3.25Å; V1193-H1197 PolarHBondContact O-N 3.47Å; Q1195-H1197 PolarHBondContact O-N 3.01Å; H1197-L1200 PolarHBondContact O-N 3.37Å; H1197-L1201 WeakPolarHBondContact O-CB 3.47Å; H1197-L1201 VanDerWaalsContact O-CG 3.27Å; H1197-L1201 WeakPolarHBondContact O-CG 3.47Å; H1197-L1201 PolarHBondContact O-N 2.86Å
1198	G	94.4	Very high	92.3	Very high	13 Å²	13	37 Å²	37	13%	0.134	22%	0.215	C	C	.	.	H	α-helix	trans	-63.2	-43.5	176.8	0	0	0	0	0	112.9	Y1037 Q1194 Q1195 E1196 L1200 L1201 A1202	Y1037-G1198 PolarHBondContact OH-O 3.43Å; Q1194-G1198 PolarHBondContact O-N 3.18Å; Q1195-G1198 PolarHBondContact O-N 3.44Å; E1196-G1198 VanDerWaalsContact C-N 3.32Å; E1196-G1198 PolarHBondContact O-N 2.87Å; G1198-L1200 VanDerWaalsContact C-N 3.34Å; G1198-L1200 PolarHBondContact O-N 3.25Å; G1198-L1201 PolarHBondContact O-N 3.46Å; G1198-A1202 WeakPolarHBondContact O-CB 3.39Å; G1198-A1202 PolarHBondContact O-N 3.11Å
1199	Q	96	Very high	92.5	Very high	91 Å²	91	41.2 Å²	41.2	43%	0.425	22%	0.217	S	C	.	.	H	α-helix	trans	-63	-42.3	175.2	-69.5	176.6	30.1	0	0	111.5	F390 Q1195 E1196 A1202 L1203	F390-Q1199 HydrophobicContact CD2-CB 4.07Å; F390-Q1199 HydrophobicContact CE2-CB 3.93Å; Q1195-Q1199 WeakPolarHBondContact O-CG 3.44Å; Q1195-Q1199 PolarHBondContact O-N 2.89Å; E1196-Q1199 PolarHBondContact O-N 3.26Å; Q1199-A1202 PolarHBondContact O-N 2.97Å; Q1199-L1203 WeakPolarHBondContact O-CG 3.27Å; Q1199-L1203 PolarHBondContact O-N 3.29Å; Q1199-L1203 VanDerWaalsContact O-N 3.14Å
1200	L	96.4	Very high	91.7	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-62.8	-46.2	178.4	-178.4	55.6	0	0	0	112.2	F390 F1170 A1173 L1174 M1177 E1196 H1197 G1198 L1203 L1204	F390-L1200 HydrophobicContact CD1-CD1 4.37Å; F390-L1200 HydrophobicContact CE1-CB 4.34Å; F390-L1200 HydrophobicContact CE1-CD1 3.79Å; F390-L1200 HydrophobicContact CE1-CG 4.47Å; F390-L1200 HydrophobicContact CE2-CB 4.1Å; F390-L1200 HydrophobicContact CZ-CB 3.73Å; F390-L1200 HydrophobicContact CZ-CD1 4.07Å; F390-L1200 HydrophobicContact CZ-CD2 4.43Å; F390-L1200 HydrophobicContact CZ-CG 4.29Å; F1170-L1200 HydrophobicContact CD2-CD1 3.83Å; F1170-L1200 HydrophobicContact CE2-CD1 3.26Å; F1170-L1200 HydrophobicContact CZ-CD1 3.74Å; A1173-L1200 HydrophobicContact CB-CD1 4.19Å; A1173-L1200 HydrophobicContact CB-CD2 4.17Å; L1174-L1200 HydrophobicContact CD2-CD1 4Å; L1174-L1200 HydrophobicContact CD2-CD2 3.88Å; L1174-L1200 HydrophobicContact CD2-CG 3.7Å; L1174-L1200 HydrophobicContact CG-CD1 4.38Å; L1174-L1200 HydrophobicContact CG-CD2 4.46Å; L1174-L1200 HydrophobicContact CG-CG 4.49Å; M1177-L1200 HydrophobicContact CB-CD2 3.98Å; M1177-L1200 HydrophobicContact CG-CD2 4.48Å; M1177-L1200 HydrophobicContact SD-CD2 3.94Å; M1177-L1200 HydrophobicContact SD-CG 4.48Å; E1196-L1200 WeakPolarHBondContact O-CB 3.36Å; E1196-L1200 PolarHBondContact O-N 3.44Å; H1197-L1200 PolarHBondContact O-N 3.37Å; G1198-L1200 VanDerWaalsContact C-N 3.34Å; G1198-L1200 PolarHBondContact O-N 3.25Å; L1200-L1203 PolarHBondContact O-N 3.45Å; L1200-L1204 PolarHBondContact O-N 3.02Å
1201	L	97	Very high	90.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.1	-37	178	-69.4	174.4	0	0	0	112.3	F922 R923 Y1037 M1177 H1197 G1198 L1203 L1204 A1205	F922-L1201 HydrophobicContact CB-CD2 4.44Å; F922-L1201 HydrophobicContact CD1-CD2 3.52Å; F922-L1201 HydrophobicContact CE1-CD2 4.19Å; F922-L1201 HydrophobicContact CG-CD2 4.37Å; R923-L1201 HydrophobicContact CB-CD1 4.29Å; R923-L1201 HydrophobicContact CG-CD1 3.84Å; Y1037-L1201 HydrophobicContact CD2-CB 4.07Å; Y1037-L1201 HydrophobicContact CD2-CD1 4.3Å; Y1037-L1201 HydrophobicContact CE2-CB 3.38Å; Y1037-L1201 HydrophobicContact CE2-CD1 3.96Å; Y1037-L1201 HydrophobicContact CE2-CG 4.29Å; M1177-L1201 HydrophobicContact CE-CD2 3.78Å; M1177-L1201 HydrophobicContact CE-CG 4.4Å; M1177-L1201 HydrophobicContact SD-CD2 4.1Å; M1177-L1201 HydrophobicContact SD-CG 4.07Å; H1197-L1201 WeakPolarHBondContact O-CB 3.47Å; H1197-L1201 VanDerWaalsContact O-CG 3.27Å; H1197-L1201 WeakPolarHBondContact O-CG 3.47Å; H1197-L1201 PolarHBondContact O-N 2.86Å; G1198-L1201 PolarHBondContact O-N 3.46Å; L1201-L1203 VanDerWaalsContact C-N 3.31Å; L1201-L1203 PolarHBondContact O-N 3.43Å; L1201-L1204 HydrophobicContact CD2-CD2 4.35Å; L1201-L1204 PolarHBondContact O-N 2.71Å; L1201-A1205 WeakPolarHBondContact O-CB 2.84Å; L1201-A1205 PolarHBondContact O-N 2.79Å
1202	A	96.2	Very high	88.6	Confident	42 Å²	42	38.7 Å²	38.7	35%	0.347	21%	0.212	S	C	.	.	H	α-helix	trans	-60.3	-41.6	174.4	0	0	0	0	0	111.8	Y1037 G1198 Q1199 E1206	Y1037-A1202 WeakPolarHBondContact OH-CA 3.45Å; Y1037-A1202 PolarHBondContact OH-N 3.07Å; G1198-A1202 WeakPolarHBondContact O-CB 3.39Å; G1198-A1202 PolarHBondContact O-N 3.11Å; Q1199-A1202 PolarHBondContact O-N 2.97Å; A1202-E1206 WeakPolarHBondContact O-CB 3.28Å; A1202-E1206 PolarHBondContact O-N 2.78Å
1203	L	95.9	Very high	86.7	Confident	17 Å²	17	36.3 Å²	36.3	9%	0.089	20%	0.2	C	C	.	.	H	α-helix	trans	-66.4	-39.9	174.8	-67.9	174.2	0	0	0	112.3	K386 I387 F390 F1170 Q1199 L1200 L1201 E1206 L1207	K386-L1203 HydrophobicContact CB-CD2 3.54Å; K386-L1203 HydrophobicContact CD-CD2 4.07Å; K386-L1203 HydrophobicContact CG-CD2 4.42Å; I387-L1203 HydrophobicContact CG1-CD1 4.46Å; F390-L1203 HydrophobicContact CB-CD1 3.63Å; F390-L1203 HydrophobicContact CD2-CD1 4.21Å; F390-L1203 HydrophobicContact CG-CD1 3.88Å; F1170-L1203 HydrophobicContact CE2-CB 3.95Å; F1170-L1203 HydrophobicContact CE2-CD1 4.3Å; F1170-L1203 HydrophobicContact CZ-CB 3.93Å; Q1199-L1203 WeakPolarHBondContact O-CG 3.27Å; Q1199-L1203 PolarHBondContact O-N 3.29Å; Q1199-L1203 VanDerWaalsContact O-N 3.14Å; L1200-L1203 PolarHBondContact O-N 3.45Å; L1201-L1203 VanDerWaalsContact C-N 3.31Å; L1201-L1203 PolarHBondContact O-N 3.43Å; L1203-E1206 PolarHBondContact O-N 3.11Å; L1203-L1207 VanDerWaalsContact O-CB 3.24Å; L1203-L1207 WeakPolarHBondContact O-CB 3.3Å; L1203-L1207 PolarHBondContact O-N 3.5Å
1204	L	96.3	Very high	84.7	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.9	-46.7	176.2	175.5	64	0	0	0	111.1	F922 L1043 L1130 L1131 F1170 L1174 L1200 L1201 L1207 L1208	F922-L1204 HydrophobicContact CD1-CD2 3.91Å; F922-L1204 HydrophobicContact CE1-CD2 3.81Å; L1043-L1204 HydrophobicContact CD1-CD2 3.6Å; L1043-L1204 HydrophobicContact CD1-CG 4.15Å; L1130-L1204 HydrophobicContact CD1-CD1 3.97Å; L1131-L1204 HydrophobicContact CD2-CD2 3.95Å; F1170-L1204 HydrophobicContact CE1-CB 4.19Å; F1170-L1204 HydrophobicContact CE1-CD1 4.16Å; F1170-L1204 HydrophobicContact CZ-CB 4.08Å; L1174-L1204 HydrophobicContact CD1-CD1 4.25Å; L1174-L1204 HydrophobicContact CD1-CD2 4.42Å; L1174-L1204 HydrophobicContact CD2-CD2 4.1Å; L1200-L1204 PolarHBondContact O-N 3.02Å; L1201-L1204 HydrophobicContact CD2-CD2 4.35Å; L1201-L1204 PolarHBondContact O-N 2.71Å; L1204-L1207 PolarHBondContact O-N 3.23Å; L1204-L1208 HydrophobicContact CD1-CD1 4.03Å; L1204-L1208 HydrophobicContact CD1-CG 4.14Å; L1204-L1208 HydrophobicContact CG-CD1 4.21Å; L1204-L1208 WeakPolarHBondContact O-CG 3.34Å; L1204-L1208 PolarHBondContact O-N 3.22Å
1205	A	94.7	Very high	82.8	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.008	20%	0.204	C	C	.	.	H	α-helix	trans	-60.3	-47.2	176.4	0	0	0	0	0	111.2	Y1037 E1040 L1201 L1207 L1208 R1209	Y1037-A1205 HydrophobicContact CD1-CB 4.08Å; Y1037-A1205 HydrophobicContact CE1-CB 4.2Å; E1040-A1205 HydrophobicContact CG-CB 4.12Å; L1201-A1205 WeakPolarHBondContact O-CB 2.84Å; L1201-A1205 PolarHBondContact O-N 2.79Å; A1205-L1207 VanDerWaalsContact C-N 3.31Å; A1205-L1207 PolarHBondContact O-N 2.81Å; A1205-L1208 PolarHBondContact O-N 2.87Å; A1205-R1209 WeakPolarHBondContact O-CG 3.45Å; A1205-R1209 PolarHBondContact O-N 3.01Å
1206	E	93.2	Very high	80.8	Confident	57 Å²	57	33.2 Å²	33.2	27%	0.266	19%	0.191	S	C	.	.	H	α-helix	trans	-59.9	-40.5	176.6	-168.9	178.1	169.1	0	0	112.1	I383 K386 A1202 L1203 R1209	I383-E1206 HydrophobicContact CD1-CG 4Å; I383-E1206 HydrophobicContact CG1-CG 4.16Å; K386-E1206 IonicContact NZ-OE1 2.7Å; K386-E1206 PolarHBondContact NZ-OE1 2.92Å; K386-E1206 IonicContact NZ-OE2 3.08Å; K386-E1206 PolarHBondContact NZ-OE2 2.97Å; A1202-E1206 WeakPolarHBondContact O-CB 3.28Å; A1202-E1206 PolarHBondContact O-N 2.78Å; L1203-E1206 PolarHBondContact O-N 3.11Å; E1206-R1209 PolarHBondContact O-N 2.9Å
1207	L	92.4	Very high	78.6	Confident	5 Å²	5	33 Å²	33	3%	0.026	19%	0.19	C	C	.	.	H	α-helix	trans	-64.6	-39.4	177.4	-177.5	64.6	0	0	0	112.4	V379 I383 I387 L1126 L1130 L1167 F1170 L1203 L1204 A1205 G1210	V379-L1207 HydrophobicContact CB-CD1 4.44Å; V379-L1207 HydrophobicContact CG1-CD1 3.49Å; V379-L1207 VanDerWaalsContact CG1-CD1 3.49Å; V379-L1207 HydrophobicContact CG2-CD1 4.08Å; I383-L1207 HydrophobicContact CG2-CB 4.41Å; I383-L1207 HydrophobicContact CG2-CD1 4.11Å; I387-L1207 HydrophobicContact CD1-CD2 4.4Å; L1126-L1207 HydrophobicContact CD1-CD1 3.8Å; L1126-L1207 HydrophobicContact CD1-CD2 4.25Å; L1126-L1207 HydrophobicContact CD1-CG 3.81Å; L1130-L1207 HydrophobicContact CD1-CD2 3.51Å; L1167-L1207 HydrophobicContact CD2-CD2 3.95Å; F1170-L1207 HydrophobicContact CD1-CD2 4.43Å; F1170-L1207 HydrophobicContact CE1-CD2 4.22Å; L1203-L1207 VanDerWaalsContact O-CB 3.24Å; L1203-L1207 WeakPolarHBondContact O-CB 3.3Å; L1203-L1207 PolarHBondContact O-N 3.5Å; L1204-L1207 PolarHBondContact O-N 3.23Å; A1205-L1207 VanDerWaalsContact C-N 3.31Å; A1205-L1207 PolarHBondContact O-N 2.81Å; L1207-G1210 PolarHBondContact O-N 2.93Å
1208	L	91.9	Very high	76.1	Confident	4 Å²	4	38.4 Å²	38.4	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-78.6	-21.9	-180	-65.7	-179.4	0	0	0	113.6	E1042 L1043 H1124 L1126 A1127 L1204 A1205 G1210	E1042-L1208 HydrophobicContact CB-CB 3.94Å; L1043-L1208 HydrophobicContact CB-CD1 4.21Å; L1043-L1208 HydrophobicContact CD1-CD1 4.19Å; H1124-L1208 HydrophobicContact CB-CD2 4.23Å; L1126-L1208 HydrophobicContact CB-CD2 4.08Å; A1127-L1208 HydrophobicContact CB-CD1 4.3Å; A1127-L1208 HydrophobicContact CB-CD2 3.88Å; L1204-L1208 HydrophobicContact CD1-CD1 4.03Å; L1204-L1208 HydrophobicContact CD1-CG 4.14Å; L1204-L1208 HydrophobicContact CG-CD1 4.21Å; L1204-L1208 WeakPolarHBondContact O-CG 3.34Å; L1204-L1208 PolarHBondContact O-N 3.22Å; A1205-L1208 PolarHBondContact O-N 2.87Å; L1208-G1210 PolarHBondContact O-N 3.01Å
1209	R	85.4	Confident	73.6	Confident	155 Å²	155	44 Å²	44	59%	0.585	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-16.7	171.3	-72.8	-175.9	-151.4	139.8	-2.1	113.6	E1040 A1205 E1206	E1040-R1209 IonicContact OE1-CZ 3.08Å; E1040-R1209 IonicContact OE1-NE 3.88Å; E1040-R1209 PolarHBondContact OE1-NE 2.76Å; E1040-R1209 IonicContact OE1-NH2 3.48Å; E1040-R1209 PolarHBondContact OE1-NH2 2.78Å; E1040-R1209 IonicContact OE2-CZ 2.68Å; E1040-R1209 IonicContact OE2-NE 2.85Å; E1040-R1209 PolarHBondContact OE2-NE 2.84Å; E1040-R1209 IonicContact OE2-NH2 3.62Å; A1205-R1209 WeakPolarHBondContact O-CG 3.45Å; A1205-R1209 PolarHBondContact O-N 3.01Å; E1206-R1209 PolarHBondContact O-N 2.9Å
1210	G	70.1	Confident	70.9	Confident	19 Å²	19	42.3 Å²	42.3	20%	0.196	23%	0.227	C	C	.	.	S	Bend	trans	-53.3	147.6	179.3	0	0	0	0	0	111.8	L1207 L1208 C1212	L1207-G1210 PolarHBondContact O-N 2.93Å; L1208-G1210 PolarHBondContact O-N 3.01Å; G1210-C1212 PolarHBondContact O-N 2.83Å; G1210-C1212 VanDerWaalsContact O-N 3.16Å
1211	P	58.7	Low	68.1	Low	109 Å²	109	45.2 Å²	45.2	71%	0.708	25%	0.251	S	S	*	.			trans	-60	125.5	-178.2	23.1	-31.7	0	0	0	110.2	G1213	P1211-G1213 PolarHBondContact O-N 2.85Å
1212	C	52.2	Low	64.8	Low	31 Å²	31	52.4 Å²	52.4	21%	0.209	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-62.3	3.9	167.4	-120.1	0	0	0	0	112.7	H1124 G1210 S1214 F1215 D1216	H1124-C1212 PolarHBondContact CD2-SG 3.26Å; G1210-C1212 PolarHBondContact O-N 2.83Å; G1210-C1212 VanDerWaalsContact O-N 3.16Å; C1212-S1214 PolarHBondContact O-N 2.88Å; C1212-S1214 VanDerWaalsContact O-N 3.08Å; C1212-F1215 WeakPolarHBondContact O-CA 3.22Å; C1212-F1215 WeakPolarHBondContact O-CB 3.07Å; C1212-F1215 PolarHBondContact O-N 2.79Å; C1212-D1216 PolarHBondContact O-N 3.14Å
1213	G	49.4	Very low	61.6	Low	28 Å²	28	59.7 Å²	59.7	29%	0.289	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-65.7	-11.5	-167.7	0	0	0	0	0	115.5	P1211 K1219	P1211-G1213 PolarHBondContact O-N 2.85Å; G1213-K1219 VanDerWaalsContact O-CD 3.29Å; G1213-K1219 WeakPolarHBondContact O-CD 3.48Å; G1213-K1219 VanDerWaalsContact O-CE 3.28Å; G1213-K1219 WeakPolarHBondContact O-CE 3.1Å; G1213-K1219 PolarHBondContact O-NZ 2.9Å
1214	S	48.4	Very low	59.9	Low	35 Å²	35	61.8 Å²	61.8	25%	0.245	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-82.9	-12.5	166.4	54.2	0	0	0	0	113.1	C1212	C1212-S1214 PolarHBondContact O-N 2.88Å; C1212-S1214 VanDerWaalsContact O-N 3.08Å
1215	F	51	Low	58	Low	7 Å²	7	65.1 Å²	65.1	3%	0.031	35%	0.351	C	S	.	.	S	Bend	trans	-110.5	-2.2	-173.7	-51.2	-76.1	0	0	0	113.8	C375 T376 I377 P1125 L1157 C1212 M1217	C375-F1215 WeakPolarHBondContact SG-CD1 3.25Å; T376-F1215 WeakPolarHBondContact O-CE1 3.47Å; I377-F1215 HydrophobicContact CB-CZ 4.33Å; I377-F1215 HydrophobicContact CG2-CE1 3.79Å; I377-F1215 HydrophobicContact CG2-CZ 3.77Å; P1125-F1215 HydrophobicContact CB-CD1 4.35Å; P1125-F1215 HydrophobicContact CB-CE1 4.3Å; P1125-F1215 HydrophobicContact CG-CB 4.4Å; P1125-F1215 HydrophobicContact CG-CD1 3.56Å; P1125-F1215 HydrophobicContact CG-CD2 3.75Å; P1125-F1215 HydrophobicContact CG-CE1 3.68Å; P1125-F1215 HydrophobicContact CG-CE2 3.84Å; P1125-F1215 HydrophobicContact CG-CG 3.63Å; P1125-F1215 HydrophobicContact CG-CZ 3.83Å; L1157-F1215 HydrophobicContact CD2-CE1 4.47Å; C1212-F1215 WeakPolarHBondContact O-CA 3.22Å; C1212-F1215 WeakPolarHBondContact O-CB 3.07Å; C1212-F1215 PolarHBondContact O-N 2.79Å; F1215-M1217 PolarHBondContact O-N 2.7Å
1216	D	49.9	Very low	55.9	Low	56 Å²	56	68.6 Å²	68.6	30%	0.299	37%	0.371	S	S	.	.			trans	-65	123.7	177.3	-169.3	-20	0	0	0	110.4	C1212 R1218 K1219	C1212-D1216 PolarHBondContact O-N 3.14Å; D1216-R1218 PolarHBondContact O-N 3.39Å; D1216-R1218 PolarHBondContact OD1-N 3.4Å; D1216-K1219 PolarHBondContact O-N 3.18Å; D1216-K1219 VanDerWaalsContact O-N 3.1Å
1217	M	47.5	Very low	53.7	Low	17 Å²	17	69.3 Å²	69.3	8%	0.084	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-22.1	-179.5	-84.6	-86.2	-134.6	0	0	114.1	V1059 Q1061 R1101 F1215 T1220	V1059-M1217 HydrophobicContact CB-CE 4.18Å; V1059-M1217 HydrophobicContact CG1-CE 3.58Å; Q1061-M1217 HydrophobicContact CG-CE 3.69Å; Q1061-M1217 HydrophobicContact CG-SD 3.82Å; Q1061-M1217 PolarHBondContact NE2-SD 2.91Å; R1101-M1217 HydrophobicContact CG-CE 4.16Å; R1101-M1217 HydrophobicContact CG-CG 3.91Å; R1101-M1217 HydrophobicContact CG-SD 3.97Å; R1101-M1217 PolarHBondContact NE-SD 3Å; R1101-M1217 VanDerWaalsContact NE-SD 3.38Å; F1215-M1217 PolarHBondContact O-N 2.7Å; M1217-T1220 PolarHBondContact O-OG1 3.18Å; M1217-T1220 VanDerWaalsContact O-OG1 3.11Å
1218	R	42.1	Very low	51.3	Low	119 Å²	119	73.3 Å²	73.3	45%	0.449	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-33.7	178.1	-67.2	-174.2	-172.3	-153.2	-4.5	114	R1097 D1216 T1220 A1221 D1222	R1097-R1218 VanDerWaalsContact NE-NH2 3.17Å; D1216-R1218 PolarHBondContact O-N 3.39Å; D1216-R1218 PolarHBondContact OD1-N 3.4Å; R1218-T1220 PolarHBondContact O-N 3.33Å; R1218-A1221 PolarHBondContact O-N 2.69Å; R1218-A1221 VanDerWaalsContact O-N 3.13Å; R1218-D1222 PolarHBondContact O-N 3.32Å
1219	K	41.1	Very low	48.6	Very low	131 Å²	131	77.9 Å²	77.9	57%	0.57	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-22.2	-179.6	-76.4	-165.2	-174.3	168.7	0	113.1	G1213 D1216	G1213-K1219 VanDerWaalsContact O-CD 3.29Å; G1213-K1219 WeakPolarHBondContact O-CD 3.48Å; G1213-K1219 VanDerWaalsContact O-CE 3.28Å; G1213-K1219 WeakPolarHBondContact O-CE 3.1Å; G1213-K1219 PolarHBondContact O-NZ 2.9Å; D1216-K1219 PolarHBondContact O-N 3.18Å; D1216-K1219 VanDerWaalsContact O-N 3.1Å
1220	T	40.3	Very low	46	Very low	55 Å²	55	72.4 Å²	72.4	34%	0.337	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	1	177.9	54.1	0	0	0	0	114.5	R1101 M1217 R1218	R1101-T1220 PolarHBondContact NH2-OG1 3.42Å; M1217-T1220 PolarHBondContact O-OG1 3.18Å; M1217-T1220 VanDerWaalsContact O-OG1 3.11Å; R1218-T1220 PolarHBondContact O-N 3.33Å
1221	A	35.6	Very low	44.1	Very low	61 Å²	61	76.5 Å²	76.5	50%	0.504	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-23.1	-177.6	0	0	0	0	0	113.5	R1218	R1218-A1221 PolarHBondContact O-N 2.69Å; R1218-A1221 VanDerWaalsContact O-N 3.13Å
1222	D	29.4	Very low	42.9	Very low	151 Å²	151	73.8 Å²	73.8	81%	0.807	41%	0.406	S	S	*	.			trans	-86.2	-15.7	171.5	-75.5	-22.7	0	0	0	112.7	R1218	R1218-D1222 PolarHBondContact O-N 3.32Å
1223	D	28	Very low	42.1	Very low	195 Å²	195	77.7 Å²	77.7	100%	1.043	42%	0.423	S	S	*	.			trans	-96.4	0	167.4	-74.8	-11.8	0	0	0	110

Retrieved 1,223 of 1,223 residues in 1382.4 ms (Link to these results)

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