A0A077YWZ6_TRITR Loading...

EGF domain containing protein

AlphaFold DB , UniProt , Accession A0A077YWZ6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,054 aa.

						>A0A077YWZ6_TRITR|A0A077YWZ6
MRSTHAFLFVVCYVFAINHGTALECPEKWESHGWTTFKYLNDCVSLVAMNEIEKCTREKSETVYETGKNFSIDCIEEYCQDNFPFGYFWTWKPDQLEEKRIVNLTDWKKVLHGRLFLCLQSENILCYTEKPSHSLKVQAPYAGDCPTYFHVFTQSTYNQERRLTRKCTNFHVPIFEGMTIRQYVCHILDKQDDQLYITGVNHCSQLKDDFFTCGHDGAFPCDRNRTFACNFNHDLNHCVSYYYEKAPPDREKYQRCTFDYGSTCNCTCTDDYTQWTSWSSTCKPSTRIRIAPIIQPNDELSPVHCSFENITQCCVQTETNPSSELEECTNYIYGTNISLVKYNCSQPGAPHNCLSKPCMNGGTCSSDGLYYFCDCKPGFKGFQCEQQVKYCENDTCSPNGECQNVTALMTYRCHCRTPYAGRHCEHAHEYCKADSCSGHGACLNLSTGKIKCICYIGFVGQFCGFNLYALIAPFCLCAAFLGGLVLLRSPREPLVGIVHGVSTVLSLSKPKEKQGVYVYGRAGKVPVSEIQHCKAVTSNQKLGYGQEYMIECVDKYCEDTFPVGYFWSWIPDFDEEGRVEQSVPKDVWEKTMYGFAILCTGPNVSCVSLRSNRSIIIQGRHPETYDKCKPLPRRIKTFEYYRRNCSAFRRGFLLDDVDKHYLCLLVILEERSLWFTKANYCIGWNYTLVSCGHEGTYPCERNRTFGCNFNHDLNRCVSYYYTKAAPDREKYQRCTFDYGSTCNCSCSDSYTQWTSWSSTCKPSTRMRIAPIIQPNDELSPVHCSFENKTQCCAQTETNPSSELEECTNYVYGTNISLVNHNCSKPGGRRVVDEKGHFKCQCAEGYEGMFCEKTPHDCLSKPCMNGGTCSSDGLYYLCDCKPGFKGFQCEQQVKYCENDTCSPNGECQNVTALMTYRCHCRTPYAGRHCEHAHEYCKADSCSGHGACLNLSTGKIKCICYIGFVGQFCGFNLYVLIAPICLCSAFLGVYLLLRKSRKGKRKTTTTSRMSSHSLNKHDAKRKSSGKSPLPVTKKPPSHDYELPALPEETKAEKLKK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.9	Very low	30	Very low	242 Å²	242	157.2 Å²	157.2	100%	1.192	81%	0.806	S	S	*	*				0	166.2	0	-75.9	175.5	168.8	0	0	108.6
2	R	28.8	Very low	29.6	Very low	245 Å²	245	151.8 Å²	151.8	93%	0.925	79%	0.791	S	S	*	*			trans	-13.2	148.2	168.1	-59.4	173.3	-177.9	170.9	-1	117.5
3	S	30.7	Very low	29.5	Very low	101 Å²	101	158.1 Å²	158.1	71%	0.706	80%	0.801	S	S	*	*			cis	-168.7	-175.7	-11.1	57.8	0	0	0	0	106.8
4	T	32.7	Very low	29.2	Very low	109 Å²	109	154.1 Å²	154.1	67%	0.669	79%	0.788	S	S	*	*			cis	-155.1	131.7	11.3	-12.9	0	0	0	0	105.9
5	H	32.7	Very low	29.1	Very low	181 Å²	181	156.5 Å²	156.5	84%	0.838	79%	0.791	S	S	*	*				48.5	146.1	106.9	-67.6	-139	0	0	0	117.4
6	A	28.6	Very low	29.1	Very low	78 Å²	78	151.9 Å²	151.9	65%	0.645	78%	0.784	S	S	*	*			cis	174.7	139.8	-25.3	0	0	0	0	0	107.1
7	F	31.5	Very low	29.2	Very low	205 Å²	205	150.8 Å²	150.8	90%	0.899	78%	0.778	S	S	*	*			trans	-153	129.8	151.1	-111.5	-73.8	0	0	0	111.1
8	L	26.4	Very low	29.1	Very low	146 Å²	146	149.4 Å²	149.4	76%	0.764	77%	0.772	S	S	*	*			trans	-100.2	145.6	172.1	-80.8	154.3	0	0	0	108.7
9	F	29.8	Very low	29.2	Very low	194 Å²	194	151.4 Å²	151.4	85%	0.851	78%	0.777	S	S	*	*			trans	-130.5	120.7	148.2	-108.6	-84.1	0	0	0	109.2
10	V	26.3	Very low	29	Very low	103 Å²	103	147.3 Å²	147.3	62%	0.624	77%	0.774	S	S	*	*			trans	-111	125.2	174.5	173.1	0	0	0	0	107
11	V	30.2	Very low	29.1	Very low	125 Å²	125	147.1 Å²	147.1	76%	0.758	78%	0.779	S	S	*	*			trans	-130	108.7	160.9	-178.9	0	0	0	0	107.2
12	C	25.7	Very low	28.8	Very low	92 Å²	92	140.3 Å²	140.3	62%	0.622	76%	0.761	S	S	*	*			trans	-79.4	144.5	171.1	-58.3	0	0	0	0	109.6	V14	C12-V14 HydrophobicContact CB-CG2 4.4Å
13	Y	28.1	Very low	28.8	Very low	234 Å²	234	136.9 Å²	136.9	92%	0.918	76%	0.76	S	S	*	*			trans	-130.2	147	142.1	-111.7	-88.8	0	0	0	109.6
14	V	25.6	Very low	28.6	Very low	102 Å²	102	141.1 Å²	141.1	62%	0.618	77%	0.769	S	S	*	*			trans	-134.3	170	-164.9	179.5	0	0	0	0	108.2	C12	C12-V14 HydrophobicContact CB-CG2 4.4Å
15	F	27.8	Very low	28.2	Very low	191 Å²	191	141.8 Å²	141.8	84%	0.838	78%	0.777	S	S	*	*			trans	80.6	141.3	-178.7	-60.3	-86.7	0	0	0	114.3
16	A	29.3	Very low	28	Very low	82 Å²	82	139.4 Å²	139.4	68%	0.678	78%	0.777	S	S	*	*			cis	-144.6	132.9	-4.4	0	0	0	0	0	109.9
17	I	30.1	Very low	27.9	Very low	134 Å²	134	143.8 Å²	143.8	69%	0.687	78%	0.784	S	S	*	*				67.1	105.9	100.2	-56.9	171.8	0	0	0	115.8
18	N	27	Very low	27.6	Very low	125 Å²	125	142.5 Å²	142.5	67%	0.668	78%	0.778	S	S	*	*			trans	42.4	143.1	140.9	-50.1	-7.1	0	0	0	123.6
19	H	31.1	Very low	27.7	Very low	187 Å²	187	147.9 Å²	147.9	87%	0.866	79%	0.789	S	S	*	*			trans	71.6	147.8	163.6	-46	-67.8	0	0	0	116
20	G	25.5	Very low	27.5	Very low	69 Å²	69	147.3 Å²	147.3	71%	0.711	79%	0.789	S	S	*	*			cis	153.1	23.1	-5.7	0	0	0	0	0	117.5
21	T	31.5	Very low	27.3	Very low	145 Å²	145	147.3 Å²	147.3	89%	0.89	79%	0.793	S	S	*	*			trans	-151.8	161.2	177.1	26.3	0	0	0	0	110.9
22	A	25.4	Very low	27	Very low	98 Å²	98	150.7 Å²	150.7	81%	0.81	80%	0.8	S	S	*	*			trans	-108.2	152.1	172.6	0	0	0	0	0	110.9
23	L	29	Very low	26.9	Very low	173 Å²	173	149.2 Å²	149.2	91%	0.906	80%	0.801	S	S	*	*			trans	-158.3	158.7	173.4	-105	152.1	0	0	0	109.2
24	E	27.3	Very low	26.7	Very low	191 Å²	191	150.4 Å²	150.4	89%	0.893	80%	0.804	S	S	*	*			trans	-102.6	179.7	-162.5	-64.5	178.9	124.6	0	0	114.7
25	C	23	Very low	26.7	Very low	123 Å²	123	152.2 Å²	152.2	83%	0.831	82%	0.815	S	S	*	*			trans	-74	170.3	-165.1	-50.3	0	0	0	0	115.8
26	P	28.4	Very low	26.7	Very low	130 Å²	130	149.2 Å²	149.2	84%	0.844	81%	0.813	S	S	*	*			trans	-124	154.6	132.4	36.6	-29.9	0	0	0	113
27	E	26.7	Very low	26.5	Very low	170 Å²	170	153.9 Å²	153.9	79%	0.794	82%	0.819	S	S	*	*			trans	-91.4	169.4	175.8	-60.3	-172.8	136.2	0	0	113.4
28	K	26.4	Very low	26.3	Very low	178 Å²	178	156.6 Å²	156.6	77%	0.774	83%	0.825	S	S	*	*			trans	72.8	109.3	165.2	-54.4	176.2	-174.1	177.3	0	116.2
29	W	27.5	Very low	26.2	Very low	260 Å²	260	161.4 Å²	161.4	99%	0.985	84%	0.836	S	S	*	*				-160.1	168.4	110.4	-105.6	40.1	0	0	0	108.2
30	E	24.8	Very low	25.9	Very low	181 Å²	181	156 Å²	156	85%	0.846	81%	0.813	S	S	*	*			trans	-101.4	156.8	-156.6	-62.6	179.6	128.2	0	0	115.8
31	S	24	Very low	25.9	Very low	104 Å²	104	160.6 Å²	160.6	73%	0.727	82%	0.821	S	S	*	*	S	Bend	trans	76.6	141.2	166.9	81.3	0	0	0	0	119.1
32	H	23	Very low	25.6	Very low	195 Å²	195	159.1 Å²	159.1	90%	0.903	81%	0.808	S	S	*	*			trans	52	67.1	166.7	-56	-74	0	0	0	118.6
33	G	24.2	Very low	25.7	Very low	62 Å²	62	159.8 Å²	159.8	64%	0.639	81%	0.805	S	S	*	*			trans	-152.1	104.2	175.6	0	0	0	0	0	116.7	T35	G33-T35 PolarHBondContact O-N 3.44Å
34	W	24	Very low	25.6	Very low	258 Å²	258	154.4 Å²	154.4	98%	0.977	78%	0.779	S	S	*	*			trans	-5.3	99.3	154.7	-60.4	80.6	0	0	0	118.6
35	T	24.8	Very low	25.6	Very low	140 Å²	140	149.4 Å²	149.4	86%	0.859	77%	0.766	S	S	*	*			trans	-99.3	101.2	160.8	38.5	0	0	0	0	110.8	G33 F37	G33-T35 PolarHBondContact O-N 3.44Å; T35-F37 PolarHBondContact O-N 2.66Å
36	T	28.2	Very low	26.1	Very low	129 Å²	129	151.5 Å²	151.5	79%	0.791	77%	0.768	S	S	*	*			trans	-43.4	126.4	-176.1	45.2	0	0	0	0	116	K38	T36-K38 PolarHBondContact O-N 2.97Å
37	F	24.5	Very low	26.6	Very low	180 Å²	180	147.5 Å²	147.5	79%	0.789	74%	0.741	S	S	*	*			trans	-51.9	128.4	163	-83.4	-100.5	0	0	0	111	T35 L40	T35-F37 PolarHBondContact O-N 2.66Å; F37-L40 HydrophobicContact CD1-CB 4.4Å; F37-L40 HydrophobicContact CD1-CD1 3.73Å; F37-L40 HydrophobicContact CE1-CD1 3.78Å
38	K	25.1	Very low	27.5	Very low	191 Å²	191	141.5 Å²	141.5	83%	0.83	72%	0.72	S	S	*	*			trans	-134	20.4	178.3	-150.7	179.1	177.1	179	0	114.6	T36	T36-K38 PolarHBondContact O-N 2.97Å
39	Y	25.3	Very low	28.6	Very low	225 Å²	225	137.4 Å²	137.4	88%	0.882	71%	0.705	S	S	*	*	S	Bend	trans	-143.7	59.9	171.4	-82.4	-75.5	0	0	0	110.4
40	L	25.9	Very low	30	Very low	75 Å²	75	130.8 Å²	130.8	39%	0.393	69%	0.689	S	S	.	*			trans	-153	42.1	178.8	-127.3	167.6	0	0	0	113.6	F37 V44	F37-L40 HydrophobicContact CD1-CB 4.4Å; F37-L40 HydrophobicContact CD1-CD1 3.73Å; F37-L40 HydrophobicContact CE1-CD1 3.78Å; L40-V44 HydrophobicContact CD2-CG2 4.2Å
41	N	25.1	Very low	31.5	Very low	164 Å²	164	127.3 Å²	127.3	88%	0.877	67%	0.673	S	S	*	*	S	Bend	trans	-119.1	79.4	174	-81.3	-8.3	0	0	0	110.4
42	D	25.9	Very low	33.1	Very low	115 Å²	115	123.2 Å²	123.2	62%	0.615	64%	0.643	S	S	*	*	S	Bend	trans	-171.6	-19.4	157.4	-119.9	-45.5	0	0	0	114.1	K936	D42-K936 PolarHBondContact O-NZ 2.83Å; D42-K936 IonicContact OD1-NZ 4Å; D42-K936 PolarHBondContact OD1-NZ 3.43Å
43	C	26	Very low	34.9	Very low	111 Å²	111	118.7 Å²	118.7	75%	0.75	62%	0.622	S	S	*	*	S	Bend	trans	-118.5	44.3	-176.7	-60.9	0	0	0	0	113.6
44	V	26.6	Very low	37.1	Very low	60 Å²	60	121.1 Å²	121.1	36%	0.364	62%	0.615	S	S	.	*			trans	-122.9	101.8	168.7	176.4	0	0	0	0	108.9	L40 L115	L40-V44 HydrophobicContact CD2-CG2 4.2Å; V44-L115 HydrophobicContact CG1-CD1 3.62Å; V44-L115 HydrophobicContact CG2-CD1 4.25Å
45	S	28.9	Very low	39.3	Very low	87 Å²	87	109.8 Å²	109.8	61%	0.608	58%	0.575	S	S	*	*			trans	-82.9	119.3	168.1	-64.4	0	0	0	0	109	V47	S45-V47 PolarHBondContact O-N 2.79Å
46	L	32.1	Very low	41.3	Very low	167 Å²	167	105.1 Å²	105.1	87%	0.874	55%	0.546	S	S	*	.			trans	-72.4	114.9	172.9	-77.9	164.9	0	0	0	109.5	A48	L46-A48 PolarHBondContact O-N 3.47Å
47	V	39.5	Very low	43.3	Very low	46 Å²	46	106.6 Å²	106.6	28%	0.279	54%	0.537	S	S	.	.			trans	-65.2	131.2	175.7	-179.8	0	0	0	0	110.1	S45 M49 I52 Y78	S45-V47 PolarHBondContact O-N 2.79Å; V47-M49 PolarHBondContact O-N 3.22Å; V47-M49 VanDerWaalsContact O-N 3.12Å; V47-I52 HydrophobicContact CG1-CD1 3.58Å; V47-I52 HydrophobicContact CG1-CG1 4.32Å; V47-Y78 HydrophobicContact CB-CE1 4.31Å; V47-Y78 HydrophobicContact CG1-CD1 3.92Å; V47-Y78 HydrophobicContact CG1-CE1 3.53Å; V47-Y78 HydrophobicContact CG2-CE1 4.07Å
48	A	45.9	Very low	45.4	Very low	44 Å²	44	102.5 Å²	102.5	36%	0.364	52%	0.52	S	S	.	.			trans	-75.4	100.1	179.2	0	0	0	0	0	110.4	L46 N50 E51	L46-A48 PolarHBondContact O-N 3.47Å; A48-N50 PolarHBondContact O-N 2.89Å; A48-E51 HydrophobicContact CB-CG 4.16Å; A48-E51 WeakPolarHBondContact O-CB 3.48Å; A48-E51 PolarHBondContact O-N 3Å
49	M	49.5	Very low	47.3	Very low	91 Å²	91	95.8 Å²	95.8	45%	0.448	49%	0.491	S	S	.	.	H	α-helix	trans	-46.7	-34.8	179.4	-72.4	-61.8	-55.3	0	0	113.8	V47 E51 I52 E53	V47-M49 PolarHBondContact O-N 3.22Å; V47-M49 VanDerWaalsContact O-N 3.12Å; M49-E51 VanDerWaalsContact C-N 3.27Å; M49-E51 PolarHBondContact O-N 2.68Å; M49-I52 PolarHBondContact O-N 2.71Å; M49-E53 WeakPolarHBondContact O-CG 3.23Å; M49-E53 PolarHBondContact O-N 3.01Å
50	N	56	Low	49.1	Very low	122 Å²	122	87.9 Å²	87.9	65%	0.652	47%	0.469	S	S	*	.	H	α-helix	trans	-57.2	-35.6	179.5	-53.7	16.8	0	0	0	113.3	A48 K54	A48-N50 PolarHBondContact O-N 2.89Å; N50-K54 WeakPolarHBondContact O-CB 3.49Å; N50-K54 PolarHBondContact O-N 2.89Å
51	E	56.3	Low	50.7	Low	108 Å²	108	89.8 Å²	89.8	51%	0.505	48%	0.476	S	S	.	.	H	α-helix	trans	-70.5	-45	178.8	-63	-69.2	117.6	0	0	110.4	A48 M49 K54 C55 Y78	A48-E51 HydrophobicContact CB-CG 4.16Å; A48-E51 WeakPolarHBondContact O-CB 3.48Å; A48-E51 PolarHBondContact O-N 3Å; M49-E51 VanDerWaalsContact C-N 3.27Å; M49-E51 PolarHBondContact O-N 2.68Å; E51-K54 WeakPolarHBondContact O-CB 3.46Å; E51-K54 PolarHBondContact O-N 2.78Å; E51-C55 PolarHBondContact O-N 2.93Å; E51-Y78 HydrophobicContact CB-CD2 4.21Å; E51-Y78 HydrophobicContact CB-CE2 4.05Å; E51-Y78 HydrophobicContact CG-CE2 4.21Å
52	I	58.9	Low	52.1	Low	18 Å²	18	87 Å²	87	9%	0.092	47%	0.465	C	S	.	.	H	α-helix	trans	-64.7	-43.1	175.8	-60.5	164.7	0	0	0	110.5	V47 M49 K54 C55 T56 C74 I75	V47-I52 HydrophobicContact CG1-CD1 3.58Å; V47-I52 HydrophobicContact CG1-CG1 4.32Å; M49-I52 PolarHBondContact O-N 2.71Å; I52-K54 VanDerWaalsContact C-N 3.28Å; I52-K54 PolarHBondContact O-N 3.18Å; I52-C55 PolarHBondContact O-N 2.93Å; I52-T56 VanDerWaalsContact O-CB 3.26Å; I52-T56 WeakPolarHBondContact O-CB 3.45Å; I52-T56 PolarHBondContact O-N 3.48Å; I52-T56 PolarHBondContact O-OG1 2.84Å; I52-C74 HydrophobicContact CG2-CB 4.41Å; I52-I75 HydrophobicContact CD1-CD1 4.24Å; I52-I75 HydrophobicContact CD1-CG1 3.69Å; I52-I75 HydrophobicContact CG1-CG1 4.13Å; I52-I75 HydrophobicContact CG2-CG1 4.24Å
53	E	60.5	Low	52.9	Low	99 Å²	99	85.2 Å²	85.2	46%	0.463	46%	0.458	S	S	.	.	H	α-helix	trans	-60	-38.5	176.1	-76.7	-171.4	164.3	0	0	111.6	M49 R57	M49-E53 WeakPolarHBondContact O-CG 3.23Å; M49-E53 PolarHBondContact O-N 3.01Å; E53-R57 PolarHBondContact O-N 3Å; E53-R57 VanDerWaalsContact O-N 3.15Å
54	K	71.2	Confident	53.7	Low	113 Å²	113	90.6 Å²	90.6	49%	0.491	46%	0.464	S	S	.	.	H	α-helix	trans	-63.7	-56.8	174.6	-177.1	-168.4	171.1	-97.8	0	111.6	N50 E51 I52 T56 R57 E58	N50-K54 WeakPolarHBondContact O-CB 3.49Å; N50-K54 PolarHBondContact O-N 2.89Å; E51-K54 WeakPolarHBondContact O-CB 3.46Å; E51-K54 PolarHBondContact O-N 2.78Å; I52-K54 VanDerWaalsContact C-N 3.28Å; I52-K54 PolarHBondContact O-N 3.18Å; K54-T56 VanDerWaalsContact C-N 3.3Å; K54-T56 PolarHBondContact O-N 2.77Å; K54-R57 WeakPolarHBondContact O-CB 3.49Å; K54-R57 PolarHBondContact O-N 2.91Å; K54-R57 VanDerWaalsContact O-N 3.09Å; K54-E58 WeakPolarHBondContact CE-OE1 3.36Å; K54-E58 WeakPolarHBondContact CE-OE2 3.49Å; K54-E58 VanDerWaalsContact NZ-CD 3.34Å; K54-E58 IonicContact NZ-OE1 2.72Å; K54-E58 PolarHBondContact NZ-OE1 2.84Å; K54-E58 VanDerWaalsContact NZ-OE1 3.11Å; K54-E58 IonicContact NZ-OE2 3.56Å; K54-E58 PolarHBondContact NZ-OE2 3.32Å; K54-E58 WeakPolarHBondContact O-CG 3.3Å; K54-E58 PolarHBondContact O-N 3.24Å
55	C	68.5	Low	54.2	Low	21 Å²	21	95.7 Å²	95.7	14%	0.142	48%	0.484	C	S	.	.	H	α-helix	trans	-58.3	-42.2	179.9	171.7	0	0	0	0	111.8	E51 I52 R57 E58 K59 C74 E77	E51-C55 PolarHBondContact O-N 2.93Å; I52-C55 PolarHBondContact O-N 2.93Å; C55-R57 VanDerWaalsContact C-N 3.26Å; C55-R57 PolarHBondContact O-N 2Å; C55-E58 PolarHBondContact O-N 2.78Å; C55-E58 VanDerWaalsContact O-N 3.17Å; C55-K59 PolarHBondContact O-N 2.93Å; C55-C74 HydrophobicContact CB-CB 3.69Å; C55-C74 WeakPolarHBondContact CB-SG 3.43Å; C55-C74 VanDerWaalsContact SG-CA 3.55Å; C55-C74 WeakPolarHBondContact SG-CB 3.39Å; C55-C74 CovalentContact SG-SG 2.04Å; C55-C74 PolarHBondContact SG-SG 2.67Å; C55-E77 PolarHBondContact SG-OE2 3.22Å
56	T	68.1	Low	54.6	Low	41 Å²	41	98.2 Å²	98.2	25%	0.252	50%	0.496	S	S	.	.	H	α-helix	trans	-61.3	-37.6	178.8	-54.7	0	0	0	0	110.7	I52 K54 S60 F70 C74	I52-T56 VanDerWaalsContact O-CB 3.26Å; I52-T56 WeakPolarHBondContact O-CB 3.45Å; I52-T56 PolarHBondContact O-N 3.48Å; I52-T56 PolarHBondContact O-OG1 2.84Å; K54-T56 VanDerWaalsContact C-N 3.3Å; K54-T56 PolarHBondContact O-N 2.77Å; T56-S60 VanDerWaalsContact O-CB 3.26Å; T56-S60 WeakPolarHBondContact O-CB 3.39Å; T56-S60 PolarHBondContact O-N 3.06Å; T56-S60 PolarHBondContact O-OG 3.06Å; T56-F70 HydrophobicContact CG2-CB 4.22Å; T56-C74 PolarHBondContact N-SG 2.86Å
57	R	68.8	Low	54.8	Low	160 Å²	160	93.4 Å²	93.4	60%	0.604	49%	0.486	S	S	*	.	H	α-helix	trans	-66.7	-49.2	173.5	-124.9	-170.2	81	-149.5	-2.1	111.8	E53 K54 C55 K59 S60 E61	E53-R57 PolarHBondContact O-N 3Å; E53-R57 VanDerWaalsContact O-N 3.15Å; K54-R57 WeakPolarHBondContact O-CB 3.49Å; K54-R57 PolarHBondContact O-N 2.91Å; K54-R57 VanDerWaalsContact O-N 3.09Å; C55-R57 VanDerWaalsContact C-N 3.26Å; C55-R57 PolarHBondContact O-N 2Å; R57-K59 PolarHBondContact O-N 3.25Å; R57-S60 WeakPolarHBondContact CA-OG 3.01Å; R57-S60 PolarHBondContact O-N 2.87Å; R57-S60 VanDerWaalsContact O-N 3.1Å; R57-S60 PolarHBondContact O-OG 2.87Å; R57-E61 IonicContact CZ-OE1 2.67Å; R57-E61 IonicContact NE-OE1 3.75Å; R57-E61 PolarHBondContact NE-OE1 3.41Å; R57-E61 IonicContact NH2-OE1 3.28Å; R57-E61 PolarHBondContact NH2-OE1 3.2Å; R57-E61 IonicContact NH2-OE2 2.75Å; R57-E61 WeakPolarHBondContact O-CG 3.4Å; R57-E61 PolarHBondContact O-N 2.99Å
58	E	69.6	Low	55	Low	94 Å²	94	100 Å²	100	44%	0.439	51%	0.512	S	S	.	.	H	α-helix	trans	-61.9	-38.7	-177.3	-69	173.8	156.2	0	0	112.1	K54 C55 T62	K54-E58 WeakPolarHBondContact CE-OE1 3.36Å; K54-E58 WeakPolarHBondContact CE-OE2 3.49Å; K54-E58 VanDerWaalsContact NZ-CD 3.34Å; K54-E58 IonicContact NZ-OE1 2.72Å; K54-E58 PolarHBondContact NZ-OE1 2.84Å; K54-E58 VanDerWaalsContact NZ-OE1 3.11Å; K54-E58 IonicContact NZ-OE2 3.56Å; K54-E58 PolarHBondContact NZ-OE2 3.32Å; K54-E58 WeakPolarHBondContact O-CG 3.3Å; K54-E58 PolarHBondContact O-N 3.24Å; C55-E58 PolarHBondContact O-N 2.78Å; C55-E58 VanDerWaalsContact O-N 3.17Å; E58-T62 PolarHBondContact O-OG1 3.22Å
59	K	65	Low	55.3	Low	50 Å²	50	101.9 Å²	101.9	22%	0.217	52%	0.515	C	S	.	.	H	α-helix	trans	-71.3	-36.8	171.1	-67.6	-172.2	-175.8	172.3	0	113.1	C55 R57 E61 T62 V63 F70 D73 E77	C55-K59 PolarHBondContact O-N 2.93Å; R57-K59 PolarHBondContact O-N 3.25Å; K59-E61 VanDerWaalsContact C-N 3.31Å; K59-E61 PolarHBondContact O-N 2.85Å; K59-T62 WeakPolarHBondContact CA-OG1 2.76Å; K59-T62 PolarHBondContact O-N 2.91Å; K59-T62 PolarHBondContact O-OG1 2.89Å; K59-T62 VanDerWaalsContact O-OG1 3.12Å; K59-V63 PolarHBondContact O-N 3.11Å; K59-V63 VanDerWaalsContact O-N 3.16Å; K59-F70 HydrophobicContact CB-CD1 3.89Å; K59-F70 HydrophobicContact CB-CE1 4.43Å; K59-F70 HydrophobicContact CB-CG 4.5Å; K59-D73 HydrophobicContact CD-CB 4.31Å; K59-D73 PolarHBondContact NZ-O 3.08Å; K59-E77 WeakPolarHBondContact CE-OE2 3.5Å; K59-E77 IonicContact NZ-OE2 3.33Å; K59-E77 PolarHBondContact NZ-OE2 2.83Å
60	S	63.2	Low	55.6	Low	60 Å²	60	100 Å²	100	42%	0.42	51%	0.505	S	S	.	.	H	α-helix	trans	-69	-25.9	176.3	75	0	0	0	0	114.3	T56 R57 T62	T56-S60 VanDerWaalsContact O-CB 3.26Å; T56-S60 WeakPolarHBondContact O-CB 3.39Å; T56-S60 PolarHBondContact O-N 3.06Å; T56-S60 PolarHBondContact O-OG 3.06Å; R57-S60 WeakPolarHBondContact CA-OG 3.01Å; R57-S60 PolarHBondContact O-N 2.87Å; R57-S60 VanDerWaalsContact O-N 3.1Å; R57-S60 PolarHBondContact O-OG 2.87Å; S60-T62 VanDerWaalsContact C-N 3.29Å
61	E	58.6	Low	55.7	Low	115 Å²	115	97.2 Å²	97.2	54%	0.537	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-9	175.5	-73.5	176.2	-151.7	0	0	112.6	R57 K59	R57-E61 IonicContact CZ-OE1 2.67Å; R57-E61 IonicContact NE-OE1 3.75Å; R57-E61 PolarHBondContact NE-OE1 3.41Å; R57-E61 IonicContact NH2-OE1 3.28Å; R57-E61 PolarHBondContact NH2-OE1 3.2Å; R57-E61 IonicContact NH2-OE2 2.75Å; R57-E61 WeakPolarHBondContact O-CG 3.4Å; R57-E61 PolarHBondContact O-N 2.99Å; K59-E61 VanDerWaalsContact C-N 3.31Å; K59-E61 PolarHBondContact O-N 2.85Å
62	T	55.3	Low	55.7	Low	106 Å²	106	94.8 Å²	94.8	65%	0.65	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	-18.5	-173.1	47.5	0	0	0	0	115.7	E58 K59 S60	E58-T62 PolarHBondContact O-OG1 3.22Å; K59-T62 WeakPolarHBondContact CA-OG1 2.76Å; K59-T62 PolarHBondContact O-N 2.91Å; K59-T62 PolarHBondContact O-OG1 2.89Å; K59-T62 VanDerWaalsContact O-OG1 3.12Å; S60-T62 VanDerWaalsContact C-N 3.29Å
63	V	42.6	Very low	55.8	Low	77 Å²	77	96.3 Å²	96.3	47%	0.467	49%	0.493	S	S	.	.			trans	-120	109	-177.5	-176.2	0	0	0	0	112.3	K59 E65 F70	K59-V63 PolarHBondContact O-N 3.11Å; K59-V63 VanDerWaalsContact O-N 3.16Å; V63-E65 PolarHBondContact O-N 2.81Å; V63-F70 HydrophobicContact CB-CE1 3.93Å; V63-F70 HydrophobicContact CB-CZ 4.06Å; V63-F70 HydrophobicContact CG1-CE1 4.27Å; V63-F70 HydrophobicContact CG1-CZ 4.32Å; V63-F70 HydrophobicContact CG2-CE1 4.38Å
64	Y	42.5	Very low	56.1	Low	223 Å²	223	91.8 Å²	91.8	88%	0.875	47%	0.472	S	S	*	.			trans	-92.4	47.8	-178.8	-93.6	-89.3	0	0	0	113.8
65	E	36.7	Very low	55.5	Low	167 Å²	167	87.8 Å²	87.8	78%	0.78	46%	0.456	S	S	*	.	S	Bend	trans	-145.3	170.1	176.7	-129.1	155.9	-136.7	0	0	115.1	V63 G67	V63-E65 PolarHBondContact O-N 2.81Å; E65-G67 PolarHBondContact O-N 2.72Å
66	T	39	Very low	55	Low	140 Å²	140	90.3 Å²	90.3	86%	0.859	47%	0.466	S	S	*	.			trans	-48.4	115.4	-155.3	46.6	0	0	0	0	115.6	K68	T66-K68 PolarHBondContact O-N 2.77Å
67	G	34.6	Very low	54.9	Low	66 Å²	66	92.2 Å²	92.2	68%	0.68	47%	0.472	S	S	*	.			trans	-69	113.8	-168.9	0	0	0	0	0	116.2	E65	E65-G67 PolarHBondContact O-N 2.72Å
68	K	44	Very low	54.5	Low	185 Å²	185	86.7 Å²	86.7	80%	0.804	45%	0.451	S	S	*	.	S	Bend	trans	-166.1	113.4	144.2	-101.2	170.4	-174.8	177.6	0	107.5	T66	T66-K68 PolarHBondContact O-N 2.77Å
69	N	52.5	Low	53.8	Low	83 Å²	83	83 Å²	83	44%	0.444	44%	0.436	S	S	.	.			trans	150.3	-12.2	147.6	-79.6	7.3	0	0	0	115.3	S71 I72 D73	N69-S71 CarbonylContact O-C 3.54Å; N69-S71 PolarHBondContact O-N 3.02Å; N69-I72 CarbonylContact O-C 3.6Å; N69-I72 VanDerWaalsContact O-CA 3.31Å; N69-I72 WeakPolarHBondContact O-CA 3.5Å; N69-I72 WeakPolarHBondContact O-CB 3.4Å; N69-I72 PolarHBondContact O-N 2.97Å; N69-D73 VanDerWaalsContact C-OD2 3.3Å; N69-D73 WeakPolarHBondContact CB-OD1 3.31Å; N69-D73 VanDerWaalsContact O-CG 3.3Å; N69-D73 PolarHBondContact O-N 3.2Å
70	F	55.5	Low	53.4	Low	51 Å²	51	85.6 Å²	85.6	22%	0.224	45%	0.449	C	S	.	.	H	α-helix	trans	-43.8	-39.8	-175.7	-57	-52.6	0	0	0	116.1	T56 K59 V63 D73 C74	T56-F70 HydrophobicContact CG2-CB 4.22Å; K59-F70 HydrophobicContact CB-CD1 3.89Å; K59-F70 HydrophobicContact CB-CE1 4.43Å; K59-F70 HydrophobicContact CB-CG 4.5Å; V63-F70 HydrophobicContact CB-CE1 3.93Å; V63-F70 HydrophobicContact CB-CZ 4.06Å; V63-F70 HydrophobicContact CG1-CE1 4.27Å; V63-F70 HydrophobicContact CG1-CZ 4.32Å; V63-F70 HydrophobicContact CG2-CE1 4.38Å; F70-D73 VanDerWaalsContact CA-OD2 3.26Å; F70-D73 WeakPolarHBondContact CA-OD2 3.34Å; F70-D73 PolarHBondContact N-OD2 3.43Å; F70-C74 VanDerWaalsContact O-CB 3.28Å; F70-C74 WeakPolarHBondContact O-CB 3.44Å; F70-C74 PolarHBondContact O-N 3.43Å; F70-C74 PolarHBondContact O-SG 2.79Å
71	S	57.8	Low	53.1	Low	64 Å²	64	88.2 Å²	88.2	45%	0.448	46%	0.458	S	S	.	.	H	α-helix	trans	-72.1	-30.5	176.4	59.2	0	0	0	0	114.2	N69 I75	N69-S71 CarbonylContact O-C 3.54Å; N69-S71 PolarHBondContact O-N 3.02Å; S71-I75 WeakPolarHBondContact O-CB 3.31Å; S71-I75 VanDerWaalsContact O-CD1 3.26Å; S71-I75 WeakPolarHBondContact O-CD1 3.47Å; S71-I75 WeakPolarHBondContact O-CG1 3.49Å; S71-I75 PolarHBondContact O-N 2.76Å
72	I	56.9	Low	52.8	Low	57 Å²	57	86.6 Å²	86.6	29%	0.292	45%	0.453	S	S	.	.	H	α-helix	trans	-71.1	-51.9	169.9	-59.8	177.3	0	0	0	108.3	N69 C74 I75 E76 W89	N69-I72 CarbonylContact O-C 3.6Å; N69-I72 VanDerWaalsContact O-CA 3.31Å; N69-I72 WeakPolarHBondContact O-CA 3.5Å; N69-I72 WeakPolarHBondContact O-CB 3.4Å; N69-I72 PolarHBondContact O-N 2.97Å; I72-C74 PolarHBondContact O-N 2.79Å; I72-C74 VanDerWaalsContact O-N 3.15Å; I72-I75 CarbonylContact O-C 3.57Å; I72-I75 WeakPolarHBondContact O-CA 3.42Å; I72-I75 PolarHBondContact O-N 2.67Å; I72-E76 HydrophobicContact CG2-CG 4.09Å; I72-E76 WeakPolarHBondContact O-CG 3.37Å; I72-E76 PolarHBondContact O-N 3.2Å; I72-W89 HydrophobicContact CG2-CZ2 4.18Å
73	D	61.6	Low	52.5	Low	51 Å²	51	84.7 Å²	84.7	27%	0.273	44%	0.436	S	S	.	.	H	α-helix	trans	-54.7	-39	-180	-44	-32	0	0	0	111.8	K59 N69 F70 E77	K59-D73 HydrophobicContact CD-CB 4.31Å; K59-D73 PolarHBondContact NZ-O 3.08Å; N69-D73 VanDerWaalsContact C-OD2 3.3Å; N69-D73 WeakPolarHBondContact CB-OD1 3.31Å; N69-D73 VanDerWaalsContact O-CG 3.3Å; N69-D73 PolarHBondContact O-N 3.2Å; F70-D73 VanDerWaalsContact CA-OD2 3.26Å; F70-D73 WeakPolarHBondContact CA-OD2 3.34Å; F70-D73 PolarHBondContact N-OD2 3.43Å; D73-E77 WeakPolarHBondContact O-CB 3.34Å; D73-E77 PolarHBondContact O-N 3.41Å
74	C	66.4	Low	52.3	Low	3 Å²	3	84.8 Å²	84.8	2%	0.02	44%	0.438	C	S	.	.	H	α-helix	trans	-77.5	-23.2	176.4	-71.8	0	0	0	0	114.4	I52 C55 T56 F70 I72 Y78	I52-C74 HydrophobicContact CG2-CB 4.41Å; C55-C74 HydrophobicContact CB-CB 3.69Å; C55-C74 WeakPolarHBondContact CB-SG 3.43Å; C55-C74 VanDerWaalsContact SG-CA 3.55Å; C55-C74 WeakPolarHBondContact SG-CB 3.39Å; C55-C74 CovalentContact SG-SG 2.04Å; C55-C74 PolarHBondContact SG-SG 2.67Å; T56-C74 PolarHBondContact N-SG 2.86Å; F70-C74 VanDerWaalsContact O-CB 3.28Å; F70-C74 WeakPolarHBondContact O-CB 3.44Å; F70-C74 PolarHBondContact O-N 3.43Å; F70-C74 PolarHBondContact O-SG 2.79Å; I72-C74 PolarHBondContact O-N 2.79Å; I72-C74 VanDerWaalsContact O-N 3.15Å; C74-Y78 WeakPolarHBondContact O-CB 3.18Å; C74-Y78 PolarHBondContact O-N 3.34Å; C74-Y78 VanDerWaalsContact O-N 3.12Å
75	I	59	Low	51.9	Low	29 Å²	29	82 Å²	82	15%	0.149	43%	0.431	C	S	.	.	H	α-helix	trans	-81.8	-35	171.1	-70.7	166.5	0	0	0	110.1	I52 S71 I72 C79 W89	I52-I75 HydrophobicContact CD1-CD1 4.24Å; I52-I75 HydrophobicContact CD1-CG1 3.69Å; I52-I75 HydrophobicContact CG1-CG1 4.13Å; I52-I75 HydrophobicContact CG2-CG1 4.24Å; S71-I75 WeakPolarHBondContact O-CB 3.31Å; S71-I75 VanDerWaalsContact O-CD1 3.26Å; S71-I75 WeakPolarHBondContact O-CD1 3.47Å; S71-I75 WeakPolarHBondContact O-CG1 3.49Å; S71-I75 PolarHBondContact O-N 2.76Å; I72-I75 CarbonylContact O-C 3.57Å; I72-I75 WeakPolarHBondContact O-CA 3.42Å; I72-I75 PolarHBondContact O-N 2.67Å; I75-C79 WeakPolarHBondContact O-CB 3.13Å; I75-C79 PolarHBondContact O-N 3.47Å; I75-C79 PolarHBondContact O-SG 3.06Å; I75-W89 HydrophobicContact CB-CH2 4.33Å; I75-W89 HydrophobicContact CB-CZ2 4.08Å; I75-W89 HydrophobicContact CD1-CH2 4.14Å; I75-W89 HydrophobicContact CG2-CH2 3.9Å; I75-W89 HydrophobicContact CG2-CZ2 3.58Å
76	E	58.3	Low	51.6	Low	74 Å²	74	74.6 Å²	74.6	35%	0.346	40%	0.4	S	S	.	.	H	α-helix	trans	-67.5	-45.5	174.1	-70.3	-174.7	168.2	0	0	111.2	I72 C79 Q80 W89	I72-E76 HydrophobicContact CG2-CG 4.09Å; I72-E76 WeakPolarHBondContact O-CG 3.37Å; I72-E76 PolarHBondContact O-N 3.2Å; E76-C79 CarbonylContact O-C 3.22Å; E76-C79 PolarHBondContact O-N 3.37Å; E76-Q80 WeakPolarHBondContact O-CB 3.33Å; E76-Q80 VanDerWaalsContact O-CG 3.24Å; E76-Q80 WeakPolarHBondContact O-CG 3.49Å; E76-Q80 PolarHBondContact O-N 3.19Å; E76-W89 PolarHBondContact OE1-NE1 3.33Å
77	E	64.9	Low	51.2	Low	81 Å²	81	72.1 Å²	72.1	38%	0.379	38%	0.375	S	S	.	.	H	α-helix	trans	-60.2	-49.3	171.5	-173.7	171.6	-162.1	0	0	111.3	C55 K59 D73 C79 Q80 D81	C55-E77 PolarHBondContact SG-OE2 3.22Å; K59-E77 WeakPolarHBondContact CE-OE2 3.5Å; K59-E77 IonicContact NZ-OE2 3.33Å; K59-E77 PolarHBondContact NZ-OE2 2.83Å; D73-E77 WeakPolarHBondContact O-CB 3.34Å; D73-E77 PolarHBondContact O-N 3.41Å; E77-C79 VanDerWaalsContact C-N 3.3Å; E77-C79 PolarHBondContact O-N 3.34Å; E77-Q80 PolarHBondContact O-N 2.9Å; E77-Q80 VanDerWaalsContact O-N 3.09Å; E77-D81 PolarHBondContact O-N 3Å
78	Y	61.7	Low	51	Low	44 Å²	44	78.7 Å²	78.7	17%	0.173	39%	0.385	C	S	.	.	H	α-helix	trans	-58.9	-39.9	175.4	-175.6	-89.2	0	0	0	112.6	V47 E51 C74 N82 F83	V47-Y78 HydrophobicContact CB-CE1 4.31Å; V47-Y78 HydrophobicContact CG1-CD1 3.92Å; V47-Y78 HydrophobicContact CG1-CE1 3.53Å; V47-Y78 HydrophobicContact CG2-CE1 4.07Å; E51-Y78 HydrophobicContact CB-CD2 4.21Å; E51-Y78 HydrophobicContact CB-CE2 4.05Å; E51-Y78 HydrophobicContact CG-CE2 4.21Å; C74-Y78 WeakPolarHBondContact O-CB 3.18Å; C74-Y78 PolarHBondContact O-N 3.34Å; C74-Y78 VanDerWaalsContact O-N 3.12Å; Y78-N82 HydrophobicContact CE1-CB 4.32Å; Y78-N82 VanDerWaalsContact O-CB 3.26Å; Y78-N82 WeakPolarHBondContact O-CB 3.21Å; Y78-N82 PolarHBondContact O-N 2.98Å; Y78-N82 PolarHBondContact O-ND2 3.24Å; Y78-F83 HydrophobicContact CE1-CE2 4.29Å
79	C	53.7	Low	50.1	Low	17 Å²	17	75.6 Å²	75.6	12%	0.115	37%	0.369	C	S	.	.	H	α-helix	trans	-73.6	-30.6	176.2	-73.6	0	0	0	0	112.8	I75 E76 E77 F83 Y87	I75-C79 WeakPolarHBondContact O-CB 3.13Å; I75-C79 PolarHBondContact O-N 3.47Å; I75-C79 PolarHBondContact O-SG 3.06Å; E76-C79 CarbonylContact O-C 3.22Å; E76-C79 PolarHBondContact O-N 3.37Å; E77-C79 VanDerWaalsContact C-N 3.3Å; E77-C79 PolarHBondContact O-N 3.34Å; C79-F83 HydrophobicContact CB-CD2 4.48Å; C79-F83 CarbonylContact O-C 3.47Å; C79-F83 WeakPolarHBondContact O-CA 3.23Å; C79-F83 WeakPolarHBondContact O-CB 3.41Å; C79-F83 PolarHBondContact O-N 3.14Å; C79-Y87 HydrophobicContact CB-CD1 3.93Å; C79-Y87 HydrophobicContact CB-CE1 3.84Å
80	Q	57.6	Low	48.9	Very low	104 Å²	104	78.6 Å²	78.6	49%	0.486	39%	0.39	S	S	.	.	H	α-helix	trans	-67.5	-44	174	-77.3	169.1	17.4	0	0	110.8	E76 E77 Y87	E76-Q80 WeakPolarHBondContact O-CB 3.33Å; E76-Q80 VanDerWaalsContact O-CG 3.24Å; E76-Q80 WeakPolarHBondContact O-CG 3.49Å; E76-Q80 PolarHBondContact O-N 3.19Å; E77-Q80 PolarHBondContact O-N 2.9Å; E77-Q80 VanDerWaalsContact O-N 3.09Å; Q80-Y87 WeakPolarHBondContact CA-OH 3.32Å; Q80-Y87 HydrophobicContact CG-CE1 3.8Å; Q80-Y87 HydrophobicContact CG-CE2 4.5Å; Q80-Y87 WeakPolarHBondContact CG-OH 3.33Å
81	D	56.9	Low	47.4	Very low	115 Å²	115	86.6 Å²	86.6	62%	0.615	42%	0.419	S	S	*	.	H	α-helix	trans	-73.3	-32.3	180	-68.1	-15.5	0	0	0	113.3	E77	E77-D81 PolarHBondContact O-N 3Å
82	N	52.1	Low	45.9	Very low	81 Å²	81	91.8 Å²	91.8	43%	0.433	43%	0.434	S	S	.	.	H	α-helix	trans	-107.6	-19.3	-174.2	-64.6	-99.4	0	0	0	114.5	Y78	Y78-N82 HydrophobicContact CE1-CB 4.32Å; Y78-N82 VanDerWaalsContact O-CB 3.26Å; Y78-N82 WeakPolarHBondContact O-CB 3.21Å; Y78-N82 PolarHBondContact O-N 2.98Å; Y78-N82 PolarHBondContact O-ND2 3.24Å
83	F	49.2	Very low	44.6	Very low	66 Å²	66	93 Å²	93	29%	0.289	45%	0.445	S	S	.	.			trans	-141.3	60.8	-175.5	-55	-68.3	0	0	0	112.6	Y78 C79 F85 G86	Y78-F83 HydrophobicContact CE1-CE2 4.29Å; C79-F83 HydrophobicContact CB-CD2 4.48Å; C79-F83 CarbonylContact O-C 3.47Å; C79-F83 WeakPolarHBondContact O-CA 3.23Å; C79-F83 WeakPolarHBondContact O-CB 3.41Å; C79-F83 PolarHBondContact O-N 3.14Å; F83-F85 PolarHBondContact O-N 2.03Å; F83-G86 PolarHBondContact O-N 3.49Å
84	P	37.1	Very low	43	Very low	79 Å²	79	96 Å²	96	51%	0.513	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	15	-172.8	26.7	-36.8	0	0	0	116.8
85	F	35.4	Very low	41.2	Very low	164 Å²	164	104.2 Å²	104.2	72%	0.719	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.9	21.7	-175.6	-63.6	-69.8	0	0	0	115	F83	F83-F85 PolarHBondContact O-N 2.03Å
86	G	29.6	Very low	39.8	Very low	13 Å²	13	110.8 Å²	110.8	13%	0.134	53%	0.534	C	S	.	.			trans	171.1	131	162.4	0	0	0	0	0	118.2	F83	F83-G86 PolarHBondContact O-N 3.49Å
87	Y	30.2	Very low	38.3	Very low	87 Å²	87	116.2 Å²	116.2	34%	0.341	56%	0.559	S	S	.	*			trans	-138.1	135.2	167.9	-24.4	-90.5	0	0	0	109.5	C79 Q80	C79-Y87 HydrophobicContact CB-CD1 3.93Å; C79-Y87 HydrophobicContact CB-CE1 3.84Å; Q80-Y87 WeakPolarHBondContact CA-OH 3.32Å; Q80-Y87 HydrophobicContact CG-CE1 3.8Å; Q80-Y87 HydrophobicContact CG-CE2 4.5Å; Q80-Y87 WeakPolarHBondContact CG-OH 3.33Å
88	F	30.3	Very low	36.6	Very low	204 Å²	204	120.6 Å²	120.6	90%	0.895	58%	0.58	S	S	*	*			trans	-154.2	125.5	146.7	-81.8	-62.8	0	0	0	109.2
89	W	25.6	Very low	34.8	Very low	121 Å²	121	128.6 Å²	128.6	46%	0.458	62%	0.615	S	S	.	*			trans	-91.1	152.6	169.4	-63.2	83.6	0	0	0	110	I72 I75 E76 F116	I72-W89 HydrophobicContact CG2-CZ2 4.18Å; I75-W89 HydrophobicContact CB-CH2 4.33Å; I75-W89 HydrophobicContact CB-CZ2 4.08Å; I75-W89 HydrophobicContact CD1-CH2 4.14Å; I75-W89 HydrophobicContact CG2-CH2 3.9Å; I75-W89 HydrophobicContact CG2-CZ2 3.58Å; E76-W89 PolarHBondContact OE1-NE1 3.33Å; W89-F116 HydrophobicContact CH2-CD1 4.48Å; W89-F116 HydrophobicContact CH2-CE1 4.09Å; W89-F116 HydrophobicContact CZ3-CD1 4.4Å; W89-F116 AromaticContact CZ3-CE1 3.92Å; W89-F116 HydrophobicContact CZ3-CE1 3.92Å
90	T	27.5	Very low	33.6	Very low	146 Å²	146	138.2 Å²	138.2	90%	0.896	65%	0.649	S	S	*	*			trans	-129.9	122.9	159.6	52.6	0	0	0	0	110.8
91	W	24.5	Very low	32	Very low	218 Å²	218	141.6 Å²	141.6	83%	0.826	67%	0.669	S	S	*	*			trans	-138.9	112.6	167	-173.6	75.5	0	0	0	108.3	P93	W91-P93 HydrophobicContact CD2-CG 4.26Å; W91-P93 HydrophobicContact CE3-CG 4.24Å; W91-P93 HydrophobicContact CH2-CG 3.61Å; W91-P93 HydrophobicContact CZ2-CB 4.39Å; W91-P93 HydrophobicContact CZ2-CG 3.6Å; W91-P93 HydrophobicContact CZ3-CG 3.92Å
92	K	25.4	Very low	30.7	Very low	174 Å²	174	142 Å²	142	76%	0.757	68%	0.675	S	S	*	*			trans	-138.9	100.5	168.1	-169.4	166.7	-175.9	169.3	0	109.1	D94	K92-D94 WeakPolarHBondContact CE-OD2 3.4Å
93	P	29.8	Very low	29.4	Very low	81 Å²	81	144.3 Å²	144.3	53%	0.526	69%	0.687	S	S	.	*			trans	-84.3	112.1	171.3	33.9	-31.9	0	0	0	109.2	W91	W91-P93 HydrophobicContact CD2-CG 4.26Å; W91-P93 HydrophobicContact CE3-CG 4.24Å; W91-P93 HydrophobicContact CH2-CG 3.61Å; W91-P93 HydrophobicContact CZ2-CB 4.39Å; W91-P93 HydrophobicContact CZ2-CG 3.6Å; W91-P93 HydrophobicContact CZ3-CG 3.92Å
94	D	28.1	Very low	28.4	Very low	116 Å²	116	149.1 Å²	149.1	62%	0.62	72%	0.716	S	S	*	*			trans	-117.7	151.2	158.4	-81.8	-60.4	0	0	0	107.7	K92	K92-D94 WeakPolarHBondContact CE-OD2 3.4Å
95	Q	28.5	Very low	28.3	Very low	175 Å²	175	151.1 Å²	151.1	82%	0.818	73%	0.726	S	S	*	*			trans	82.4	150	-175.9	-48.2	-57.4	-71.3	0	0	117.3
96	L	30.3	Very low	28.2	Very low	167 Å²	167	146.7 Å²	146.7	87%	0.874	71%	0.71	S	S	*	*			trans	72.6	83.7	176.2	-61.5	175	0	0	0	117.2
97	E	26.2	Very low	28.4	Very low	187 Å²	187	152.4 Å²	152.4	87%	0.874	73%	0.728	S	S	*	*			trans	-38.4	126.5	145.8	-53.2	164.3	117.9	0	0	112.8
98	E	29	Very low	28.4	Very low	173 Å²	173	155.1 Å²	155.1	81%	0.808	74%	0.741	S	S	*	*				-176.5	152.9	118.4	-100.7	-152.1	151.8	0	0	112.1	R100	E98-R100 PolarHBondContact O-N 2.89Å
99	K	24.6	Very low	28.5	Very low	212 Å²	212	152.5 Å²	152.5	92%	0.922	73%	0.729	S	S	*	*			trans	-84.2	100.1	-177.4	-65.1	170.3	-178.3	169.9	0	111.8
100	R	27.5	Very low	28.8	Very low	219 Å²	219	151.9 Å²	151.9	83%	0.826	74%	0.739	S	S	*	*			trans	-136.2	125.6	157.7	-71.4	-170	-169.5	-155.3	0.8	113.1	E98 V102	E98-R100 PolarHBondContact O-N 2.89Å; R100-V102 PolarHBondContact O-N 2.84Å
101	I	25.5	Very low	28.9	Very low	175 Å²	175	149.7 Å²	149.7	90%	0.897	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-74.4	119.3	170.8	-60.6	166.6	0	0	0	107.6
102	V	28	Very low	29	Very low	124 Å²	124	147.1 Å²	147.1	75%	0.752	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-103.6	130.4	172.4	-178.9	0	0	0	0	108.4	R100	R100-V102 PolarHBondContact O-N 2.84Å
103	N	26	Very low	29	Very low	129 Å²	129	142.8 Å²	142.8	69%	0.69	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-79.2	151.8	-170.5	-155.6	-6.5	0	0	0	112.4	T105	N103-T105 PolarHBondContact O-N 2.92Å
104	L	27.6	Very low	28.9	Very low	168 Å²	168	148 Å²	148	88%	0.88	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	17	-160.2	-95	161.4	0	0	0	116.8
105	T	35.5	Very low	28.9	Very low	121 Å²	121	147.6 Å²	147.6	74%	0.742	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.7	-2.2	-169	53.4	0	0	0	0	115.7	N103	N103-T105 PolarHBondContact O-N 2.92Å
106	D	33.2	Very low	29	Very low	71 Å²	71	144.5 Å²	144.5	38%	0.38	71%	0.713	S	S	.	*			trans	-121	25.1	-165.2	-144.9	-6.6	0	0	0	114.4	K108 K109	D106-K108 PolarHBondContact O-N 2.86Å; D106-K109 PolarHBondContact O-N 2.02Å; D106-K109 VanDerWaalsContact O-N 3.12Å; D106-K109 WeakPolarHBondContact OD1-CD 3.18Å; D106-K109 WeakPolarHBondContact OD1-CE 3.06Å; D106-K109 IonicContact OD1-NZ 2.66Å; D106-K109 PolarHBondContact OD1-NZ 3.33Å; D106-K109 WeakPolarHBondContact OD2-CE 3.32Å; D106-K109 IonicContact OD2-NZ 3.73Å; D106-K109 PolarHBondContact OD2-NZ 2.91Å
107	W	32.3	Very low	28.9	Very low	133 Å²	133	140.9 Å²	140.9	50%	0.504	69%	0.694	S	S	.	*	G	3₁₀ helix	trans	-56.5	-25.6	-175.8	63.2	-96	0	0	0	114.3	K109 V110 L111	W107-K109 PolarHBondContact O-N 3.3Å; W107-K109 VanDerWaalsContact O-N 3.11Å; W107-V110 PolarHBondContact O-N 2.9Å; W107-L111 HydrophobicContact CE3-CD1 3.94Å; W107-L111 HydrophobicContact CZ3-CD1 4.03Å
108	K	30.4	Very low	29.1	Very low	143 Å²	143	134.5 Å²	134.5	62%	0.622	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-59.1	-21.7	177.4	-69.4	-173.7	173.7	-177.1	0	113.7	D106 H112	D106-K108 PolarHBondContact O-N 2.86Å; K108-H112 PolarHBondContact O-CD2 2.9Å; K108-H112 VanDerWaalsContact O-CD2 3.32Å
109	K	32.4	Very low	29.5	Very low	149 Å²	149	132.9 Å²	132.9	65%	0.648	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-79.4	-17	175.2	-67.8	176.7	-174.2	161	0	114.1	D106 W107	D106-K109 PolarHBondContact O-N 2.02Å; D106-K109 VanDerWaalsContact O-N 3.12Å; D106-K109 WeakPolarHBondContact OD1-CD 3.18Å; D106-K109 WeakPolarHBondContact OD1-CE 3.06Å; D106-K109 IonicContact OD1-NZ 2.66Å; D106-K109 PolarHBondContact OD1-NZ 3.33Å; D106-K109 WeakPolarHBondContact OD2-CE 3.32Å; D106-K109 IonicContact OD2-NZ 3.73Å; D106-K109 PolarHBondContact OD2-NZ 2.91Å; W107-K109 PolarHBondContact O-N 3.3Å; W107-K109 VanDerWaalsContact O-N 3.11Å
110	V	33.3	Very low	29.9	Very low	109 Å²	109	130.4 Å²	130.4	66%	0.661	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-25.8	-172.4	-173.8	0	0	0	0	112.6	W107	W107-V110 PolarHBondContact O-N 2.9Å
111	L	28.7	Very low	30.3	Very low	99 Å²	99	125.2 Å²	125.2	52%	0.518	66%	0.655	S	S	.	*			trans	-98.1	10.1	-172.3	-65.8	177.4	0	0	0	115.2	W107 G113	W107-L111 HydrophobicContact CE3-CD1 3.94Å; W107-L111 HydrophobicContact CZ3-CD1 4.03Å; L111-G113 PolarHBondContact O-N 3.49Å; L111-G113 VanDerWaalsContact O-N 3.14Å
112	H	26.3	Very low	30.5	Very low	164 Å²	164	125.2 Å²	125.2	76%	0.759	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	113.3	177.8	-90.6	-84.5	0	0	0	112.1	K108	K108-H112 PolarHBondContact O-CD2 2.9Å; K108-H112 VanDerWaalsContact O-CD2 3.32Å
113	G	26.5	Very low	30.7	Very low	83 Å²	83	126.2 Å²	126.2	86%	0.856	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	86.3	30.9	159.8	0	0	0	0	0	117.1	L111	L111-G113 PolarHBondContact O-N 3.49Å; L111-G113 VanDerWaalsContact O-N 3.14Å
114	R	26.8	Very low	30.8	Very low	190 Å²	190	128.4 Å²	128.4	72%	0.717	66%	0.662	S	S	*	*			trans	-106.6	127.1	175	-64.1	-170.2	-179.4	-159	-1.9	112.2
115	L	27.2	Very low	30.7	Very low	108 Å²	108	126.5 Å²	126.5	57%	0.565	65%	0.652	S	S	*	*			trans	-87.2	130.1	175.7	-177	73.4	0	0	0	108.9	V44 L117	V44-L115 HydrophobicContact CG1-CD1 3.62Å; V44-L115 HydrophobicContact CG2-CD1 4.25Å; L115-L117 HydrophobicContact CD2-CD1 3.86Å; L115-L117 HydrophobicContact CD2-CD2 4.28Å; L115-L117 HydrophobicContact CD2-CG 3.97Å; L115-L117 HydrophobicContact CG-CD1 4.48Å; L115-L117 HydrophobicContact CG-CG 4.15Å
116	F	31.7	Very low	30.2	Very low	111 Å²	111	126.9 Å²	126.9	49%	0.487	66%	0.658	S	S	.	*			trans	-99.3	137.3	170.6	-61	-90	0	0	0	108.8	W89	W89-F116 HydrophobicContact CH2-CD1 4.48Å; W89-F116 HydrophobicContact CH2-CE1 4.09Å; W89-F116 HydrophobicContact CZ3-CD1 4.4Å; W89-F116 AromaticContact CZ3-CE1 3.92Å; W89-F116 HydrophobicContact CZ3-CE1 3.92Å
117	L	28.2	Very low	29.7	Very low	90 Å²	90	133.3 Å²	133.3	47%	0.471	68%	0.679	S	S	.	*			trans	-137.2	130.9	-174.8	-78.2	168.3	0	0	0	109.9	L115	L115-L117 HydrophobicContact CD2-CD1 3.86Å; L115-L117 HydrophobicContact CD2-CD2 4.28Å; L115-L117 HydrophobicContact CD2-CG 3.97Å; L115-L117 HydrophobicContact CG-CD1 4.48Å; L115-L117 HydrophobicContact CG-CG 4.15Å
118	C	30.1	Very low	29.4	Very low	54 Å²	54	133.4 Å²	133.4	37%	0.365	69%	0.694	S	S	.	*			trans	-102.9	127.8	170.2	-53.7	0	0	0	0	108.1
119	L	38.2	Very low	29.3	Very low	138 Å²	138	134.7 Å²	134.7	72%	0.723	70%	0.702	S	S	*	*			trans	-144.5	158.2	-173.9	-68.5	174.1	0	0	0	110.7
120	Q	31.6	Very low	28.9	Very low	160 Å²	160	136.7 Å²	136.7	75%	0.748	71%	0.711	S	S	*	*			trans	-134.1	124	-165.8	-175.5	-172.3	25.2	0	0	111.6
121	S	35.9	Very low	28.7	Very low	111 Å²	111	136.9 Å²	136.9	78%	0.776	72%	0.715	S	S	*	*			trans	-167.6	141.3	166.4	60.3	0	0	0	0	112.3
122	E	30.5	Very low	28.6	Very low	174 Å²	174	137.3 Å²	137.3	81%	0.813	73%	0.726	S	S	*	*			trans	-107	162.5	164.4	-64.8	-175.1	149.2	0	0	110.9
123	N	31.6	Very low	28.7	Very low	145 Å²	145	138.3 Å²	138.3	78%	0.775	73%	0.731	S	S	*	*			trans	66.2	89.4	170.6	-59	-57.5	0	0	0	117.9
124	I	28.9	Very low	28.8	Very low	176 Å²	176	140.4 Å²	140.4	90%	0.903	73%	0.732	S	S	*	*				-169.8	132.2	123.7	-95.6	152.3	0	0	0	108
125	L	24.7	Very low	28.6	Very low	127 Å²	127	139 Å²	139	67%	0.665	74%	0.738	S	S	*	*			trans	-151.9	100.2	178.1	-155	175.2	0	0	0	111.3	Y127	L125-Y127 HydrophobicContact CD2-CD2 4.02Å; L125-Y127 HydrophobicContact CD2-CE2 4.43Å
126	C	25.7	Very low	28.5	Very low	129 Å²	129	143.6 Å²	143.6	87%	0.872	75%	0.753	S	S	*	*			trans	-142.1	115.2	161.9	-85.3	0	0	0	0	109
127	Y	22.7	Very low	28.2	Very low	206 Å²	206	144.8 Å²	144.8	81%	0.808	77%	0.77	S	S	*	*			trans	-90.6	150.1	165.9	-84.5	-102	0	0	0	109.7	L125	L125-Y127 HydrophobicContact CD2-CD2 4.02Å; L125-Y127 HydrophobicContact CD2-CE2 4.43Å
128	T	26.5	Very low	28.1	Very low	135 Å²	135	149.1 Å²	149.1	83%	0.828	79%	0.788	S	S	*	*				-167.4	126.5	116.8	34.3	0	0	0	0	111.7
129	E	26.8	Very low	27.9	Very low	170 Å²	170	151.1 Å²	151.1	79%	0.794	81%	0.808	S	S	*	*			trans	29	110.1	144	-49.1	-156.9	108.3	0	0	122.4
130	K	25.2	Very low	27.5	Very low	192 Å²	192	149.4 Å²	149.4	84%	0.835	81%	0.805	S	S	*	*				39.3	149.6	115.1	-79.4	-176.2	177.8	174.4	0	121.7
131	P	29.2	Very low	27.4	Very low	112 Å²	112	152.3 Å²	152.3	73%	0.727	81%	0.811	S	S	*	*			cis	-150.3	95.8	-40.1	37.2	-14.9	0	0	0	114.1
132	S	27	Very low	27.1	Very low	109 Å²	109	152 Å²	152	76%	0.762	82%	0.815	S	S	*	*			trans	-156.3	112.2	171.1	61.5	0	0	0	0	117.5
133	H	28	Very low	26.9	Very low	184 Å²	184	147.2 Å²	147.2	85%	0.852	81%	0.812	S	S	*	*			trans	50.9	140.2	143.8	-65.6	-88.3	0	0	0	123
134	S	28.4	Very low	26.8	Very low	127 Å²	127	148.1 Å²	148.1	89%	0.888	82%	0.816	S	S	*	*			trans	79.8	127.1	166.5	79.1	0	0	0	0	117.4
135	L	22.3	Very low	26.6	Very low	162 Å²	162	145.1 Å²	145.1	85%	0.848	81%	0.81	S	S	*	*			trans	-104.5	116.7	-173	-168.2	92	0	0	0	109.9
136	K	25.8	Very low	27	Very low	203 Å²	203	145.3 Å²	145.3	88%	0.883	82%	0.819	S	S	*	*			trans	-142.7	115.7	161.2	-84	-168.9	175.8	179.3	0	110.1
137	V	25.1	Very low	27	Very low	136 Å²	136	144.8 Å²	144.8	82%	0.824	81%	0.812	S	S	*	*			trans	-94.9	124.8	172	179.4	0	0	0	0	108.2
138	Q	25.9	Very low	27.2	Very low	182 Å²	182	145.3 Å²	145.3	85%	0.85	81%	0.814	S	S	*	*			trans	-144.6	114.5	174.7	-169.2	168	-5.3	0	0	108.6
139	A	26.4	Very low	27.1	Very low	96 Å²	96	148.5 Å²	148.5	79%	0.793	82%	0.817	S	S	*	*			trans	-110.8	139.7	-169.9	0	0	0	0	0	112.2
140	P	28.8	Very low	27	Very low	101 Å²	101	148.5 Å²	148.5	66%	0.656	82%	0.816	S	S	*	*			trans	-113.2	129	162.8	6.8	15.5	0	0	0	112.2
141	Y	30.3	Very low	27.1	Very low	222 Å²	222	144.8 Å²	144.8	87%	0.871	81%	0.809	S	S	*	*			trans	57.6	101.9	165.4	-47.3	-72.1	0	0	0	117
142	A	28.7	Very low	26.8	Very low	105 Å²	105	148.5 Å²	148.5	87%	0.868	82%	0.815	S	S	*	*				85.8	104.6	51.7	0	0	0	0	0	114.1
143	G	27.9	Very low	26.9	Very low	72 Å²	72	150.3 Å²	150.3	74%	0.742	82%	0.821	S	S	*	*			trans	172.3	90.2	178	0	0	0	0	0	112.6
144	D	29.6	Very low	26.7	Very low	164 Å²	164	150.3 Å²	150.3	88%	0.877	82%	0.821	S	S	*	*			trans	33.9	103.1	165.1	-63.6	-3.1	0	0	0	121.2
145	C	23.9	Very low	26.6	Very low	114 Å²	114	149.5 Å²	149.5	77%	0.77	82%	0.816	S	S	*	*			trans	-104.7	126.6	156.4	-72.7	0	0	0	0	110.4	T147	C145-T147 PolarHBondContact O-N 3.02Å
146	P	32.3	Very low	26.9	Very low	130 Å²	130	147.7 Å²	147.7	84%	0.844	81%	0.812	S	S	*	*			trans	-74.5	104.3	174.6	-14.4	29.6	0	0	0	111.7
147	T	27.3	Very low	26.9	Very low	119 Å²	119	147.6 Å²	147.6	73%	0.73	81%	0.807	S	S	*	*			trans	-84.7	122.9	-179.4	51.8	0	0	0	0	113.1	C145	C145-T147 PolarHBondContact O-N 3.02Å
148	Y	25.2	Very low	26.9	Very low	217 Å²	217	147.1 Å²	147.1	85%	0.851	80%	0.8	S	S	*	*			trans	-145.6	66.4	157.7	-95.1	-66.8	0	0	0	112.7
149	F	26.2	Very low	27.1	Very low	201 Å²	201	146.3 Å²	146.3	88%	0.882	80%	0.796	S	S	*	*			trans	-132.3	97.2	160.5	-100.2	-82.9	0	0	0	110.2	V151	F149-V151 PolarHBondContact O-N 2.87Å
150	H	23.8	Very low	27.1	Very low	171 Å²	171	148 Å²	148	79%	0.792	79%	0.788	S	S	*	*			trans	-81.7	106.8	170.5	-99.5	-77	0	0	0	110.1
151	V	27	Very low	27	Very low	113 Å²	113	150.8 Å²	150.8	69%	0.685	79%	0.785	S	S	*	*			trans	-130.2	131.8	159.6	-177.7	0	0	0	0	108.3	F149	F149-V151 PolarHBondContact O-N 2.87Å
152	F	22.7	Very low	26.8	Very low	191 Å²	191	149.4 Å²	149.4	84%	0.838	78%	0.779	S	S	*	*			trans	-78.9	128.8	-179.9	-76.7	-112.3	0	0	0	111.2
153	T	28.7	Very low	26.8	Very low	147 Å²	147	151.3 Å²	151.3	90%	0.902	77%	0.773	S	S	*	*			trans	-135.3	152.6	146.1	43.6	0	0	0	0	109
154	Q	24.1	Very low	26.7	Very low	183 Å²	183	153.3 Å²	153.3	86%	0.855	77%	0.771	S	S	*	*			trans	-120.8	157.1	-155.3	-171.7	175	0.4	0	0	112.2
155	S	26.7	Very low	26.6	Very low	111 Å²	111	156.3 Å²	156.3	78%	0.776	77%	0.77	S	S	*	*			trans	72.7	153.8	179.9	82.8	0	0	0	0	114.6
156	T	28.7	Very low	26.8	Very low	124 Å²	124	159.9 Å²	159.9	76%	0.761	77%	0.773	S	S	*	*			cis	-137.3	138.4	17.2	49	0	0	0	0	115.2
157	Y	26.4	Very low	26.5	Very low	201 Å²	201	158.2 Å²	158.2	79%	0.788	76%	0.763	S	S	*	*			trans	71.7	100.2	138.2	-133.5	-100.6	0	0	0	123.3
158	N	25.2	Very low	26.5	Very low	125 Å²	125	157.9 Å²	157.9	67%	0.668	76%	0.761	S	S	*	*				18.7	121.1	129.4	-54.6	-30.7	0	0	0	121.1
159	Q	29.1	Very low	26.5	Very low	165 Å²	165	154.7 Å²	154.7	77%	0.771	76%	0.758	S	S	*	*				-177.1	128.6	103.2	-95.7	173	-2.6	0	0	109.4
160	E	26.8	Very low	26.5	Very low	132 Å²	132	155.3 Å²	155.3	62%	0.617	76%	0.761	S	S	*	*				60.7	132.7	87.2	-62.3	-138.8	133.9	0	0	114.2
161	R	26.4	Very low	26.6	Very low	159 Å²	159	155.4 Å²	155.4	60%	0.6	76%	0.762	S	S	*	*			cis	-174.4	159	9	-119.8	174.9	-172	163.2	20.4	112
162	R	26.2	Very low	26.6	Very low	194 Å²	194	155.8 Å²	155.8	73%	0.732	76%	0.764	S	S	*	*			trans	65.2	152.2	148	-67.2	168.9	-179.9	174.7	-0.6	117.7
163	L	29.4	Very low	26.8	Very low	144 Å²	144	152 Å²	152	75%	0.754	76%	0.759	S	S	*	*			cis	-136.1	135.3	3.6	-75.8	94.9	0	0	0	108.2
164	T	25.4	Very low	26.6	Very low	114 Å²	114	152 Å²	152	70%	0.699	75%	0.752	S	S	*	*				62.5	104	64	66	0	0	0	0	118.5
165	R	28	Very low	26.6	Very low	228 Å²	228	151.6 Å²	151.6	86%	0.86	75%	0.747	S	S	*	*			trans	-174.2	121.5	135.4	-98.1	154.5	-165.4	-143.7	4	109.6
166	K	26.4	Very low	26.5	Very low	189 Å²	189	154.8 Å²	154.8	82%	0.822	75%	0.75	S	S	*	*				71.4	135	101	-71.8	-166.9	172.9	-169	0	114.5
167	C	26.8	Very low	26.2	Very low	94 Å²	94	152.5 Å²	152.5	64%	0.635	75%	0.751	S	S	*	*			cis	-157.9	141.9	10.1	-119.9	0	0	0	0	115.1
168	T	27.1	Very low	26.1	Very low	112 Å²	112	151.7 Å²	151.7	69%	0.687	76%	0.757	S	S	*	*			trans	46.2	115.8	141.3	57.1	0	0	0	0	123.7
169	N	25.5	Very low	26.1	Very low	150 Å²	150	152.6 Å²	152.6	80%	0.802	77%	0.767	S	S	*	*				43.7	116.2	125.3	-55	9.3	0	0	0	121.5
170	F	26	Very low	25.9	Very low	214 Å²	214	150.6 Å²	150.6	94%	0.939	76%	0.76	S	S	*	*			trans	-142.3	151.1	130.5	-113.4	-84.7	0	0	0	109.3
171	H	25.1	Very low	25.9	Very low	174 Å²	174	155.9 Å²	155.9	81%	0.806	78%	0.775	S	S	*	*			trans	-148.8	101.4	-165	-163.1	-63.4	0	0	0	112
172	V	26.8	Very low	25.9	Very low	120 Å²	120	156.3 Å²	156.3	73%	0.727	78%	0.784	S	S	*	*			trans	-145.6	125.3	171.8	-174.8	0	0	0	0	109.5
173	P	27	Very low	26	Very low	112 Å²	112	157.2 Å²	157.2	73%	0.727	79%	0.788	S	S	*	*			trans	-104.9	126.3	177.7	35.5	-27.9	0	0	0	112.6
174	I	26.3	Very low	25.8	Very low	148 Å²	148	154.5 Å²	154.5	76%	0.759	78%	0.778	S	S	*	*			trans	-140.3	117.4	169.5	-61.5	-176.2	0	0	0	111
175	F	24.2	Very low	25.9	Very low	174 Å²	174	152.5 Å²	152.5	76%	0.763	77%	0.768	S	S	*	*			trans	26.5	126	150	-72.7	-96	0	0	0	122.9
176	E	23.2	Very low	26	Very low	177 Å²	177	147.1 Å²	147.1	83%	0.827	75%	0.752	S	S	*	*			trans	46.5	115.4	130.1	-61	-176.7	147.3	0	0	121.2
177	G	22.3	Very low	26.4	Very low	77 Å²	77	142.8 Å²	142.8	79%	0.794	74%	0.737	S	S	*	*			trans	89.8	82.4	130.3	0	0	0	0	0	118.7
178	M	25.1	Very low	26.6	Very low	184 Å²	184	144.3 Å²	144.3	91%	0.906	74%	0.738	S	S	*	*			trans	-153	136.8	149.7	-110.5	174	-161.6	0	0	112.2
179	T	24.3	Very low	26.9	Very low	143 Å²	143	143.2 Å²	143.2	88%	0.877	73%	0.728	S	S	*	*			trans	-101.7	105	-179.6	49	0	0	0	0	111.2
180	I	25.8	Very low	27.3	Very low	124 Å²	124	146.1 Å²	146.1	64%	0.636	73%	0.733	S	S	*	*			trans	-137.6	119.5	172.4	-56.9	-179.5	0	0	0	109.6	Q182	I180-Q182 HydrophobicContact CG2-CG 3.76Å
181	R	26.1	Very low	27.9	Very low	242 Å²	242	144.2 Å²	144.2	91%	0.913	73%	0.728	S	S	*	*			trans	-112.8	114.6	154.7	-80.7	-173.2	173.1	-172	-2.9	107
182	Q	27.2	Very low	28.6	Very low	169 Å²	169	141.7 Å²	141.7	79%	0.79	72%	0.72	S	S	*	*			trans	-89.2	146.5	174.1	-82.9	164.4	-26.6	0	0	110.2	I180	I180-Q182 HydrophobicContact CG2-CG 3.76Å
183	Y	27.1	Very low	29	Very low	212 Å²	212	143.1 Å²	143.1	83%	0.831	72%	0.724	S	S	*	*			trans	-84.6	146.8	177.4	-61.4	-90	0	0	0	110.6
184	V	26.1	Very low	29.2	Very low	88 Å²	88	143.4 Å²	143.4	53%	0.533	72%	0.715	S	S	.	*			trans	-126.2	128.2	175.3	178	0	0	0	0	108	I197	V184-I197 HydrophobicContact CG1-CG2 3.7Å
185	C	27.9	Very low	29.3	Very low	72 Å²	72	140.7 Å²	140.7	49%	0.486	70%	0.701	S	S	.	*			trans	-91.6	137.7	173.1	-66.1	0	0	0	0	110.1
186	H	29.7	Very low	29.8	Very low	115 Å²	115	139.1 Å²	139.1	53%	0.532	69%	0.692	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.2	129	173.7	-75.2	-95.4	0	0	0	109.3	L195	H186-L195 HydrophobicContact CB-CD1 4.1Å
187	I	34.7	Very low	30.2	Very low	98 Å²	98	135.8 Å²	135.8	50%	0.503	68%	0.678	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.5	125.8	173.4	-58.3	177.6	0	0	0	108.4	Y196	I187-Y196 PolarHBondContact N-O 3.04Å; I187-Y196 PolarHBondContact O-N 3.01Å
188	L	31.4	Very low	30.9	Very low	126 Å²	126	135.9 Å²	135.9	66%	0.66	66%	0.664	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-108.9	111.9	169	-86.5	164.1	0	0	0	108.1	L195	L188-L195 HydrophobicContact CD2-CD1 4.03Å; L188-L195 HydrophobicContact CG-CD1 3.87Å
189	D	32.6	Very low	31	Very low	89 Å²	89	130.4 Å²	130.4	48%	0.476	65%	0.654	S	S	.	*			trans	-77.7	139.7	165.5	-161.4	-46.6	0	0	0	109	Q191	D189-Q191 VanDerWaalsContact C-N 3.32Å; D189-Q191 PolarHBondContact OD1-N 2.9Å
190	K	34.6	Very low	31.3	Very low	210 Å²	210	128 Å²	128	91%	0.913	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-3.9	-179.9	-83.3	-178.8	175.5	171.7	0	114
191	Q	38.7	Very low	31.6	Very low	175 Å²	175	128.9 Å²	128.9	82%	0.818	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-29.7	-177.4	-61.7	-162.8	-7.5	0	0	115	D189	D189-Q191 VanDerWaalsContact C-N 3.32Å; D189-Q191 PolarHBondContact OD1-N 2.9Å
192	D	39.7	Very low	32	Very low	121 Å²	121	125.4 Å²	125.4	65%	0.647	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.6	-0.8	-170.1	-83	-40.3	0	0	0	115.9	Q194	D192-Q194 PolarHBondContact O-N 3.02Å; D192-Q194 VanDerWaalsContact O-N 3.14Å
193	D	34.4	Very low	32.1	Very low	150 Å²	150	122.3 Å²	122.3	80%	0.802	64%	0.635	S	S	*	*			trans	55.7	31.8	178	-126	11.2	0	0	0	113.4
194	Q	31.4	Very low	32.2	Very low	118 Å²	118	117.2 Å²	117.2	55%	0.551	63%	0.63	S	S	*	*			trans	-118.6	144.5	179.3	-69.9	-58.4	-77.2	0	0	112.4	D192 Y196	D192-Q194 PolarHBondContact O-N 3.02Å; D192-Q194 VanDerWaalsContact O-N 3.14Å; Q194-Y196 HydrophobicContact CB-CE2 4.04Å
195	L	29	Very low	32.5	Very low	90 Å²	90	121.4 Å²	121.4	47%	0.471	64%	0.644	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.1	112.7	-176.5	-176.9	72.4	0	0	0	110.6	H186 L188	H186-L195 HydrophobicContact CB-CD1 4.1Å; L188-L195 HydrophobicContact CD2-CD1 4.03Å; L188-L195 HydrophobicContact CG-CD1 3.87Å
196	Y	35.3	Very low	32.6	Very low	142 Å²	142	126.4 Å²	126.4	56%	0.557	67%	0.665	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-98.9	127	176.7	-68.5	-84.2	0	0	0	111.3	I187 Q194	I187-Y196 PolarHBondContact N-O 3.04Å; I187-Y196 PolarHBondContact O-N 3.01Å; Q194-Y196 HydrophobicContact CB-CE2 4.04Å
197	I	30.6	Very low	32.5	Very low	106 Å²	106	129.7 Å²	129.7	54%	0.544	68%	0.677	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.5	119.6	176.1	-55.9	176.5	0	0	0	107.6	V184	V184-I197 HydrophobicContact CG1-CG2 3.7Å
198	T	36.8	Very low	32.1	Very low	80 Å²	80	131.8 Å²	131.8	49%	0.491	69%	0.69	S	S	.	*			trans	-130.4	152.5	-177.8	67.7	0	0	0	0	112
199	G	28.6	Very low	32	Very low	68 Å²	68	132.1 Å²	132.1	70%	0.701	69%	0.692	S	S	*	*			trans	-77.8	137.3	-179.1	0	0	0	0	0	112.5	N201	G199-N201 PolarHBondContact O-N 3.29Å
200	V	30.5	Very low	31.8	Very low	93 Å²	93	137.1 Å²	137.1	56%	0.564	71%	0.71	S	S	*	*	S	Bend	trans	-70.2	100.2	-174.6	-175.4	0	0	0	0	111.5
201	N	31.4	Very low	31.4	Very low	143 Å²	143	136.6 Å²	136.6	77%	0.765	71%	0.708	S	S	*	*	S	Bend	trans	-151.6	-6	165.8	-101.7	-32.8	0	0	0	115.1	G199	G199-N201 PolarHBondContact O-N 3.29Å
202	H	34.4	Very low	30.9	Very low	169 Å²	169	134.9 Å²	134.9	78%	0.782	71%	0.71	S	S	*	*			trans	-132.8	10.6	-169.3	-72.3	-11.2	0	0	0	116.1	S204	H202-S204 PolarHBondContact O-N 2.04Å
203	C	28.8	Very low	30.3	Very low	104 Å²	104	135.4 Å²	135.4	70%	0.703	72%	0.721	S	S	*	*			trans	-80.1	37.4	-175.7	-59.2	0	0	0	0	114.8
204	S	29.5	Very low	30.1	Very low	104 Å²	104	132.1 Å²	132.1	73%	0.727	72%	0.723	S	S	*	*	S	Bend	trans	-123.8	18.5	-169	55	0	0	0	0	115.1	H202	H202-S204 PolarHBondContact O-N 2.04Å
205	Q	32.1	Very low	29.9	Very low	177 Å²	177	135.4 Å²	135.4	83%	0.827	74%	0.738	S	S	*	*	S	Bend	trans	-137	5.5	-170.8	-67.9	-166	-19	0	0	116.8
206	L	29.9	Very low	29.9	Very low	177 Å²	177	138.9 Å²	138.9	93%	0.927	76%	0.757	S	S	*	*			trans	-110.1	138.2	-179.5	-66.2	174.9	0	0	0	111.6
207	K	27.8	Very low	29.6	Very low	183 Å²	183	134 Å²	134	80%	0.796	75%	0.751	S	S	*	*			trans	-98.8	154.3	177.9	-72.3	-174.7	171.6	-172.5	0	110.8
208	D	27.6	Very low	29.4	Very low	143 Å²	143	133.1 Å²	133.1	77%	0.765	76%	0.759	S	S	*	*	S	Bend	trans	68.6	148.5	161.7	-47.4	-37.6	0	0	0	116.1
209	D	28.9	Very low	28.9	Very low	133 Å²	133	137 Å²	137	71%	0.711	77%	0.769	S	S	*	*	S	Bend	trans	60.8	101.5	174.8	-65.2	-18.6	0	0	0	121.3
210	F	28.1	Very low	29.1	Very low	193 Å²	193	139.7 Å²	139.7	85%	0.846	77%	0.774	S	S	*	*			trans	49	115.7	145.1	-61.6	-86.5	0	0	0	121.4
211	F	25.1	Very low	28.9	Very low	199 Å²	199	140.8 Å²	140.8	87%	0.873	79%	0.785	S	S	*	*			trans	-119.5	143.1	164.3	-72.7	-89.9	0	0	0	112.3
212	T	28.8	Very low	28.9	Very low	140 Å²	140	138.9 Å²	138.9	86%	0.859	77%	0.774	S	S	*	*			trans	-133.1	127.6	171.6	53.7	0	0	0	0	110.8
213	C	28	Very low	29	Very low	131 Å²	131	142 Å²	142	89%	0.885	78%	0.779	S	S	*	*			trans	-102.2	118.1	175.6	-64.4	0	0	0	0	110.3
214	G	28.7	Very low	29.4	Very low	82 Å²	82	143.5 Å²	143.5	85%	0.845	78%	0.781	S	S	*	*			trans	-82.4	157.3	175.5	0	0	0	0	0	113
215	H	28.2	Very low	29.7	Very low	187 Å²	187	146.8 Å²	146.8	87%	0.866	78%	0.777	S	S	*	*			trans	-142.5	127.8	175.3	-153.8	-66.5	0	0	0	109.4
216	D	29.5	Very low	29.8	Very low	162 Å²	162	142.8 Å²	142.8	87%	0.866	77%	0.765	S	S	*	*			trans	-66.3	135.3	179.4	-69.9	-53.6	0	0	0	111.3
217	G	28.7	Very low	30.2	Very low	41 Å²	41	140.7 Å²	140.7	42%	0.423	75%	0.748	S	S	.	*			trans	171.8	1.7	-176	0	0	0	0	0	119.7	A911	G217-A911 WeakPolarHBondContact O-CB 3.21Å
218	A	26.5	Very low	31.2	Very low	86 Å²	86	132.7 Å²	132.7	71%	0.711	72%	0.716	S	S	*	*			trans	57	71.6	167.5	0	0	0	0	0	118.4
219	F	27	Very low	32.2	Very low	162 Å²	162	127.7 Å²	127.7	71%	0.711	69%	0.692	S	S	*	*			trans	-138.1	149.5	143.1	-89.4	-80	0	0	0	109.1	C221 A911	F219-C221 PolarHBondContact O-N 3.42Å; F219-A911 WeakPolarHBondContact CE2-O 3.46Å
220	P	32.3	Very low	33.5	Very low	124 Å²	124	125.6 Å²	125.6	81%	0.805	68%	0.681	S	S	*	*			trans	-77	123.2	-173	30	-33	0	0	0	111.8	D222	P220-D222 PolarHBondContact O-N 2.89Å
221	C	26.6	Very low	34.6	Very low	117 Å²	117	120.5 Å²	120.5	79%	0.791	66%	0.658	S	S	*	*			trans	-71.1	113.4	178.9	-58.1	0	0	0	0	112	F219 R223	F219-C221 PolarHBondContact O-N 3.42Å; C221-R223 PolarHBondContact O-N 3.45Å
222	D	31.7	Very low	36.4	Very low	102 Å²	102	113.1 Å²	113.1	55%	0.545	63%	0.628	S	S	.	*			trans	-61.6	121.8	158.8	176	17.8	0	0	0	109	P220 N224 R225	P220-D222 PolarHBondContact O-N 2.89Å; D222-N224 VanDerWaalsContact C-N 3.26Å; D222-N224 PolarHBondContact O-N 2.91Å; D222-R225 IonicContact OD2-NE 3.11Å
223	R	34.8	Very low	37.7	Very low	234 Å²	234	114 Å²	114	88%	0.883	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-2.8	-163.5	-75.8	-175.3	170.9	-176.6	-3.4	115	C221	C221-R223 PolarHBondContact O-N 3.45Å
224	N	36.8	Very low	38.5	Very low	137 Å²	137	115.2 Å²	115.2	73%	0.733	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.3	22.5	-161.9	-65.1	-40.3	0	0	0	115.6	D222	D222-N224 VanDerWaalsContact C-N 3.26Å; D222-N224 PolarHBondContact O-N 2.91Å
225	R	36.3	Very low	39.4	Very low	173 Å²	173	116.1 Å²	116.1	65%	0.653	61%	0.605	S	S	*	*			trans	-108.3	104.5	176.4	-62.7	-172.3	-175	-141.6	-4.1	111.4	D222	D222-R225 IonicContact OD2-NE 3.11Å
226	T	35.3	Very low	40.3	Very low	92 Å²	92	113.4 Å²	113.4	56%	0.564	60%	0.597	S	S	*	*			trans	-68.7	129.3	171.9	36.9	0	0	0	0	110.8	E244	T226-E244 PolarHBondContact OG1-OE2 3.03Å
227	F	38.1	Very low	41.4	Very low	134 Å²	134	110.2 Å²	110.2	59%	0.588	58%	0.576	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.6	110	166.3	-92.2	-98.8	0	0	0	108.6	Y241 Y243	F227-Y241 HydrophobicContact CD1-CD1 4.33Å; F227-Y243 AromaticContact CE1-CE1 3.93Å; F227-Y243 HydrophobicContact CE1-CE1 3.93Å; F227-Y243 AromaticContact CE2-CE1 3.94Å; F227-Y243 HydrophobicContact CE2-CE1 3.94Å; F227-Y243 AromaticContact CZ-CE1 3.56Å; F227-Y243 HydrophobicContact CZ-CE1 3.56Å; F227-Y243 AromaticContact CZ-CZ 3.95Å
228	A	47.6	Very low	42.6	Very low	14 Å²	14	109.7 Å²	109.7	12%	0.116	57%	0.566	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.8	144.9	166.9	0	0	0	0	0	109.5	Y241 Y242 E244	A228-Y241 CarbonylContact O-C 3.6Å; A228-Y241 WeakPolarHBondContact O-CA 2.98Å; A228-Y242 HydrophobicContact CB-CD1 4.22Å; A228-Y242 HydrophobicContact CB-CD2 3.84Å; A228-Y242 HydrophobicContact CB-CE1 3.87Å; A228-Y242 HydrophobicContact CB-CE2 3.45Å; A228-Y242 VanDerWaalsContact CB-CE2 3.45Å; A228-Y242 HydrophobicContact CB-CG 4.21Å; A228-Y242 VanDerWaalsContact CB-CZ 3.47Å; A228-Y242 PolarHBondContact N-O 3.48Å; A228-Y242 VanDerWaalsContact N-O 3.1Å; A228-Y242 PolarHBondContact O-N 3.19Å; A228-E244 HydrophobicContact CB-CG 3.97Å
229	C	49.8	Very low	44	Very low	39 Å²	39	108.1 Å²	108.1	26%	0.264	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	144	174.2	121	0	0	0	0	111	F231 C238 S240 Y241	C229-F231 PolarHBondContact O-N 3.38Å; C229-C238 HydrophobicContact CB-CB 3.67Å; C229-C238 WeakPolarHBondContact CB-SG 3.29Å; C229-C238 WeakPolarHBondContact SG-CB 3.49Å; C229-C238 CovalentContact SG-SG 2.03Å; C229-C238 PolarHBondContact SG-SG 2.99Å; C229-S240 WeakPolarHBondContact CA-O 3.21Å; C229-Y241 HydrophobicContact CB-CD1 3.52Å; C229-Y241 HydrophobicContact CB-CE1 3.53Å; C229-Y241 HydrophobicContact CB-CG 4.29Å
230	N	56.7	Low	44.5	Very low	88 Å²	88	102.7 Å²	102.7	47%	0.471	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	92.8	169.3	-166.2	7.2	0	0	0	107.3	C238 V239 S240	N230-C238 CarbonylContact O-C 3.35Å; N230-C238 WeakPolarHBondContact O-CA 3.47Å; N230-V239 HydrophobicContact CB-CG2 4.46Å; N230-V239 VanDerWaalsContact O-CG2 3.26Å; N230-V239 WeakPolarHBondContact O-CG2 3.49Å; N230-V239 PolarHBondContact O-N 3.01Å; N230-S240 VanDerWaalsContact CB-OG 3.24Å; N230-S240 WeakPolarHBondContact CB-OG 3.46Å; N230-S240 PolarHBondContact N-O 2.78Å
231	F	51.3	Low	45.1	Very low	86 Å²	86	103.9 Å²	103.9	38%	0.377	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	124	-174	-165.9	-92.5	0	0	0	111.1	C229 H233	C229-F231 PolarHBondContact O-N 3.38Å; F231-H233 AromaticContact CD1-ND1 3.95Å; F231-H233 AromaticContact CE1-ND1 3.97Å
232	N	61.7	Low	45.8	Very low	44 Å²	44	104.1 Å²	104.1	24%	0.235	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	112.2	171.6	-175.8	-43.8	0	0	0	109.1	D234 L235 N236 H237 V239	N232-D234 WeakPolarHBondContact OD1-CB 3.27Å; N232-D234 PolarHBondContact OD1-N 3.18Å; N232-L235 HydrophobicContact CB-CB 4.2Å; N232-L235 HydrophobicContact CB-CD1 4.48Å; N232-L235 HydrophobicContact CB-CG 4.47Å; N232-L235 PolarHBondContact O-N 3.13Å; N232-L235 PolarHBondContact OD1-N 3.28Å; N232-N236 WeakPolarHBondContact O-CA 3.36Å; N232-N236 PolarHBondContact O-N 2.75Å; N232-H237 PolarHBondContact N-O 3.01Å; N232-H237 PolarHBondContact O-N 3.43Å; N232-V239 HydrophobicContact CB-CB 4.42Å; N232-V239 HydrophobicContact CB-CG1 3.57Å; N232-V239 HydrophobicContact CB-CG2 3.98Å
233	H	56.2	Low	46.1	Very low	160 Å²	160	106.9 Å²	106.9	74%	0.741	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-33.2	-179.4	-76.8	-76.6	0	0	0	113.7	F231	F231-H233 AromaticContact CD1-ND1 3.95Å; F231-H233 AromaticContact CE1-ND1 3.97Å
234	D	45.6	Very low	46.4	Very low	156 Å²	156	101.2 Å²	101.2	83%	0.834	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-32.7	179.5	-56.2	-48.9	0	0	0	112.1	N232	N232-D234 WeakPolarHBondContact OD1-CB 3.27Å; N232-D234 PolarHBondContact OD1-N 3.18Å
235	L	46	Very low	46.4	Very low	100 Å²	100	104.6 Å²	104.6	52%	0.524	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-1	179	-54.9	179.1	0	0	0	113.4	N232 H237 V239	N232-L235 HydrophobicContact CB-CB 4.2Å; N232-L235 HydrophobicContact CB-CD1 4.48Å; N232-L235 HydrophobicContact CB-CG 4.47Å; N232-L235 PolarHBondContact O-N 3.13Å; N232-L235 PolarHBondContact OD1-N 3.28Å; L235-H237 VanDerWaalsContact CB-CE1 3.49Å; L235-H237 WeakPolarHBondContact CB-CE1 3.18Å; L235-H237 WeakPolarHBondContact CB-ND1 3.23Å; L235-H237 PolarHBondContact O-N 2.88Å; L235-H237 VanDerWaalsContact O-N 3.14Å; L235-H237 PolarHBondContact O-ND1 2.99Å; L235-V239 HydrophobicContact CD1-CG1 4.19Å
236	N	48	Very low	46.2	Very low	131 Å²	131	100.5 Å²	100.5	70%	0.701	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	35	-179.8	-156.6	27.2	0	0	0	114.9	N232	N232-N236 WeakPolarHBondContact O-CA 3.36Å; N232-N236 PolarHBondContact O-N 2.75Å
237	H	52.5	Low	46.1	Very low	94 Å²	94	101.1 Å²	101.1	44%	0.435	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	165.4	177.6	74.5	-85.4	0	0	0	113.4	N232 L235 V239	N232-H237 PolarHBondContact N-O 3.01Å; N232-H237 PolarHBondContact O-N 3.43Å; L235-H237 VanDerWaalsContact CB-CE1 3.49Å; L235-H237 WeakPolarHBondContact CB-CE1 3.18Å; L235-H237 WeakPolarHBondContact CB-ND1 3.23Å; L235-H237 PolarHBondContact O-N 2.88Å; L235-H237 VanDerWaalsContact O-N 3.14Å; L235-H237 PolarHBondContact O-ND1 2.99Å; H237-V239 PolarHBondContact O-N 3.5Å
238	C	54.2	Low	46	Very low	31 Å²	31	100.4 Å²	100.4	21%	0.209	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	112.8	175.8	-62.2	0	0	0	0	112.3	C229 N230 Y241	C229-C238 HydrophobicContact CB-CB 3.67Å; C229-C238 WeakPolarHBondContact CB-SG 3.29Å; C229-C238 WeakPolarHBondContact SG-CB 3.49Å; C229-C238 CovalentContact SG-SG 2.03Å; C229-C238 PolarHBondContact SG-SG 2.99Å; N230-C238 CarbonylContact O-C 3.35Å; N230-C238 WeakPolarHBondContact O-CA 3.47Å; C238-Y241 HydrophobicContact CB-CD2 4.45Å; C238-Y241 HydrophobicContact CB-CE1 4.09Å; C238-Y241 HydrophobicContact CB-CE2 3.74Å
239	V	55.3	Low	45.4	Very low	52 Å²	52	106.5 Å²	106.5	32%	0.315	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	-9.6	178.6	-71.2	0	0	0	0	114.2	N230 N232 L235 H237	N230-V239 HydrophobicContact CB-CG2 4.46Å; N230-V239 VanDerWaalsContact O-CG2 3.26Å; N230-V239 WeakPolarHBondContact O-CG2 3.49Å; N230-V239 PolarHBondContact O-N 3.01Å; N232-V239 HydrophobicContact CB-CB 4.42Å; N232-V239 HydrophobicContact CB-CG1 3.57Å; N232-V239 HydrophobicContact CB-CG2 3.98Å; L235-V239 HydrophobicContact CD1-CG1 4.19Å; H237-V239 PolarHBondContact O-N 3.5Å
240	S	38.6	Very low	44.6	Very low	49 Å²	49	115.6 Å²	115.6	34%	0.343	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-158.4	165.8	158.8	62	0	0	0	0	110.8	C229 N230	C229-S240 WeakPolarHBondContact CA-O 3.21Å; N230-S240 VanDerWaalsContact CB-OG 3.24Å; N230-S240 WeakPolarHBondContact CB-OG 3.46Å; N230-S240 PolarHBondContact N-O 2.78Å
241	Y	43.4	Very low	43.4	Very low	149 Å²	149	119.7 Å²	119.7	58%	0.584	59%	0.593	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-120.9	149.4	167.3	-66.6	-94	0	0	0	109.1	F227 A228 C229 C238	F227-Y241 HydrophobicContact CD1-CD1 4.33Å; A228-Y241 CarbonylContact O-C 3.6Å; A228-Y241 WeakPolarHBondContact O-CA 2.98Å; C229-Y241 HydrophobicContact CB-CD1 3.52Å; C229-Y241 HydrophobicContact CB-CE1 3.53Å; C229-Y241 HydrophobicContact CB-CG 4.29Å; C238-Y241 HydrophobicContact CB-CD2 4.45Å; C238-Y241 HydrophobicContact CB-CE1 4.09Å; C238-Y241 HydrophobicContact CB-CE2 3.74Å
242	Y	40.9	Very low	42.5	Very low	122 Å²	122	121.9 Å²	121.9	48%	0.478	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-144	154.5	176.5	59.8	-83.8	0	0	0	111.1	A228 E244	A228-Y242 HydrophobicContact CB-CD1 4.22Å; A228-Y242 HydrophobicContact CB-CD2 3.84Å; A228-Y242 HydrophobicContact CB-CE1 3.87Å; A228-Y242 HydrophobicContact CB-CE2 3.45Å; A228-Y242 VanDerWaalsContact CB-CE2 3.45Å; A228-Y242 HydrophobicContact CB-CG 4.21Å; A228-Y242 VanDerWaalsContact CB-CZ 3.47Å; A228-Y242 PolarHBondContact N-O 3.48Å; A228-Y242 VanDerWaalsContact N-O 3.1Å; A228-Y242 PolarHBondContact O-N 3.19Å; Y242-E244 HydrophobicContact CE2-CG 4.43Å
243	Y	39.6	Very low	40.9	Very low	159 Å²	159	130.2 Å²	130.2	62%	0.624	63%	0.632	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.1	128.1	172.2	-58.5	-75	0	0	0	108.9	F227	F227-Y243 AromaticContact CE1-CE1 3.93Å; F227-Y243 HydrophobicContact CE1-CE1 3.93Å; F227-Y243 AromaticContact CE2-CE1 3.94Å; F227-Y243 HydrophobicContact CE2-CE1 3.94Å; F227-Y243 AromaticContact CZ-CE1 3.56Å; F227-Y243 HydrophobicContact CZ-CE1 3.56Å; F227-Y243 AromaticContact CZ-CZ 3.95Å
244	E	40	Very low	39.6	Very low	116 Å²	116	132.3 Å²	132.3	54%	0.542	64%	0.643	S	S	.	*	P	Polyproline II helix	trans	-69.4	135.4	164.5	-64.4	178.8	125.7	0	0	108.7	T226 A228 Y242 A246	T226-E244 PolarHBondContact OG1-OE2 3.03Å; A228-E244 HydrophobicContact CB-CG 3.97Å; Y242-E244 HydrophobicContact CE2-CG 4.43Å; E244-A246 PolarHBondContact O-N 2.85Å
245	K	37	Very low	38.8	Very low	208 Å²	208	132 Å²	132	90%	0.904	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-67.6	125.8	174.2	-94.1	-173	171.8	-176.4	0	109.1
246	A	32.2	Very low	37.8	Very low	87 Å²	87	131.1 Å²	131.1	72%	0.719	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-60	147.7	169.1	0	0	0	0	0	110.9	E244	E244-A246 PolarHBondContact O-N 2.85Å
247	P	34.1	Very low	37	Very low	104 Å²	104	131.6 Å²	131.6	68%	0.675	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-63.5	151.4	174.1	27.2	-34.5	0	0	0	111.2	D249	P247-D249 PolarHBondContact O-N 2.94Å
248	P	34.4	Very low	35.8	Very low	120 Å²	120	137.5 Å²	137.5	78%	0.779	66%	0.663	S	S	*	*	S	Bend	trans	-71.2	-3.6	-159.6	26.8	-35.5	0	0	0	116.7	R250	P248-R250 PolarHBondContact O-N 3.16Å
249	D	36.1	Very low	34.6	Very low	141 Å²	141	142.6 Å²	142.6	75%	0.754	69%	0.689	S	S	*	*	S	Bend	trans	-100.9	24	-157.3	-51.1	-52.2	0	0	0	115.7	P247	P247-D249 PolarHBondContact O-N 2.94Å
250	R	33.5	Very low	33.2	Very low	230 Å²	230	151.3 Å²	151.3	87%	0.868	72%	0.718	S	S	*	*			trans	-133.6	-6.9	-171.4	-79.6	-165.5	173.2	-166.2	-1.1	119.7	P248 K252	P248-R250 PolarHBondContact O-N 3.16Å; R250-K252 PolarHBondContact O-N 2.82Å
251	E	31.9	Very low	32.7	Very low	174 Å²	174	153.1 Å²	153.1	81%	0.813	74%	0.744	S	S	*	*			trans	-89	94.7	177.6	-67.7	-172.4	169.1	0	0	111.6
252	K	30.3	Very low	32.2	Very low	133 Å²	133	150.6 Å²	150.6	58%	0.578	75%	0.748	S	S	*	*			trans	-133.2	3.7	175.6	-144.9	175.5	-177.7	179.8	0	116.3	R250 T267	R250-K252 PolarHBondContact O-N 2.82Å; K252-T267 HydrophobicContact CG-CG2 3.98Å
253	Y	29.4	Very low	31.8	Very low	218 Å²	218	151.8 Å²	151.8	86%	0.855	77%	0.768	S	S	*	*			trans	-148.2	93	-179.9	-63.3	-74.1	0	0	0	114.5
254	Q	28.4	Very low	31.3	Very low	205 Å²	205	147.8 Å²	147.8	96%	0.958	76%	0.762	S	S	*	*			trans	-158.3	158.6	147.5	-116.3	170.8	2.8	0	0	110.6
255	R	28.3	Very low	31.4	Very low	149 Å²	149	149.3 Å²	149.3	56%	0.562	77%	0.774	S	S	*	*			trans	-104.1	125.6	-160.9	-137.1	-179.3	-155.2	-179.2	3.8	111.4	P296 N297	R255-P296 HydrophobicContact CG-CG 4.36Å; R255-P296 PolarHBondContact NH2-O 2.04Å; R255-N297 PolarHBondContact NH2-OD1 2.04Å
256	C	25.4	Very low	31.8	Very low	82 Å²	82	142.6 Å²	142.6	55%	0.554	75%	0.753	S	S	*	*			trans	-83.4	135.4	172.7	-58.4	0	0	0	0	111.1
257	T	30.8	Very low	33.2	Very low	140 Å²	140	141 Å²	141	86%	0.859	73%	0.734	S	S	*	*			trans	-102.6	144.4	163	43.4	0	0	0	0	109.4	D259	T257-D259 PolarHBondContact O-N 2.89Å
258	F	27.8	Very low	34.9	Very low	218 Å²	218	137.5 Å²	137.5	96%	0.956	71%	0.712	S	S	*	*			trans	-70.7	112.9	-174.5	-79.8	-101.6	0	0	0	112.2
259	D	28.7	Very low	36.8	Very low	139 Å²	139	133.2 Å²	133.2	74%	0.743	68%	0.683	S	S	*	*			trans	-142.5	155.1	142.9	-147.1	-19.1	0	0	0	109.5	T257 G261	T257-D259 PolarHBondContact O-N 2.89Å; D259-G261 PolarHBondContact O-N 3.32Å
260	Y	27.4	Very low	38.7	Very low	235 Å²	235	133.5 Å²	133.5	92%	0.922	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	125.6	-159.2	-72.7	-102.5	0	0	0	113.5
261	G	27	Very low	40.9	Very low	86 Å²	86	129 Å²	129	89%	0.887	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	120.5	2.9	155.4	0	0	0	0	0	118.6	D259	D259-G261 PolarHBondContact O-N 3.32Å
262	S	32.5	Very low	43.3	Very low	97 Å²	97	122.7 Å²	122.7	68%	0.678	65%	0.647	S	S	*	*	S	Bend	trans	-111.9	147	176.5	63.4	0	0	0	0	113.5	C264	S262-C264 PolarHBondContact O-N 3.35Å; S262-C264 VanDerWaalsContact O-N 3.16Å
263	T	33.2	Very low	45.8	Very low	146 Å²	146	118.9 Å²	118.9	90%	0.896	64%	0.635	S	S	*	*			trans	-69.7	106.9	-169.3	48.9	0	0	0	0	112.6
264	C	28.9	Very low	48.4	Very low	75 Å²	75	117.1 Å²	117.1	51%	0.507	64%	0.635	S	S	.	*			trans	-85.3	116.3	177.5	-66.5	0	0	0	0	111.7	S262 C266	S262-C264 PolarHBondContact O-N 3.35Å; S262-C264 VanDerWaalsContact O-N 3.16Å; C264-C266 PolarHBondContact O-N 3.07Å; C264-C266 VanDerWaalsContact O-N 3.16Å
265	N	42.4	Very low	51	Low	148 Å²	148	111.1 Å²	111.1	79%	0.791	60%	0.604	S	S	*	*			trans	-78.6	90.3	167.1	-95.7	-12.4	0	0	0	109.9
266	C	45.7	Very low	53.5	Low	67 Å²	67	106.1 Å²	106.1	45%	0.453	59%	0.589	S	S	.	*			trans	-75.7	133.5	171.5	-65.3	0	0	0	0	111.1	C264 I293	C264-C266 PolarHBondContact O-N 3.07Å; C264-C266 VanDerWaalsContact O-N 3.16Å; C266-I293 HydrophobicContact CB-CD1 4.23Å; C266-I293 HydrophobicContact CB-CG1 4.35Å; C266-I293 HydrophobicContact CB-CG2 3.99Å
267	T	61.5	Low	56.1	Low	53 Å²	53	107.2 Å²	107.2	33%	0.325	60%	0.598	S	S	.	*			trans	-72.8	131.8	168.9	37.9	0	0	0	0	111.1	K252 I294	K252-T267 HydrophobicContact CG-CG2 3.98Å; T267-I294 PolarHBondContact O-N 3.2Å
268	C	68.8	Low	58.3	Low	32 Å²	32	104.7 Å²	104.7	22%	0.216	57%	0.573	C	S	.	*	B	Isolated β-bridge	trans	-104.1	151	-175.5	-44.8	0	0	0	0	111.2	Y272 I294 C314	C268-Y272 HydrophobicContact CB-CE2 4.35Å; C268-Y272 WeakPolarHBondContact CB-OH 3.24Å; C268-Y272 PolarHBondContact SG-OH 2.83Å; C268-I294 WeakPolarHBondContact O-CD1 2.99Å; C268-C314 WeakPolarHBondContact CA-SG 3.46Å; C268-C314 HydrophobicContact CB-CB 3.6Å; C268-C314 WeakPolarHBondContact CB-SG 3.18Å; C268-C314 WeakPolarHBondContact SG-CB 3.46Å; C268-C314 CovalentContact SG-SG 2.02Å; C268-C314 PolarHBondContact SG-SG 3.47Å
269	T	75.1	Confident	60.2	Low	29 Å²	29	94.6 Å²	94.6	18%	0.178	53%	0.529	C	S	.	.			trans	-67	151.5	161.2	52.7	0	0	0	0	110	D271 Y272 P292 I294	T269-D271 PolarHBondContact O-N 3.14Å; T269-Y272 WeakPolarHBondContact O-CE2 3.31Å; T269-P292 HydrophobicContact CG2-CB 4.12Å; T269-P292 PolarHBondContact N-O 2.7Å; T269-P292 WeakPolarHBondContact OG1-CB 3.43Å; T269-P292 VanDerWaalsContact OG1-CD 3.24Å; T269-P292 WeakPolarHBondContact OG1-CD 3.5Å; T269-P292 PolarHBondContact OG1-O 3.35Å; T269-I294 HydrophobicContact CG2-CG1 3.76Å
270	D	76.6	Confident	62.1	Low	148 Å²	148	92.8 Å²	92.8	79%	0.791	53%	0.528	S	S	*	.	S	Bend	trans	-75.6	-11	176.8	-64.6	-53	0	0	0	112.4	Y272	D270-Y272 PolarHBondContact O-N 3.33Å
271	D	79.9	Confident	63.6	Low	134 Å²	134	84.5 Å²	84.5	72%	0.717	50%	0.502	S	S	*	.			trans	-72.1	63.3	176.3	-65.7	-49.8	0	0	0	112.8	T269	T269-D271 PolarHBondContact O-N 3.14Å
272	Y	81.1	Confident	65	Low	43 Å²	43	81 Å²	81	17%	0.169	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-74.5	141.9	171.3	-78.5	-89.5	0	0	0	112.4	C268 T269 D270 R289 I290 A291 C314 Q316	C268-Y272 HydrophobicContact CB-CE2 4.35Å; C268-Y272 WeakPolarHBondContact CB-OH 3.24Å; C268-Y272 PolarHBondContact SG-OH 2.83Å; T269-Y272 WeakPolarHBondContact O-CE2 3.31Å; D270-Y272 PolarHBondContact O-N 3.33Å; Y272-R289 HydrophobicContact CD1-CG 3.81Å; Y272-R289 HydrophobicContact CG-CG 4.36Å; Y272-I290 CarbonylContact C-O 3.55Å; Y272-I290 WeakPolarHBondContact CA-O 3.49Å; Y272-A291 HydrophobicContact CD1-CB 3.56Å; Y272-A291 HydrophobicContact CD2-CB 3.87Å; Y272-A291 HydrophobicContact CE1-CB 3.58Å; Y272-A291 HydrophobicContact CE2-CB 3.87Å; Y272-A291 HydrophobicContact CG-CB 3.72Å; Y272-C314 HydrophobicContact CE1-CB 4.48Å; Y272-Q316 HydrophobicContact CD1-CG 4.36Å; Y272-Q316 HydrophobicContact CE1-CB 4.06Å; Y272-Q316 HydrophobicContact CE1-CG 3.56Å; Y272-Q316 VanDerWaalsContact CZ-CD 3.5Å; Y272-Q316 VanDerWaalsContact CZ-NE2 3.27Å; Y272-Q316 PolarHBondContact OH-NE2 2.03Å
273	T	82.1	Confident	66.7	Low	53 Å²	53	79.5 Å²	79.5	33%	0.325	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-58.5	165	168.6	64.5	0	0	0	0	112	R289 I290	T273-R289 WeakPolarHBondContact O-CB 3.38Å; T273-I290 HydrophobicContact CG2-CD1 4.38Å; T273-I290 HydrophobicContact CG2-CG1 3.57Å; T273-I290 PolarHBondContact N-O 2.88Å; T273-I290 PolarHBondContact OG1-N 3.18Å
274	Q	85	Confident	68.1	Low	181 Å²	181	75.3 Å²	75.3	85%	0.846	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-57.5	151.4	161.9	-65.6	-173	-3.1	0	0	110.5
275	W	84	Confident	70	Confident	79 Å²	79	72.1 Å²	72.1	30%	0.299	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-64.5	143.1	173.9	-70.7	107.6	0	0	0	111.3	R287 I288 R289 Q316 E318	W275-R287 HydrophobicContact CD2-CG 4.27Å; W275-R287 HydrophobicContact CE3-CB 4.43Å; W275-R287 HydrophobicContact CE3-CG 3.74Å; W275-R287 HydrophobicContact CZ3-CG 4.28Å; W275-I288 WeakPolarHBondContact CA-O 3.19Å; W275-I288 VanDerWaalsContact CE3-C 3.41Å; W275-R289 HydrophobicContact CD2-CB 4.22Å; W275-R289 HydrophobicContact CD2-CG 3.97Å; W275-R289 HydrophobicContact CE3-CB 4Å; W275-R289 HydrophobicContact CE3-CG 3.79Å; W275-R289 HydrophobicContact CH2-CG 3.91Å; W275-R289 HydrophobicContact CZ2-CG 4.08Å; W275-R289 HydrophobicContact CZ3-CB 4.38Å; W275-R289 HydrophobicContact CZ3-CG 3.77Å; W275-Q316 HydrophobicContact CH2-CB 4.18Å; W275-E318 HydrophobicContact CE3-CB 4.43Å; W275-E318 HydrophobicContact CH2-CB 3.68Å; W275-E318 HydrophobicContact CZ2-CB 4.29Å; W275-E318 WeakPolarHBondContact CZ2-OE2 3.31Å; W275-E318 HydrophobicContact CZ3-CB 3.75Å
276	T	80	Confident	71.3	Confident	43 Å²	43	65.8 Å²	65.8	26%	0.264	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-62.6	164.9	165.1	62.9	0	0	0	0	111.2	R287 I288 F307	T276-R287 WeakPolarHBondContact OG1-CA 3.49Å; T276-I288 HydrophobicContact CG2-CG1 3.68Å; T276-I288 PolarHBondContact N-O 2.84Å; T276-I288 PolarHBondContact OG1-N 3.47Å; T276-F307 HydrophobicContact CG2-CE1 4.17Å; T276-F307 HydrophobicContact CG2-CZ 3.89Å
277	S	79.5	Confident	73	Confident	105 Å²	105	65.3 Å²	65.3	73%	0.734	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-54.6	149.4	160.4	51.4	0	0	0	0	110.9
278	W	77.8	Confident	73.9	Confident	88 Å²	88	64.9 Å²	64.9	33%	0.333	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-57.6	134.6	167.5	-70.6	112.4	0	0	0	110.9	S280 R287 E318 N320	W278-S280 PolarHBondContact O-N 2.93Å; W278-R287 HydrophobicContact CD2-CB 4.44Å; W278-R287 HydrophobicContact CD2-CG 4.21Å; W278-R287 HydrophobicContact CE3-CB 4.11Å; W278-R287 HydrophobicContact CE3-CG 3.88Å; W278-R287 HydrophobicContact CH2-CG 4.02Å; W278-R287 HydrophobicContact CZ2-CG 4.36Å; W278-R287 HydrophobicContact CZ3-CB 4.43Å; W278-R287 HydrophobicContact CZ3-CG 3.77Å; W278-E318 HydrophobicContact CH2-CB 4.46Å; W278-E318 HydrophobicContact CH2-CG 3.91Å; W278-E318 WeakPolarHBondContact CH2-OE1 2.92Å; W278-N320 HydrophobicContact CE3-CB 4.09Å; W278-N320 HydrophobicContact CH2-CB 3.74Å; W278-N320 HydrophobicContact CZ2-CB 4.34Å; W278-N320 HydrophobicContact CZ3-CB 3.59Å
279	S	67.4	Low	74.6	Confident	6 Å²	6	66.7 Å²	66.7	4%	0.042	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-68.8	126.4	176.1	63.2	0	0	0	0	110.1	T281 S285 T286 G334	S279-T281 VanDerWaalsContact C-N 3.29Å; S279-T281 PolarHBondContact O-N 3.08Å; S279-S285 PolarHBondContact O-OG 3.32Å; S279-T286 WeakPolarHBondContact CB-O 3.31Å; S279-T286 PolarHBondContact N-O 3.33Å; S279-T286 PolarHBondContact OG-N 3.2Å; S279-T286 PolarHBondContact OG-O 2.88Å; S279-T286 PolarHBondContact OG-OG1 3.12Å; S279-G334 WeakPolarHBondContact CB-O 3.06Å
280	S	67.5	Low	75	Confident	101 Å²	101	65.4 Å²	65.4	71%	0.706	34%	0.343	S	S	*	.	S	Bend	trans	-90.3	11.2	-176.8	64.3	0	0	0	0	113.3	W278	W278-S280 PolarHBondContact O-N 2.93Å
281	T	59.4	Low	75.1	Confident	61 Å²	61	58.3 Å²	58.3	37%	0.374	31%	0.305	S	S	.	.	S	Bend	trans	-81.9	-45.7	-172.3	28.5	0	0	0	0	113.7	S279 T335	S279-T281 VanDerWaalsContact C-N 3.29Å; S279-T281 PolarHBondContact O-N 3.08Å; T281-T335 HydrophobicContact CG2-CG2 3.72Å
282	C	57.4	Low	75	Confident	12 Å²	12	53.2 Å²	53.2	8%	0.081	28%	0.28	C	S	.	.	S	Bend	trans	-169	176.6	178	50.1	0	0	0	0	114.2	P284 S285 L325 E326 C328	C282-P284 CarbonylContact O-C 3.27Å; C282-P284 VanDerWaalsContact O-C 3.27Å; C282-S285 WeakPolarHBondContact O-CA 3Å; C282-S285 PolarHBondContact O-N 3.4Å; C282-L325 WeakPolarHBondContact O-CD1 3.5Å; C282-E326 VanDerWaalsContact CB-O 3.31Å; C282-E326 WeakPolarHBondContact CB-O 3.22Å; C282-C328 HydrophobicContact CB-CB 3.69Å; C282-C328 WeakPolarHBondContact CB-SG 3.48Å; C282-C328 WeakPolarHBondContact SG-CB 3.34Å; C282-C328 CovalentContact SG-SG 2Å; C282-C328 PolarHBondContact SG-SG 2.83Å
283	K	68	Low	74.4	Confident	65 Å²	65	53 Å²	53	28%	0.283	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	-88.5	135.3	176.9	178.1	-172.3	175.5	-153.4	0	111	P321 S323 L325 E326 E327	K283-P321 VanDerWaalsContact CE-O 3.3Å; K283-P321 WeakPolarHBondContact CE-O 3.43Å; K283-S323 WeakPolarHBondContact CA-OG 3.18Å; K283-S323 WeakPolarHBondContact CB-OG 3.02Å; K283-L325 HydrophobicContact CB-CB 4.26Å; K283-L325 VanDerWaalsContact CB-O 3.23Å; K283-L325 WeakPolarHBondContact CB-O 3.07Å; K283-E326 WeakPolarHBondContact CB-O 3.05Å; K283-E326 PolarHBondContact N-O 2.99Å; K283-E327 HydrophobicContact CD-CG 4.25Å; K283-E327 WeakPolarHBondContact CE-OE1 3.27Å; K283-E327 IonicContact NZ-OE1 2.68Å; K283-E327 PolarHBondContact NZ-OE1 2.87Å
284	P	61.5	Low	73.6	Confident	59 Å²	59	54.4 Å²	54.4	38%	0.383	29%	0.285	S	S	.	.	S	Bend	cis	-72.4	132.9	-6	30.9	-34.8	0	0	0	111.8	C282 T319 N320	C282-P284 CarbonylContact O-C 3.27Å; C282-P284 VanDerWaalsContact O-C 3.27Å; P284-T319 HydrophobicContact CG-CG2 4.34Å; P284-N320 WeakPolarHBondContact CA-O 3.36Å; P284-N320 WeakPolarHBondContact CB-O 3.08Å
285	S	70.1	Confident	72.1	Confident	7 Å²	7	49.1 Å²	49.1	5%	0.049	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	144.6	174.1	-179.5	0	0	0	0	110.6	S279 C282 N320 S323	S279-S285 PolarHBondContact O-OG 3.32Å; C282-S285 WeakPolarHBondContact O-CA 3Å; C282-S285 PolarHBondContact O-N 3.4Å; S285-N320 PolarHBondContact N-O 3.23Å; S285-N320 PolarHBondContact O-N 3.11Å; S285-S323 PolarHBondContact N-OG 3.17Å
286	T	68	Low	70.3	Confident	15 Å²	15	49.8 Å²	49.8	9%	0.092	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	146.4	-165.9	37	0	0	0	0	113.2	S279 E318 T319 Y333	S279-T286 WeakPolarHBondContact CB-O 3.31Å; S279-T286 PolarHBondContact N-O 3.33Å; S279-T286 PolarHBondContact OG-N 3.2Å; S279-T286 PolarHBondContact OG-O 2.88Å; S279-T286 PolarHBondContact OG-OG1 3.12Å; T286-E318 VanDerWaalsContact CA-O 3.31Å; T286-E318 WeakPolarHBondContact CA-O 3.38Å; T286-T319 HydrophobicContact CG2-CG2 3.55Å; T286-Y333 HydrophobicContact CG2-CD1 3.55Å; T286-Y333 HydrophobicContact CG2-CE1 3.45Å; T286-Y333 VanDerWaalsContact CG2-CE1 3.45Å
287	R	81.7	Confident	68.8	Low	58 Å²	58	52 Å²	52	22%	0.219	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	159.5	172.5	64.7	-179.3	-169.7	-168.9	-6.9	111.6	W275 T276 W278 T317 E318	W275-R287 HydrophobicContact CD2-CG 4.27Å; W275-R287 HydrophobicContact CE3-CB 4.43Å; W275-R287 HydrophobicContact CE3-CG 3.74Å; W275-R287 HydrophobicContact CZ3-CG 4.28Å; T276-R287 WeakPolarHBondContact OG1-CA 3.49Å; W278-R287 HydrophobicContact CD2-CB 4.44Å; W278-R287 HydrophobicContact CD2-CG 4.21Å; W278-R287 HydrophobicContact CE3-CB 4.11Å; W278-R287 HydrophobicContact CE3-CG 3.88Å; W278-R287 HydrophobicContact CH2-CG 4.02Å; W278-R287 HydrophobicContact CZ2-CG 4.36Å; W278-R287 HydrophobicContact CZ3-CB 4.43Å; W278-R287 HydrophobicContact CZ3-CG 3.77Å; R287-T317 WeakPolarHBondContact O-CA 3.43Å; R287-E318 HydrophobicContact CG-CB 3.96Å; R287-E318 IonicContact CZ-OE1 3.57Å; R287-E318 IonicContact CZ-OE2 3.16Å; R287-E318 PolarHBondContact N-O 3.48Å; R287-E318 IonicContact NE-OE1 3.64Å; R287-E318 IonicContact NE-OE2 2.79Å; R287-E318 PolarHBondContact NE-OE2 3.2Å; R287-E318 IonicContact NH2-OE1 2.89Å; R287-E318 PolarHBondContact NH2-OE1 3.12Å; R287-E318 IonicContact NH2-OE2 2.71Å; R287-E318 PolarHBondContact NH2-OE2 2.98Å; R287-E318 PolarHBondContact O-N 3.26Å
288	I	81.5	Confident	67	Low	43 Å²	43	55.3 Å²	55.3	22%	0.221	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	160	-176.7	68.8	173.7	0	0	0	113.2	W275 T276 F307 I310 V315 Q316 T317	W275-I288 WeakPolarHBondContact CA-O 3.19Å; W275-I288 VanDerWaalsContact CE3-C 3.41Å; T276-I288 HydrophobicContact CG2-CG1 3.68Å; T276-I288 PolarHBondContact N-O 2.84Å; T276-I288 PolarHBondContact OG1-N 3.47Å; I288-F307 HydrophobicContact CD1-CD1 4.46Å; I288-F307 HydrophobicContact CD1-CE1 3.95Å; I288-F307 HydrophobicContact CG1-CE1 4.23Å; I288-I310 HydrophobicContact CD1-CD1 4.1Å; I288-V315 HydrophobicContact CB-CG1 4.3Å; I288-Q316 CarbonylContact C-O 3.57Å; I288-Q316 VanDerWaalsContact CA-O 3.23Å; I288-Q316 WeakPolarHBondContact CA-O 3.48Å; I288-T317 HydrophobicContact CG2-CG2 3.94Å
289	R	83.1	Confident	65.3	Low	70 Å²	70	60.4 Å²	60.4	26%	0.264	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	154.7	164.7	61.2	179.9	-169.6	158.4	0.3	110.4	Y272 T273 W275 Q316	Y272-R289 HydrophobicContact CD1-CG 3.81Å; Y272-R289 HydrophobicContact CG-CG 4.36Å; T273-R289 WeakPolarHBondContact O-CB 3.38Å; W275-R289 HydrophobicContact CD2-CB 4.22Å; W275-R289 HydrophobicContact CD2-CG 3.97Å; W275-R289 HydrophobicContact CE3-CB 4Å; W275-R289 HydrophobicContact CE3-CG 3.79Å; W275-R289 HydrophobicContact CH2-CG 3.91Å; W275-R289 HydrophobicContact CZ2-CG 4.08Å; W275-R289 HydrophobicContact CZ3-CB 4.38Å; W275-R289 HydrophobicContact CZ3-CG 3.77Å; R289-Q316 HydrophobicContact CG-CB 3.98Å; R289-Q316 VanDerWaalsContact CZ-OE1 3.27Å; R289-Q316 PolarHBondContact N-O 3.48Å; R289-Q316 PolarHBondContact O-N 3.16Å
290	I	83.5	Confident	64.3	Low	2 Å²	2	65 Å²	65	1%	0.01	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	153.7	-173.3	66.1	177.5	0	0	0	112.5	Y272 T273 C305 S306 F307 I310 C313 C314 V315	Y272-I290 CarbonylContact C-O 3.55Å; Y272-I290 WeakPolarHBondContact CA-O 3.49Å; T273-I290 HydrophobicContact CG2-CD1 4.38Å; T273-I290 HydrophobicContact CG2-CG1 3.57Å; T273-I290 PolarHBondContact N-O 2.88Å; T273-I290 PolarHBondContact OG1-N 3.18Å; I290-C305 HydrophobicContact CD1-CB 4.22Å; I290-C305 HydrophobicContact CG1-CB 4.49Å; I290-S306 WeakPolarHBondContact CD1-O 3.29Å; I290-F307 HydrophobicContact CD1-CD1 4.38Å; I290-F307 HydrophobicContact CD1-CE1 4.49Å; I290-F307 HydrophobicContact CG2-CE1 4.26Å; I290-I310 HydrophobicContact CG2-CD1 3.71Å; I290-I310 HydrophobicContact CG2-CG1 3.94Å; I290-C313 HydrophobicContact CB-CB 4.43Å; I290-C314 CarbonylContact C-O 3.57Å; I290-C314 WeakPolarHBondContact CA-O 3.5Å; I290-V315 HydrophobicContact CG2-CG1 4.39Å; I290-V315 HydrophobicContact CG2-CG2 4.18Å
291	A	79.4	Confident	63.5	Low	0 Å²	0	65 Å²	65	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	150.4	175	0	0	0	0	0	112	Y272 C305 C314	Y272-A291 HydrophobicContact CD1-CB 3.56Å; Y272-A291 HydrophobicContact CD2-CB 3.87Å; Y272-A291 HydrophobicContact CE1-CB 3.58Å; Y272-A291 HydrophobicContact CE2-CB 3.87Å; Y272-A291 HydrophobicContact CG-CB 3.72Å; A291-C305 PolarHBondContact O-SG 2.85Å; A291-C314 HydrophobicContact CB-CB 4.41Å; A291-C314 PolarHBondContact N-O 3.21Å; A291-C314 PolarHBondContact O-N 3.04Å
292	P	77.5	Confident	63.3	Low	27 Å²	27	66.5 Å²	66.5	18%	0.175	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	143.2	167.7	-27.3	33.9	0	0	0	114	T269 V303 C305	T269-P292 HydrophobicContact CG2-CB 4.12Å; T269-P292 PolarHBondContact N-O 2.7Å; T269-P292 WeakPolarHBondContact OG1-CB 3.43Å; T269-P292 VanDerWaalsContact OG1-CD 3.24Å; T269-P292 WeakPolarHBondContact OG1-CD 3.5Å; T269-P292 PolarHBondContact OG1-O 3.35Å; P292-V303 WeakPolarHBondContact CB-O 3.06Å; P292-C305 VanDerWaalsContact CA-SG 3.56Å; P292-C305 HydrophobicContact CG-CB 4.29Å
293	I	68.1	Low	63.3	Low	39 Å²	39	67.4 Å²	67.4	20%	0.2	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-79.5	131.4	170.3	-62.7	174.5	0	0	0	109.2	C266 Q295 Q312	C266-I293 HydrophobicContact CB-CD1 4.23Å; C266-I293 HydrophobicContact CB-CG1 4.35Å; C266-I293 HydrophobicContact CB-CG2 3.99Å; I293-Q295 PolarHBondContact O-N 2.72Å; I293-Q312 WeakPolarHBondContact CD1-O 3.21Å
294	I	64	Low	63.3	Low	81 Å²	81	72.3 Å²	72.3	42%	0.415	39%	0.385	S	S	.	.			trans	-71.7	107.5	169.9	-61.6	173.4	0	0	0	107.6	T267 C268 T269	T267-I294 PolarHBondContact O-N 3.2Å; C268-I294 WeakPolarHBondContact O-CD1 2.99Å; T269-I294 HydrophobicContact CG2-CG1 3.76Å
295	Q	55.1	Low	63.6	Low	71 Å²	71	70.5 Å²	70.5	33%	0.332	37%	0.374	S	S	.	.			trans	-74.4	137.4	173.2	-63.2	-162.1	16.8	0	0	110	I293 N297	I293-Q295 PolarHBondContact O-N 2.72Å; Q295-N297 PolarHBondContact O-N 3.38Å
296	P	46.6	Very low	63.9	Low	92 Å²	92	72.1 Å²	72.1	60%	0.597	39%	0.385	S	S	*	.	S	Bend	trans	-81.7	31.5	-174.6	35.3	-38.4	0	0	0	113.4	R255	R255-P296 HydrophobicContact CG-CG 4.36Å; R255-P296 PolarHBondContact NH2-O 2.04Å
297	N	46.9	Very low	63.8	Low	89 Å²	89	74.6 Å²	74.6	48%	0.476	40%	0.395	S	S	.	.	S	Bend	trans	-147.9	121.2	177.2	-79.8	-16.2	0	0	0	108.4	R255 Q295 E299	R255-N297 PolarHBondContact NH2-OD1 2.04Å; Q295-N297 PolarHBondContact O-N 3.38Å; N297-E299 PolarHBondContact O-N 2.98Å; N297-E299 VanDerWaalsContact O-N 3.12Å
298	D	42.4	Very low	63	Low	176 Å²	176	80.4 Å²	80.4	94%	0.941	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-1.9	-175.5	-60.9	-70.2	0	0	0	115.5
299	E	41.1	Very low	62.1	Low	195 Å²	195	80 Å²	80	91%	0.911	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	0	-179.1	-65.6	-169.6	133	0	0	114.3	N297	N297-E299 PolarHBondContact O-N 2.98Å; N297-E299 VanDerWaalsContact O-N 3.12Å
300	L	46.5	Very low	61.1	Low	103 Å²	103	79 Å²	79	54%	0.539	42%	0.422	S	S	.	.	S	Bend	trans	-116.4	124.6	178.7	-84	149.7	0	0	0	111.3
301	S	51.9	Low	60	Low	101 Å²	101	85.4 Å²	85.4	71%	0.706	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-59.5	137.3	176.2	54.5	0	0	0	0	111.3
302	P	54.1	Low	59.2	Low	91 Å²	91	90.6 Å²	90.6	59%	0.591	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-59.1	142.1	-176.8	24.3	-34.2	0	0	0	111.6	H304	P302-H304 PolarHBondContact O-N 2.78Å; P302-H304 VanDerWaalsContact O-N 3.14Å
303	V	59	Low	58.8	Low	31 Å²	31	89.9 Å²	89.9	19%	0.188	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-64.2	116.8	-178.6	-176.2	0	0	0	0	109.2	P292 C305 Q312	P292-V303 WeakPolarHBondContact CB-O 3.06Å; V303-C305 PolarHBondContact O-N 3.29Å; V303-Q312 HydrophobicContact CG1-CB 3.91Å
304	H	68.1	Low	59.1	Low	168 Å²	168	88.6 Å²	88.6	78%	0.778	48%	0.475	S	S	*	.			trans	-70.1	106.8	-179.4	-164.9	-59.7	0	0	0	109.6	P302 N309	P302-H304 PolarHBondContact O-N 2.78Å; P302-H304 VanDerWaalsContact O-N 3.14Å; H304-N309 PolarHBondContact O-ND2 2.03Å; H304-N309 PolarHBondContact O-OD1 3.28Å
305	C	66.3	Low	59.7	Low	21 Å²	21	87.8 Å²	87.8	14%	0.142	47%	0.474	C	S	.	.			trans	-81.4	138	-172.8	-82.9	0	0	0	0	113.6	I290 A291 P292 V303 C313	I290-C305 HydrophobicContact CD1-CB 4.22Å; I290-C305 HydrophobicContact CG1-CB 4.49Å; A291-C305 PolarHBondContact O-SG 2.85Å; P292-C305 VanDerWaalsContact CA-SG 3.56Å; P292-C305 HydrophobicContact CG-CB 4.29Å; V303-C305 PolarHBondContact O-N 3.29Å; C305-C313 WeakPolarHBondContact CA-SG 3.4Å; C305-C313 HydrophobicContact CB-CB 4.1Å; C305-C313 WeakPolarHBondContact CB-SG 3.34Å; C305-C313 VanDerWaalsContact SG-CA 3.58Å; C305-C313 WeakPolarHBondContact SG-CB 3.05Å; C305-C313 CovalentContact SG-SG 2.03Å; C305-C313 PolarHBondContact SG-SG 2.74Å
306	S	76.3	Confident	60.6	Low	41 Å²	41	87.6 Å²	87.6	29%	0.287	47%	0.473	S	S	.	.			trans	-147.8	169.7	175.1	74.2	0	0	0	0	108.7	I290 E308 N309 I310	I290-S306 WeakPolarHBondContact CD1-O 3.29Å; S306-E308 PolarHBondContact O-N 3.46Å; S306-E308 PolarHBondContact OG-N 2.99Å; S306-N309 WeakPolarHBondContact CA-OD1 3.45Å; S306-N309 WeakPolarHBondContact CB-OD1 3.37Å; S306-N309 PolarHBondContact N-OD1 2.91Å; S306-N309 PolarHBondContact O-OD1 2.73Å; S306-N309 PolarHBondContact OG-N 3.36Å; S306-N309 PolarHBondContact OG-OD1 3.48Å; S306-I310 PolarHBondContact O-N 2.88Å
307	F	65.8	Low	61.9	Low	68 Å²	68	87.7 Å²	87.7	30%	0.298	47%	0.472	S	S	.	.	S	Bend	trans	-70.8	-14.7	172.7	-67	-74.2	0	0	0	113.4	T276 I288 I290 I310 I337	T276-F307 HydrophobicContact CG2-CE1 4.17Å; T276-F307 HydrophobicContact CG2-CZ 3.89Å; I288-F307 HydrophobicContact CD1-CD1 4.46Å; I288-F307 HydrophobicContact CD1-CE1 3.95Å; I288-F307 HydrophobicContact CG1-CE1 4.23Å; I290-F307 HydrophobicContact CD1-CD1 4.38Å; I290-F307 HydrophobicContact CD1-CE1 4.49Å; I290-F307 HydrophobicContact CG2-CE1 4.26Å; F307-I310 HydrophobicContact CD1-CD1 4.25Å; F307-I337 HydrophobicContact CB-CD1 3.98Å; F307-I337 HydrophobicContact CB-CG1 3.79Å; F307-I337 HydrophobicContact CB-CG2 4.23Å; F307-I337 HydrophobicContact CD1-CD1 3.6Å; F307-I337 HydrophobicContact CD1-CG1 4.38Å; F307-I337 HydrophobicContact CD2-CD1 4.46Å; F307-I337 HydrophobicContact CE1-CD1 4.19Å; F307-I337 HydrophobicContact CG-CD1 3.77Å; F307-I337 HydrophobicContact CG-CG1 4.11Å
308	E	65	Low	63.3	Low	179 Å²	179	86.4 Å²	86.4	84%	0.836	46%	0.464	S	S	*	.	S	Bend	trans	-79	-30.2	177.9	-58.2	-176.1	165.3	0	0	112.5	S306	S306-E308 PolarHBondContact O-N 3.46Å; S306-E308 PolarHBondContact OG-N 2.99Å
309	N	63.2	Low	64.9	Low	36 Å²	36	81.2 Å²	81.2	19%	0.193	44%	0.438	C	S	.	.	S	Bend	trans	-115.1	29	177.8	69.6	-27.6	0	0	0	113.2	H304 S306 T311 Q312	H304-N309 PolarHBondContact O-ND2 2.03Å; H304-N309 PolarHBondContact O-OD1 3.28Å; S306-N309 WeakPolarHBondContact CA-OD1 3.45Å; S306-N309 WeakPolarHBondContact CB-OD1 3.37Å; S306-N309 PolarHBondContact N-OD1 2.91Å; S306-N309 PolarHBondContact O-OD1 2.73Å; S306-N309 PolarHBondContact OG-N 3.36Å; S306-N309 PolarHBondContact OG-OD1 3.48Å; N309-T311 PolarHBondContact O-N 3.43Å; N309-Q312 PolarHBondContact O-N 2.88Å
310	I	63.3	Low	66.5	Low	49 Å²	49	74.4 Å²	74.4	25%	0.251	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-54	-24.9	-176.3	-171.6	163.8	0	0	0	114.7	I288 I290 S306 F307 Q312 C313 V315	I288-I310 HydrophobicContact CD1-CD1 4.1Å; I290-I310 HydrophobicContact CG2-CD1 3.71Å; I290-I310 HydrophobicContact CG2-CG1 3.94Å; S306-I310 PolarHBondContact O-N 2.88Å; F307-I310 HydrophobicContact CD1-CD1 4.25Å; I310-Q312 PolarHBondContact O-N 2.95Å; I310-C313 WeakPolarHBondContact O-CB 3.15Å; I310-C313 PolarHBondContact O-N 2.8Å; I310-V315 HydrophobicContact CD1-CG1 4.42Å; I310-V315 HydrophobicContact CD1-CG2 3.9Å; I310-V315 HydrophobicContact CG1-CG2 3.54Å
311	T	58.7	Low	67.2	Low	136 Å²	136	73.6 Å²	73.6	83%	0.834	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-68.6	-12.7	174.1	51.6	0	0	0	0	114.4	N309	N309-T311 PolarHBondContact O-N 3.43Å
312	Q	62.4	Low	68.1	Low	108 Å²	108	73.6 Å²	73.6	51%	0.505	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-105.3	11.5	175.3	-55.2	-178.7	-31.8	0	0	112.2	I293 V303 N309 I310	I293-Q312 WeakPolarHBondContact CD1-O 3.21Å; V303-Q312 HydrophobicContact CG1-CB 3.91Å; N309-Q312 PolarHBondContact O-N 2.88Å; I310-Q312 PolarHBondContact O-N 2.95Å
313	C	70.9	Confident	68.7	Low	13 Å²	13	70 Å²	70	9%	0.088	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	152.6	-173.6	-63	0	0	0	0	111.1	I290 C305 I310	I290-C313 HydrophobicContact CB-CB 4.43Å; C305-C313 WeakPolarHBondContact CA-SG 3.4Å; C305-C313 HydrophobicContact CB-CB 4.1Å; C305-C313 WeakPolarHBondContact CB-SG 3.34Å; C305-C313 VanDerWaalsContact SG-CA 3.58Å; C305-C313 WeakPolarHBondContact SG-CB 3.05Å; C305-C313 CovalentContact SG-SG 2.03Å; C305-C313 PolarHBondContact SG-SG 2.74Å; I310-C313 WeakPolarHBondContact O-CB 3.15Å; I310-C313 PolarHBondContact O-N 2.8Å
314	C	74.2	Confident	69.1	Low	11 Å²	11	78.3 Å²	78.3	7%	0.074	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	138	159.6	-76.7	0	0	0	0	109.8	C268 Y272 I290 A291	C268-C314 WeakPolarHBondContact CA-SG 3.46Å; C268-C314 HydrophobicContact CB-CB 3.6Å; C268-C314 WeakPolarHBondContact CB-SG 3.18Å; C268-C314 WeakPolarHBondContact SG-CB 3.46Å; C268-C314 CovalentContact SG-SG 2.02Å; C268-C314 PolarHBondContact SG-SG 3.47Å; Y272-C314 HydrophobicContact CE1-CB 4.48Å; I290-C314 CarbonylContact C-O 3.57Å; I290-C314 WeakPolarHBondContact CA-O 3.5Å; A291-C314 HydrophobicContact CB-CB 4.41Å; A291-C314 PolarHBondContact N-O 3.21Å; A291-C314 PolarHBondContact O-N 3.04Å
315	V	76	Confident	69	Low	65 Å²	65	73.3 Å²	73.3	39%	0.394	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.6	175.6	-171.3	0	0	0	0	108.5	I288 I290 I310	I288-V315 HydrophobicContact CB-CG1 4.3Å; I290-V315 HydrophobicContact CG2-CG1 4.39Å; I290-V315 HydrophobicContact CG2-CG2 4.18Å; I310-V315 HydrophobicContact CD1-CG1 4.42Å; I310-V315 HydrophobicContact CD1-CG2 3.9Å; I310-V315 HydrophobicContact CG1-CG2 3.54Å
316	Q	73.8	Confident	68.6	Low	67 Å²	67	80.7 Å²	80.7	31%	0.313	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	138.4	166.5	-77.9	-178.1	2.1	0	0	109.9	Y272 W275 I288 R289	Y272-Q316 HydrophobicContact CD1-CG 4.36Å; Y272-Q316 HydrophobicContact CE1-CB 4.06Å; Y272-Q316 HydrophobicContact CE1-CG 3.56Å; Y272-Q316 VanDerWaalsContact CZ-CD 3.5Å; Y272-Q316 VanDerWaalsContact CZ-NE2 3.27Å; Y272-Q316 PolarHBondContact OH-NE2 2.03Å; W275-Q316 HydrophobicContact CH2-CB 4.18Å; I288-Q316 CarbonylContact C-O 3.57Å; I288-Q316 VanDerWaalsContact CA-O 3.23Å; I288-Q316 WeakPolarHBondContact CA-O 3.48Å; R289-Q316 HydrophobicContact CG-CB 3.98Å; R289-Q316 VanDerWaalsContact CZ-OE1 3.27Å; R289-Q316 PolarHBondContact N-O 3.48Å; R289-Q316 PolarHBondContact O-N 3.16Å
317	T	74.1	Confident	67.6	Low	94 Å²	94	85 Å²	85	58%	0.577	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.5	145.3	178.5	52.5	0	0	0	0	109.7	R287 I288	R287-T317 WeakPolarHBondContact O-CA 3.43Å; I288-T317 HydrophobicContact CG2-CG2 3.94Å
318	E	76.8	Confident	66.8	Low	62 Å²	62	84 Å²	84	29%	0.29	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	132.2	173.3	-170.7	-174.8	153.8	0	0	109.3	W275 W278 T286 R287	W275-E318 HydrophobicContact CE3-CB 4.43Å; W275-E318 HydrophobicContact CH2-CB 3.68Å; W275-E318 HydrophobicContact CZ2-CB 4.29Å; W275-E318 WeakPolarHBondContact CZ2-OE2 3.31Å; W275-E318 HydrophobicContact CZ3-CB 3.75Å; W278-E318 HydrophobicContact CH2-CB 4.46Å; W278-E318 HydrophobicContact CH2-CG 3.91Å; W278-E318 WeakPolarHBondContact CH2-OE1 2.92Å; T286-E318 VanDerWaalsContact CA-O 3.31Å; T286-E318 WeakPolarHBondContact CA-O 3.38Å; R287-E318 HydrophobicContact CG-CB 3.96Å; R287-E318 IonicContact CZ-OE1 3.57Å; R287-E318 IonicContact CZ-OE2 3.16Å; R287-E318 PolarHBondContact N-O 3.48Å; R287-E318 IonicContact NE-OE1 3.64Å; R287-E318 IonicContact NE-OE2 2.79Å; R287-E318 PolarHBondContact NE-OE2 3.2Å; R287-E318 IonicContact NH2-OE1 2.89Å; R287-E318 PolarHBondContact NH2-OE1 3.12Å; R287-E318 IonicContact NH2-OE2 2.71Å; R287-E318 PolarHBondContact NH2-OE2 2.98Å; R287-E318 PolarHBondContact O-N 3.26Å
319	T	75.9	Confident	65.9	Low	67 Å²	67	81.5 Å²	81.5	41%	0.411	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	132.3	-179.1	41.6	0	0	0	0	110.5	P284 T286 P321 Y333	P284-T319 HydrophobicContact CG-CG2 4.34Å; T286-T319 HydrophobicContact CG2-CG2 3.55Å; T319-P321 WeakPolarHBondContact O-CD 3.01Å; T319-Y333 HydrophobicContact CG2-CE1 4.04Å
320	N	74	Confident	64.5	Low	52 Å²	52	84.6 Å²	84.6	28%	0.278	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	98.4	170.3	-178.5	1.3	0	0	0	109.5	W278 P284 S285 S322 S323	W278-N320 HydrophobicContact CE3-CB 4.09Å; W278-N320 HydrophobicContact CH2-CB 3.74Å; W278-N320 HydrophobicContact CZ2-CB 4.34Å; W278-N320 HydrophobicContact CZ3-CB 3.59Å; P284-N320 WeakPolarHBondContact CA-O 3.36Å; P284-N320 WeakPolarHBondContact CB-O 3.08Å; S285-N320 PolarHBondContact N-O 3.23Å; S285-N320 PolarHBondContact O-N 3.11Å; N320-S322 PolarHBondContact O-N 2.04Å; N320-S322 WeakPolarHBondContact OD1-CA 3.13Å; N320-S322 WeakPolarHBondContact OD1-CB 3.45Å; N320-S322 PolarHBondContact OD1-N 2.04Å; N320-S323 PolarHBondContact O-OG 3.49Å
321	P	62.5	Low	63	Low	86 Å²	86	89.4 Å²	89.4	56%	0.558	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-12	177.7	29.1	-35.3	0	0	0	113.8	K283 T319	K283-P321 VanDerWaalsContact CE-O 3.3Å; K283-P321 WeakPolarHBondContact CE-O 3.43Å; T319-P321 WeakPolarHBondContact O-CD 3.01Å
322	S	69.2	Low	61.8	Low	100 Å²	100	84.9 Å²	84.9	70%	0.699	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	9	-175.5	-49.4	0	0	0	0	114	N320	N320-S322 PolarHBondContact O-N 2.04Å; N320-S322 WeakPolarHBondContact OD1-CA 3.13Å; N320-S322 WeakPolarHBondContact OD1-CB 3.45Å; N320-S322 PolarHBondContact OD1-N 2.04Å
323	S	66.6	Low	60.3	Low	16 Å²	16	87.1 Å²	87.1	11%	0.112	46%	0.455	C	S	.	.			trans	-70.2	134.1	178.8	58	0	0	0	0	112.2	K283 S285 N320 L325	K283-S323 WeakPolarHBondContact CA-OG 3.18Å; K283-S323 WeakPolarHBondContact CB-OG 3.02Å; S285-S323 PolarHBondContact N-OG 3.17Å; N320-S323 PolarHBondContact O-OG 3.49Å; S323-L325 PolarHBondContact O-N 3.22Å
324	E	67.7	Low	58.3	Low	206 Å²	206	87.1 Å²	87.1	96%	0.963	46%	0.458	S	S	*	.	S	Bend	trans	-69.6	10.1	179.1	-56.9	-177.6	145.8	0	0	114.9
325	L	66.4	Low	56.3	Low	62 Å²	62	91 Å²	91	33%	0.325	48%	0.481	S	S	.	.	S	Bend	trans	-78.8	159.1	179.5	-58.5	167.9	0	0	0	111	C282 K283 S323	C282-L325 WeakPolarHBondContact O-CD1 3.5Å; K283-L325 HydrophobicContact CB-CB 4.26Å; K283-L325 VanDerWaalsContact CB-O 3.23Å; K283-L325 WeakPolarHBondContact CB-O 3.07Å; S323-L325 PolarHBondContact O-N 3.22Å
326	E	58.7	Low	53.9	Low	177 Å²	177	94.9 Å²	94.9	83%	0.827	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-64	153.1	175.2	-65.7	-170	147.2	0	0	112.2	C282 K283	C282-E326 VanDerWaalsContact CB-O 3.31Å; C282-E326 WeakPolarHBondContact CB-O 3.22Å; K283-E326 WeakPolarHBondContact CB-O 3.05Å; K283-E326 PolarHBondContact N-O 2.99Å
327	E	54.3	Low	52	Low	131 Å²	131	96.2 Å²	96.2	61%	0.612	51%	0.508	S	S	*	.	B	Isolated β-bridge	trans	-78.2	124	179.9	-121.1	158.4	-123.2	0	0	110.8	K283 T329	K283-E327 HydrophobicContact CD-CG 4.25Å; K283-E327 WeakPolarHBondContact CE-OE1 3.27Å; K283-E327 IonicContact NZ-OE1 2.68Å; K283-E327 PolarHBondContact NZ-OE1 2.87Å; E327-T329 VanDerWaalsContact C-N 3.31Å; E327-T329 PolarHBondContact O-N 3.47Å
328	C	49.7	Very low	49.8	Very low	46 Å²	46	96.5 Å²	96.5	31%	0.311	51%	0.514	S	S	.	.			trans	-76.9	76.1	-171.7	-106.8	0	0	0	0	113.2	C282 N330 Y331	C282-C328 HydrophobicContact CB-CB 3.69Å; C282-C328 WeakPolarHBondContact CB-SG 3.48Å; C282-C328 WeakPolarHBondContact SG-CB 3.34Å; C282-C328 CovalentContact SG-SG 2Å; C282-C328 PolarHBondContact SG-SG 2.83Å; C328-N330 PolarHBondContact O-N 3.1Å; C328-Y331 WeakPolarHBondContact SG-CB 3.48Å
329	T	45	Very low	47.5	Very low	128 Å²	128	100.6 Å²	100.6	79%	0.785	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-14.5	177.2	53.1	0	0	0	0	114.6	E327	E327-T329 VanDerWaalsContact C-N 3.31Å; E327-T329 PolarHBondContact O-N 3.47Å
330	N	34.6	Very low	45.4	Very low	100 Å²	100	103.5 Å²	103.5	54%	0.535	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-150.2	48.3	176.5	-79.8	-75.4	0	0	0	112.2	C328 G348	C328-N330 PolarHBondContact O-N 3.1Å; N330-G348 CarbonylContact O-C 3.23Å; N330-G348 VanDerWaalsContact O-CA 3.27Å; N330-G348 WeakPolarHBondContact O-CA 3.3Å
331	Y	31.7	Very low	43.2	Very low	151 Å²	151	108.3 Å²	108.3	59%	0.592	57%	0.573	S	S	*	*			trans	-153.6	118.7	-179.2	-116.1	-91.7	0	0	0	116.2	C328	C328-Y331 WeakPolarHBondContact SG-CB 3.48Å
332	I	33	Very low	41.5	Very low	41 Å²	41	112.5 Å²	112.5	21%	0.21	58%	0.579	C	S	.	*			trans	-4.8	140.9	136.7	-29.9	176.4	0	0	0	117	G334 Q346 P347	I332-G334 VanDerWaalsContact C-N 3.29Å; I332-G334 PolarHBondContact O-N 2.79Å; I332-Q346 HydrophobicContact CD1-CB 3.91Å; I332-Q346 HydrophobicContact CD1-CG 3.83Å; I332-P347 HydrophobicContact CB-CG 4.29Å; I332-P347 VanDerWaalsContact CG1-C 3.41Å; I332-P347 HydrophobicContact CG1-CG 4.08Å; I332-P347 VanDerWaalsContact CG1-O 3.23Å; I332-P347 WeakPolarHBondContact CG1-O 3.49Å; I332-P347 HydrophobicContact CG2-CG 4.08Å; I332-P347 PolarHBondContact N-O 3.28Å
333	Y	31.1	Very low	39.4	Very low	155 Å²	155	111.1 Å²	111.1	61%	0.608	56%	0.563	S	S	*	*	S	Bend	trans	-53.7	86.1	151.6	-75.5	-112.6	0	0	0	111	T286 T319	T286-Y333 HydrophobicContact CG2-CD1 3.55Å; T286-Y333 HydrophobicContact CG2-CE1 3.45Å; T286-Y333 VanDerWaalsContact CG2-CE1 3.45Å; T319-Y333 HydrophobicContact CG2-CE1 4.04Å
334	G	28.3	Very low	37.4	Very low	13 Å²	13	116.1 Å²	116.1	13%	0.134	60%	0.597	C	S	.	*			trans	-85	152.3	-171.1	0	0	0	0	0	115.2	S279 I332	S279-G334 WeakPolarHBondContact CB-O 3.06Å; I332-G334 VanDerWaalsContact C-N 3.29Å; I332-G334 PolarHBondContact O-N 2.79Å
335	T	32.5	Very low	35.7	Very low	93 Å²	93	110.7 Å²	110.7	57%	0.571	58%	0.581	S	S	*	*			trans	72.4	143.6	165.7	79.5	0	0	0	0	115.4	T281	T281-T335 HydrophobicContact CG2-CG2 3.72Å
336	N	26.8	Very low	33.9	Very low	146 Å²	146	112.6 Å²	112.6	78%	0.781	59%	0.589	S	S	*	*	S	Bend	cis	-153.2	61.4	7.4	-158.5	15.7	0	0	0	114.9
337	I	33	Very low	32.7	Very low	94 Å²	94	107.2 Å²	107.2	48%	0.482	57%	0.569	S	S	.	*			trans	-130.5	146.4	165.5	-69.8	97.6	0	0	0	109.3	F307	F307-I337 HydrophobicContact CB-CD1 3.98Å; F307-I337 HydrophobicContact CB-CG1 3.79Å; F307-I337 HydrophobicContact CB-CG2 4.23Å; F307-I337 HydrophobicContact CD1-CD1 3.6Å; F307-I337 HydrophobicContact CD1-CG1 4.38Å; F307-I337 HydrophobicContact CD2-CD1 4.46Å; F307-I337 HydrophobicContact CE1-CD1 4.19Å; F307-I337 HydrophobicContact CG-CD1 3.77Å; F307-I337 HydrophobicContact CG-CG1 4.11Å
338	S	28.2	Very low	31.7	Very low	101 Å²	101	101.5 Å²	101.5	71%	0.706	55%	0.545	S	S	*	.			trans	-138.3	153.4	-176	62.3	0	0	0	0	111.3
339	L	28.7	Very low	31	Very low	147 Å²	147	101.5 Å²	101.5	77%	0.77	55%	0.549	S	S	*	.			trans	72	133.1	-169.9	-44.7	169.4	0	0	0	111.7
340	V	30.7	Very low	30.7	Very low	129 Å²	129	98.2 Å²	98.2	78%	0.782	53%	0.529	S	S	*	.			cis	-128.5	123	14.6	177.6	0	0	0	0	112.4
341	K	28.3	Very low	31.4	Very low	152 Å²	152	95 Å²	95	66%	0.661	51%	0.511	S	S	*	.			trans	10.9	132.1	145.4	-75.7	173.8	170.1	-166.3	0	119
342	Y	27.7	Very low	32.4	Very low	175 Å²	175	90.6 Å²	90.6	69%	0.686	50%	0.498	S	S	*	.	S	Bend	cis	-142.4	144.8	15.7	-92.9	-79.7	0	0	0	113.4
343	N	23.9	Very low	34.1	Very low	71 Å²	71	90.8 Å²	90.8	38%	0.38	50%	0.502	S	S	.	.			trans	53.8	55.5	153.4	-61.4	7.8	0	0	0	119.5	F382 Q383	N343-F382 HydrophobicContact CB-CD1 4.1Å; N343-F382 HydrophobicContact CB-CE1 3.96Å; N343-Q383 PolarHBondContact ND2-OE1 3.25Å
344	C	25.4	Very low	35.8	Very low	120 Å²	120	90 Å²	90	81%	0.811	51%	0.508	S	S	*	.			trans	-108.3	163	131.3	-77.8	0	0	0	0	109.5
345	S	30.9	Very low	37.7	Very low	92 Å²	92	93.1 Å²	93.1	64%	0.643	53%	0.528	S	S	*	.			trans	49.4	94.1	177.8	60.7	0	0	0	0	117.4
346	Q	29.5	Very low	39.6	Very low	103 Å²	103	97.1 Å²	97.1	48%	0.481	54%	0.537	S	S	.	.				-107.5	146	92.8	-71.2	-170.2	12.1	0	0	107.8	I332 H351	I332-Q346 HydrophobicContact CD1-CB 3.91Å; I332-Q346 HydrophobicContact CD1-CG 3.83Å; Q346-H351 VanDerWaalsContact CB-NE2 3.29Å; Q346-H351 WeakPolarHBondContact CB-NE2 2.94Å; Q346-H351 PolarHBondContact N-NE2 3.39Å; Q346-H351 PolarHBondContact O-ND1 3.47Å; Q346-H351 PolarHBondContact O-NE2 3.15Å
347	P	32.8	Very low	42.1	Very low	63 Å²	63	90.9 Å²	90.9	41%	0.409	50%	0.504	S	S	.	.			trans	-121.8	75.1	136.5	34.8	-36.6	0	0	0	112	I332 H351	I332-P347 HydrophobicContact CB-CG 4.29Å; I332-P347 VanDerWaalsContact CG1-C 3.41Å; I332-P347 HydrophobicContact CG1-CG 4.08Å; I332-P347 VanDerWaalsContact CG1-O 3.23Å; I332-P347 WeakPolarHBondContact CG1-O 3.49Å; I332-P347 HydrophobicContact CG2-CG 4.08Å; I332-P347 PolarHBondContact N-O 3.28Å; P347-H351 VanDerWaalsContact CA-CD2 3.45Å; P347-H351 WeakPolarHBondContact CA-CD2 3.21Å
348	G	33.2	Very low	44.6	Very low	11 Å²	11	87.4 Å²	87.4	11%	0.113	49%	0.488	C	S	.	.	S	Bend	trans	-161.6	-48.4	-171.8	0	0	0	0	0	116.6	N330	N330-G348 CarbonylContact O-C 3.23Å; N330-G348 VanDerWaalsContact O-CA 3.27Å; N330-G348 WeakPolarHBondContact O-CA 3.3Å
349	A	36.4	Very low	47.2	Very low	46 Å²	46	87.4 Å²	87.4	38%	0.38	48%	0.479	S	S	.	.	S	Bend	trans	-58.4	152.1	147.3	0	0	0	0	0	107.5	H351	A349-H351 PolarHBondContact O-CD2 2.86Å; A349-H351 PolarHBondContact O-N 3.04Å; A349-H351 VanDerWaalsContact O-N 3.13Å
350	P	38.2	Very low	49.8	Very low	59 Å²	59	84.2 Å²	84.2	38%	0.383	46%	0.462	S	S	.	.			trans	-54.5	126.5	173.5	-23.5	33.4	0	0	0	108.8	N352 L354	P350-N352 HydrophobicContact CB-CB 3.98Å; P350-N352 PolarHBondContact O-N 2.86Å; P350-L354 HydrophobicContact CB-CD1 4.11Å; P350-L354 HydrophobicContact CG-CD1 4.12Å
351	H	48.2	Very low	52.1	Low	33 Å²	33	79.9 Å²	79.9	15%	0.153	44%	0.443	C	S	.	.	S	Bend	trans	-76.9	45.6	-179.2	-91.2	-82.7	0	0	0	112.5	Q346 P347 A349 S366 Y370 Y371	Q346-H351 VanDerWaalsContact CB-NE2 3.29Å; Q346-H351 WeakPolarHBondContact CB-NE2 2.94Å; Q346-H351 PolarHBondContact N-NE2 3.39Å; Q346-H351 PolarHBondContact O-ND1 3.47Å; Q346-H351 PolarHBondContact O-NE2 3.15Å; P347-H351 VanDerWaalsContact CA-CD2 3.45Å; P347-H351 WeakPolarHBondContact CA-CD2 3.21Å; A349-H351 PolarHBondContact O-CD2 2.86Å; A349-H351 PolarHBondContact O-N 3.04Å; A349-H351 VanDerWaalsContact O-N 3.13Å; H351-S366 WeakPolarHBondContact O-CB 3.42Å; H351-Y370 CarbonylContact O-C 3.52Å; H351-Y371 AromaticContact CE1-CD1 3.36Å; H351-Y371 WeakPolarHBondContact CE1-CD1 2.96Å
352	N	53.6	Low	54.5	Low	58 Å²	58	73.2 Å²	73.2	31%	0.31	42%	0.418	S	S	.	.	S	Bend	trans	-131.7	161.1	-158.9	-52.6	8.6	0	0	0	106.8	P350 L354	P350-N352 HydrophobicContact CB-CB 3.98Å; P350-N352 PolarHBondContact O-N 2.86Å; N352-L354 PolarHBondContact O-N 3.47Å
353	C	69.6	Low	57.2	Low	45 Å²	45	69.2 Å²	69.2	30%	0.304	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-72.2	9.3	-168.6	-56.1	0	0	0	0	116.3	S355 K356 C364 S365	C353-S355 VanDerWaalsContact C-N 3.27Å; C353-S355 PolarHBondContact O-N 2.79Å; C353-K356 PolarHBondContact O-N 3.37Å; C353-C364 WeakPolarHBondContact CA-SG 3.01Å; C353-C364 HydrophobicContact CB-CB 3.51Å; C353-C364 WeakPolarHBondContact CB-SG 3.43Å; C353-C364 WeakPolarHBondContact SG-CB 3.27Å; C353-C364 PolarHBondContact SG-O 2.94Å; C353-C364 CovalentContact SG-SG 2.04Å; C353-C364 PolarHBondContact SG-SG 2.79Å; C353-S365 PolarHBondContact SG-N 3.12Å
354	L	66.3	Low	59.9	Low	139 Å²	139	67 Å²	67	73%	0.728	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-59.9	-34.4	173.4	-65.9	170.1	0	0	0	112.4	P350 N352 K356	P350-L354 HydrophobicContact CB-CD1 4.11Å; P350-L354 HydrophobicContact CG-CD1 4.12Å; N352-L354 PolarHBondContact O-N 3.47Å; L354-K356 VanDerWaalsContact C-N 3.31Å; L354-K356 PolarHBondContact O-N 3Å
355	S	67.3	Low	62.1	Low	78 Å²	78	62.5 Å²	62.5	55%	0.545	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-79.1	-8.1	178.7	58.7	0	0	0	0	114.4	C353	C353-S355 VanDerWaalsContact C-N 3.27Å; C353-S355 PolarHBondContact O-N 2.79Å
356	K	73.7	Confident	63.7	Low	178 Å²	178	60.2 Å²	60.2	77%	0.774	36%	0.356	S	S	*	.			trans	47.3	58.3	-175	-59.9	178.2	-177.4	173.2	0	113.5	C353 L354 C358	C353-K356 PolarHBondContact O-N 3.37Å; L354-K356 VanDerWaalsContact C-N 3.31Å; L354-K356 PolarHBondContact O-N 3Å; K356-C358 VanDerWaalsContact C-N 3.26Å; K356-C358 PolarHBondContact O-N 2.89Å
357	P	78.5	Confident	65	Low	14 Å²	14	59.3 Å²	59.3	9%	0.091	35%	0.354	C	S	.	.			trans	-73	-11.5	-169.2	30.2	-35.5	0	0	0	114.9	C364 Y371 Q383	P357-C364 HydrophobicContact CG-CB 4.36Å; P357-Y371 HydrophobicContact CB-CD2 3.9Å; P357-Y371 HydrophobicContact CB-CE1 4.17Å; P357-Y371 HydrophobicContact CB-CE2 3.46Å; P357-Y371 VanDerWaalsContact CB-CE2 3.46Å; P357-Y371 HydrophobicContact CB-CG 4.44Å; P357-Y371 HydrophobicContact CG-CD1 4.3Å; P357-Y371 HydrophobicContact CG-CD2 3.43Å; P357-Y371 VanDerWaalsContact CG-CD2 3.43Å; P357-Y371 HydrophobicContact CG-CE1 4.4Å; P357-Y371 HydrophobicContact CG-CE2 3.58Å; P357-Y371 HydrophobicContact CG-CG 3.84Å; P357-Q383 PolarHBondContact O-NE2 2.87Å
358	C	85	Confident	65.9	Low	21 Å²	21	58.9 Å²	58.9	14%	0.142	36%	0.361	C	S	.	.			trans	-94.5	123.5	-172.8	-45.6	0	0	0	0	112.8	K356 G362 C364 C373	K356-C358 VanDerWaalsContact C-N 3.26Å; K356-C358 PolarHBondContact O-N 2.89Å; C358-G362 WeakPolarHBondContact CB-O 3.37Å; C358-C364 VanDerWaalsContact SG-CB 3.58Å; C358-C373 WeakPolarHBondContact CA-SG 3.34Å; C358-C373 HydrophobicContact CB-CB 3.8Å; C358-C373 WeakPolarHBondContact CB-SG 3.41Å; C358-C373 WeakPolarHBondContact SG-CA 3.48Å; C358-C373 WeakPolarHBondContact SG-CB 3.48Å; C358-C373 CovalentContact SG-SG 2.04Å; C358-C373 PolarHBondContact SG-SG 2.88Å
359	M	83.3	Confident	66.7	Low	102 Å²	102	64 Å²	64	50%	0.502	39%	0.385	S	S	.	.	S	Bend	trans	-79	174.5	172.9	-56	-164.6	176.5	0	0	112.1	G361 G362 Q383 E385	M359-G361 PolarHBondContact O-N 2.76Å; M359-G362 PolarHBondContact O-N 3.37Å; M359-Q383 WeakPolarHBondContact CA-O 3.41Å; M359-Q383 VanDerWaalsContact CB-O 3.24Å; M359-Q383 WeakPolarHBondContact CB-O 3.27Å; M359-Q383 PolarHBondContact N-O 3.19Å; M359-E385 HydrophobicContact SD-CB 4.1Å
360	N	84.3	Confident	67.6	Low	80 Å²	80	69 Å²	69	43%	0.428	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	18.4	178	-64.4	-50.4	0	0	0	114.9	F379 C384	N360-F379 HydrophobicContact CB-CB 4.5Å; N360-F379 HydrophobicContact CB-CD1 3.57Å; N360-F379 HydrophobicContact CB-CD2 3.92Å; N360-F379 HydrophobicContact CB-CE1 3.63Å; N360-F379 HydrophobicContact CB-CE2 3.97Å; N360-F379 HydrophobicContact CB-CG 3.71Å; N360-F379 HydrophobicContact CB-CZ 3.83Å; N360-F379 VanDerWaalsContact CG-CD1 3.46Å; N360-F379 VanDerWaalsContact ND2-CD1 3.32Å; N360-F379 WeakPolarHBondContact ND2-CD1 3.46Å; N360-F379 WeakPolarHBondContact ND2-CE1 2.98Å; N360-C384 PolarHBondContact ND2-O 3.49Å
361	G	77.5	Confident	69.1	Low	37 Å²	37	67.4 Å²	67.4	38%	0.381	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	30.5	-176.2	0	0	0	0	0	114.3	M359 K376	M359-G361 PolarHBondContact O-N 2.76Å; G361-K376 WeakPolarHBondContact O-CD 3.5Å; G361-K376 WeakPolarHBondContact O-CE 3.2Å; G361-K376 PolarHBondContact O-NZ 3.46Å
362	G	80.4	Confident	70.3	Confident	12 Å²	12	70.1 Å²	70.1	12%	0.124	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-59.7	154.1	162.2	0	0	0	0	0	111.6	C358 M359 D374	C358-G362 WeakPolarHBondContact CB-O 3.37Å; M359-G362 PolarHBondContact O-N 3.37Å; G362-D374 CarbonylContact C-O 3.4Å; G362-D374 WeakPolarHBondContact CA-O 3.4Å
363	T	82.9	Confident	71.6	Confident	91 Å²	91	68.4 Å²	68.4	56%	0.558	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	137.4	176.2	-47.4	0	0	0	0	108.7	C373 D374	T363-C373 CarbonylContact O-C 3.51Å; T363-C373 WeakPolarHBondContact O-CA 3.31Å; T363-D374 PolarHBondContact N-O 3.14Å; T363-D374 PolarHBondContact O-N 2.93Å
364	C	81	Confident	71.9	Confident	26 Å²	26	69.2 Å²	69.2	18%	0.176	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	138	168.4	169.8	0	0	0	0	109.9	C353 P357 C358 F372	C353-C364 WeakPolarHBondContact CA-SG 3.01Å; C353-C364 HydrophobicContact CB-CB 3.51Å; C353-C364 WeakPolarHBondContact CB-SG 3.43Å; C353-C364 WeakPolarHBondContact SG-CB 3.27Å; C353-C364 PolarHBondContact SG-O 2.94Å; C353-C364 CovalentContact SG-SG 2.04Å; C353-C364 PolarHBondContact SG-SG 2.79Å; P357-C364 HydrophobicContact CG-CB 4.36Å; C358-C364 VanDerWaalsContact SG-CB 3.58Å; C364-F372 WeakPolarHBondContact CA-O 3.01Å
365	S	70.9	Confident	72.6	Confident	24 Å²	24	64.7 Å²	64.7	17%	0.168	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	158.5	168	45.7	0	0	0	0	109.1	C353 Y371 F372	C353-S365 PolarHBondContact SG-N 3.12Å; S365-Y371 CarbonylContact O-C 3.55Å; S365-Y371 VanDerWaalsContact O-CA 3.31Å; S365-Y371 WeakPolarHBondContact O-CA 2.98Å; S365-F372 PolarHBondContact N-O 2.86Å; S365-F372 PolarHBondContact O-N 2.85Å
366	S	64.8	Low	73.1	Confident	45 Å²	45	66.3 Å²	66.3	32%	0.315	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	126.6	-174.7	56.4	0	0	0	0	115	H351 G368 Y370	H351-S366 WeakPolarHBondContact O-CB 3.42Å; S366-G368 VanDerWaalsContact C-N 3.3Å; S366-G368 PolarHBondContact O-N 3.1Å; S366-Y370 CarbonylContact C-O 3.45Å; S366-Y370 WeakPolarHBondContact CA-O 3.02Å; S366-Y370 WeakPolarHBondContact CB-O 3.46Å
367	D	57.4	Low	73	Confident	83 Å²	83	61.2 Å²	61.2	44%	0.444	35%	0.349	S	S	.	.			trans	-96.7	33.4	-174.2	-61.5	-8.8	0	0	0	111.8	L369 Y370 F372 H711	D367-L369 PolarHBondContact O-N 2.9Å; D367-Y370 PolarHBondContact N-O 3.36Å; D367-F372 HydrophobicContact CB-CE2 4.41Å; D367-F372 WeakPolarHBondContact OD2-CE2 3.45Å; D367-H711 IonicContact OD1-CE1 2.75Å; D367-H711 PolarHBondContact OD1-CE1 3.2Å; D367-H711 IonicContact OD1-ND1 2.72Å; D367-H711 PolarHBondContact OD1-ND1 3.21Å; D367-H711 VanDerWaalsContact OD1-ND1 3.12Å; D367-H711 IonicContact OD2-ND1 3.17Å
368	G	52.3	Low	72.5	Confident	55 Å²	55	60.6 Å²	60.6	57%	0.567	35%	0.345	S	S	*	.	S	Bend	trans	70.6	-25.5	-177.9	0	0	0	0	0	116	S366	S366-G368 VanDerWaalsContact C-N 3.3Å; S366-G368 PolarHBondContact O-N 3.1Å
369	L	50.4	Low	72.3	Confident	118 Å²	118	61.9 Å²	61.9	62%	0.618	35%	0.348	S	S	*	.	S	Bend	trans	-113.7	-24.4	178.1	-79.8	161.8	0	0	0	113.8	D367	D367-L369 PolarHBondContact O-N 2.9Å
370	Y	55	Low	72	Confident	151 Å²	151	62.3 Å²	62.3	59%	0.592	35%	0.348	S	S	*	.			trans	-137.7	152.4	-177.2	-59.4	-80.8	0	0	0	110.4	H351 S366 D367	H351-Y370 CarbonylContact O-C 3.52Å; S366-Y370 CarbonylContact C-O 3.45Å; S366-Y370 WeakPolarHBondContact CA-O 3.02Å; S366-Y370 WeakPolarHBondContact CB-O 3.46Å; D367-Y370 PolarHBondContact N-O 3.36Å
371	Y	69.3	Low	71.5	Confident	26 Å²	26	59.8 Å²	59.8	10%	0.102	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	149.9	165.3	76.3	-101.1	0	0	0	110.2	H351 P357 S365 F382	H351-Y371 AromaticContact CE1-CD1 3.36Å; H351-Y371 WeakPolarHBondContact CE1-CD1 2.96Å; P357-Y371 HydrophobicContact CB-CD2 3.9Å; P357-Y371 HydrophobicContact CB-CE1 4.17Å; P357-Y371 HydrophobicContact CB-CE2 3.46Å; P357-Y371 VanDerWaalsContact CB-CE2 3.46Å; P357-Y371 HydrophobicContact CB-CG 4.44Å; P357-Y371 HydrophobicContact CG-CD1 4.3Å; P357-Y371 HydrophobicContact CG-CD2 3.43Å; P357-Y371 VanDerWaalsContact CG-CD2 3.43Å; P357-Y371 HydrophobicContact CG-CE1 4.4Å; P357-Y371 HydrophobicContact CG-CE2 3.58Å; P357-Y371 HydrophobicContact CG-CG 3.84Å; S365-Y371 CarbonylContact O-C 3.55Å; S365-Y371 VanDerWaalsContact O-CA 3.31Å; S365-Y371 WeakPolarHBondContact O-CA 2.98Å; Y371-F382 AromaticContact CE2-CE1 3.8Å; Y371-F382 HydrophobicContact CE2-CE1 3.8Å; Y371-F382 AromaticContact CE2-CZ 3.91Å; Y371-F382 HydrophobicContact CE2-CZ 3.91Å; Y371-F382 AromaticContact CZ-CE1 3.66Å; Y371-F382 WeakPolarHBondContact OH-CE1 3.35Å
372	F	72.4	Confident	71.4	Confident	89 Å²	89	62.8 Å²	62.8	39%	0.39	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	159.1	174.4	-55.1	-81.4	0	0	0	109.7	C364 S365 D367	C364-F372 WeakPolarHBondContact CA-O 3.01Å; S365-F372 PolarHBondContact N-O 2.86Å; S365-F372 PolarHBondContact O-N 2.85Å; D367-F372 HydrophobicContact CB-CE2 4.41Å; D367-F372 WeakPolarHBondContact OD2-CE2 3.45Å
373	C	81.2	Confident	71.6	Confident	22 Å²	22	64.3 Å²	64.3	15%	0.149	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	104.9	-177.5	-75.3	0	0	0	0	111.7	C358 T363 C375 F382	C358-C373 WeakPolarHBondContact CA-SG 3.34Å; C358-C373 HydrophobicContact CB-CB 3.8Å; C358-C373 WeakPolarHBondContact CB-SG 3.41Å; C358-C373 WeakPolarHBondContact SG-CA 3.48Å; C358-C373 WeakPolarHBondContact SG-CB 3.48Å; C358-C373 CovalentContact SG-SG 2.04Å; C358-C373 PolarHBondContact SG-SG 2.88Å; T363-C373 CarbonylContact O-C 3.51Å; T363-C373 WeakPolarHBondContact O-CA 3.31Å; C373-C375 PolarHBondContact O-N 2.03Å; C373-C375 VanDerWaalsContact O-N 3.1Å; C373-C375 PolarHBondContact O-SG 2.95Å; C373-F382 WeakPolarHBondContact CB-O 3.48Å
374	D	77.1	Confident	71.7	Confident	63 Å²	63	60 Å²	60	34%	0.337	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	99.4	173.4	-63.1	-45.2	0	0	0	109.9	G362 T363	G362-D374 CarbonylContact C-O 3.4Å; G362-D374 WeakPolarHBondContact CA-O 3.4Å; T363-D374 PolarHBondContact N-O 3.14Å; T363-D374 PolarHBondContact O-N 2.93Å
375	C	80.1	Confident	71.8	Confident	43 Å²	43	62.6 Å²	62.6	29%	0.291	33%	0.33	S	S	.	.			trans	-72	135.1	-177.3	-55.4	0	0	0	0	112.1	C373 F379 C384	C373-C375 PolarHBondContact O-N 2.03Å; C373-C375 VanDerWaalsContact O-N 3.1Å; C373-C375 PolarHBondContact O-SG 2.95Å; C375-F379 HydrophobicContact CB-CB 4.21Å; C375-F379 VanDerWaalsContact CB-O 3.28Å; C375-F379 WeakPolarHBondContact CB-O 3.4Å; C375-C384 WeakPolarHBondContact CA-SG 3.19Å; C375-C384 HydrophobicContact CB-CB 3.77Å; C375-C384 WeakPolarHBondContact CB-SG 3.3Å; C375-C384 PolarHBondContact N-SG 2.78Å; C375-C384 WeakPolarHBondContact SG-CA 3.39Å; C375-C384 WeakPolarHBondContact SG-CB 3.32Å; C375-C384 CovalentContact SG-SG 2.04Å; C375-C384 PolarHBondContact SG-SG 3.35Å
376	K	78.1	Confident	72.1	Confident	112 Å²	112	65.4 Å²	65.4	49%	0.487	34%	0.34	S	S	.	.			trans	-59.3	149.7	169.5	-81.2	176.8	171.9	133.5	0	110.3	G361 G378 F379	G361-K376 WeakPolarHBondContact O-CD 3.5Å; G361-K376 WeakPolarHBondContact O-CE 3.2Å; G361-K376 PolarHBondContact O-NZ 3.46Å; K376-G378 PolarHBondContact O-N 2.93Å; K376-F379 HydrophobicContact CB-CD2 4.26Å; K376-F379 PolarHBondContact O-N 3.24Å
377	P	71.5	Confident	72.4	Confident	71 Å²	71	69.8 Å²	69.8	46%	0.461	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.1	135	167.1	-29	36	0	0	0	111	M409	P377-M409 HydrophobicContact CB-CB 4.03Å
378	G	68.4	Low	72.9	Confident	2 Å²	2	67.5 Å²	67.5	2%	0.021	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	-4.2	-170.4	0	0	0	0	0	116.1	K376 Q387 V388 Y390	K376-G378 PolarHBondContact O-N 2.93Å; G378-Q387 CarbonylContact O-C 3.53Å; G378-Q387 WeakPolarHBondContact O-CA 3.43Å; G378-Q387 WeakPolarHBondContact O-CG 3.34Å; G378-V388 PolarHBondContact O-N 2.96Å; G378-Y390 PolarHBondContact N-OH 2.95Å
379	F	81	Confident	73.6	Confident	47 Å²	47	70.6 Å²	70.6	21%	0.206	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	151.2	179.8	-59.5	-81.8	0	0	0	113.6	N360 C375 K376 C384 Q386 M409	N360-F379 HydrophobicContact CB-CB 4.5Å; N360-F379 HydrophobicContact CB-CD1 3.57Å; N360-F379 HydrophobicContact CB-CD2 3.92Å; N360-F379 HydrophobicContact CB-CE1 3.63Å; N360-F379 HydrophobicContact CB-CE2 3.97Å; N360-F379 HydrophobicContact CB-CG 3.71Å; N360-F379 HydrophobicContact CB-CZ 3.83Å; N360-F379 VanDerWaalsContact CG-CD1 3.46Å; N360-F379 VanDerWaalsContact ND2-CD1 3.32Å; N360-F379 WeakPolarHBondContact ND2-CD1 3.46Å; N360-F379 WeakPolarHBondContact ND2-CE1 2.98Å; C375-F379 HydrophobicContact CB-CB 4.21Å; C375-F379 VanDerWaalsContact CB-O 3.28Å; C375-F379 WeakPolarHBondContact CB-O 3.4Å; K376-F379 HydrophobicContact CB-CD2 4.26Å; K376-F379 PolarHBondContact O-N 3.24Å; F379-C384 HydrophobicContact CB-CB 4.38Å; F379-Q386 CarbonylContact C-O 3.51Å; F379-Q386 VanDerWaalsContact CA-O 3.23Å; F379-Q386 WeakPolarHBondContact CA-O 3.13Å; F379-M409 HydrophobicContact CE2-CE 4.06Å
380	K	75.5	Confident	74.5	Confident	112 Å²	112	67.8 Å²	67.8	49%	0.487	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	177.1	176.8	69.3	175.8	179.1	163.4	0	110.2	C384 E385 Q386 V388	K380-C384 CarbonylContact O-C 3.41Å; K380-C384 VanDerWaalsContact O-C 3.31Å; K380-C384 WeakPolarHBondContact O-CA 3.44Å; K380-E385 PolarHBondContact O-N 3.26Å; K380-Q386 VanDerWaalsContact CE-OE1 3.25Å; K380-Q386 HydrophobicContact CG-CB 3.74Å; K380-Q386 PolarHBondContact N-O 3.35Å; K380-Q386 WeakPolarHBondContact O-CB 3.33Å; K380-Q386 PolarHBondContact O-N 3.25Å; K380-V388 HydrophobicContact CB-CG2 3.81Å; K380-V388 HydrophobicContact CD-CG2 4.17Å; K380-V388 HydrophobicContact CG-CG2 3.92Å
381	G	74	Confident	75.4	Confident	26 Å²	26	62.4 Å²	62.4	27%	0.268	31%	0.309	S	S	.	.	S	Bend	trans	98.7	161.1	-177.7	0	0	0	0	0	112.5	Q383 C384 E385	G381-Q383 PolarHBondContact O-N 3.03Å; G381-C384 PolarHBondContact O-N 3.35Å; G381-E385 VanDerWaalsContact C-OE2 3.26Å; G381-E385 VanDerWaalsContact CA-OE1 3.3Å; G381-E385 WeakPolarHBondContact CA-OE1 3.22Å
382	F	76.7	Confident	75.4	Confident	100 Å²	100	67.1 Å²	67.1	44%	0.439	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-24.7	-168.9	-178.9	-109.6	0	0	0	113.7	N343 Y371 C373 E385	N343-F382 HydrophobicContact CB-CD1 4.1Å; N343-F382 HydrophobicContact CB-CE1 3.96Å; Y371-F382 AromaticContact CE2-CE1 3.8Å; Y371-F382 HydrophobicContact CE2-CE1 3.8Å; Y371-F382 AromaticContact CE2-CZ 3.91Å; Y371-F382 HydrophobicContact CE2-CZ 3.91Å; Y371-F382 AromaticContact CZ-CE1 3.66Å; Y371-F382 WeakPolarHBondContact OH-CE1 3.35Å; C373-F382 WeakPolarHBondContact CB-O 3.48Å; F382-E385 PolarHBondContact N-OE2 3.23Å
383	Q	82.8	Confident	74.8	Confident	44 Å²	44	69.3 Å²	69.3	21%	0.206	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	20	172.4	-60.1	-171.1	-104.1	0	0	110.8	N343 P357 M359 G381 E385	N343-Q383 PolarHBondContact ND2-OE1 3.25Å; P357-Q383 PolarHBondContact O-NE2 2.87Å; M359-Q383 WeakPolarHBondContact CA-O 3.41Å; M359-Q383 VanDerWaalsContact CB-O 3.24Å; M359-Q383 WeakPolarHBondContact CB-O 3.27Å; M359-Q383 PolarHBondContact N-O 3.19Å; G381-Q383 PolarHBondContact O-N 3.03Å; Q383-E385 WeakPolarHBondContact CA-OE2 3.28Å; Q383-E385 PolarHBondContact N-OE2 2.82Å; Q383-E385 PolarHBondContact O-N 2.94Å
384	C	85	Confident	74	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	37%	0.367	C	S	.	.	S	Bend	trans	56.2	29.2	-174.1	-52.1	0	0	0	0	114.5	N360 C375 F379 K380 G381	N360-C384 PolarHBondContact ND2-O 3.49Å; C375-C384 WeakPolarHBondContact CA-SG 3.19Å; C375-C384 HydrophobicContact CB-CB 3.77Å; C375-C384 WeakPolarHBondContact CB-SG 3.3Å; C375-C384 PolarHBondContact N-SG 2.78Å; C375-C384 WeakPolarHBondContact SG-CA 3.39Å; C375-C384 WeakPolarHBondContact SG-CB 3.32Å; C375-C384 CovalentContact SG-SG 2.04Å; C375-C384 PolarHBondContact SG-SG 3.35Å; F379-C384 HydrophobicContact CB-CB 4.38Å; K380-C384 CarbonylContact O-C 3.41Å; K380-C384 VanDerWaalsContact O-C 3.31Å; K380-C384 WeakPolarHBondContact O-CA 3.44Å; G381-C384 PolarHBondContact O-N 3.35Å
385	E	84.1	Confident	73.8	Confident	81 Å²	81	72.2 Å²	72.2	38%	0.379	36%	0.363	S	S	.	.			trans	-76.6	-18.2	-173.3	72.9	-67.8	161.8	0	0	114.2	M359 K380 G381 F382 Q383	M359-E385 HydrophobicContact SD-CB 4.1Å; K380-E385 PolarHBondContact O-N 3.26Å; G381-E385 VanDerWaalsContact C-OE2 3.26Å; G381-E385 VanDerWaalsContact CA-OE1 3.3Å; G381-E385 WeakPolarHBondContact CA-OE1 3.22Å; F382-E385 PolarHBondContact N-OE2 3.23Å; Q383-E385 WeakPolarHBondContact CA-OE2 3.28Å; Q383-E385 PolarHBondContact N-OE2 2.82Å; Q383-E385 PolarHBondContact O-N 2.94Å
386	Q	78	Confident	73.6	Confident	84 Å²	84	70.2 Å²	70.2	39%	0.393	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	144.4	-174.5	-48.6	169.4	29	0	0	110.9	F379 K380	F379-Q386 CarbonylContact C-O 3.51Å; F379-Q386 VanDerWaalsContact CA-O 3.23Å; F379-Q386 WeakPolarHBondContact CA-O 3.13Å; K380-Q386 VanDerWaalsContact CE-OE1 3.25Å; K380-Q386 HydrophobicContact CG-CB 3.74Å; K380-Q386 PolarHBondContact N-O 3.35Å; K380-Q386 WeakPolarHBondContact O-CB 3.33Å; K380-Q386 PolarHBondContact O-N 3.25Å
387	Q	70.4	Confident	73.4	Confident	136 Å²	136	67.8 Å²	67.8	64%	0.636	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	137.7	174.4	-166.7	177.1	-7.4	0	0	111.4	G378	G378-Q387 CarbonylContact O-C 3.53Å; G378-Q387 WeakPolarHBondContact O-CA 3.43Å; G378-Q387 WeakPolarHBondContact O-CG 3.34Å
388	V	67.6	Low	73.6	Confident	36 Å²	36	68.9 Å²	68.9	22%	0.218	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-85.3	124.3	174.6	-178	0	0	0	0	109.9	G378 K380 Y390	G378-V388 PolarHBondContact O-N 2.96Å; K380-V388 HydrophobicContact CB-CG2 3.81Å; K380-V388 HydrophobicContact CD-CG2 4.17Å; K380-V388 HydrophobicContact CG-CG2 3.92Å; V388-Y390 HydrophobicContact CB-CE1 4.41Å; V388-Y390 HydrophobicContact CB-CE2 4.07Å; V388-Y390 HydrophobicContact CG1-CD1 3.79Å; V388-Y390 HydrophobicContact CG1-CD2 4.11Å; V388-Y390 HydrophobicContact CG1-CE1 3.52Å; V388-Y390 HydrophobicContact CG1-CE2 3.85Å; V388-Y390 HydrophobicContact CG1-CG 4.07Å
389	K	67.6	Low	74	Confident	120 Å²	120	70.5 Å²	70.5	52%	0.522	36%	0.361	S	S	.	.			trans	-107.4	97.4	174	-63.9	165.2	173.1	176	0	109	C391 E392	K389-C391 PolarHBondContact O-N 2.83Å; K389-C391 VanDerWaalsContact O-N 3.11Å; K389-E392 HydrophobicContact CB-CG 3.98Å; K389-E392 HydrophobicContact CD-CG 4.11Å; K389-E392 WeakPolarHBondContact CD-OE1 3.24Å; K389-E392 WeakPolarHBondContact CD-OE2 3Å; K389-E392 WeakPolarHBondContact CE-OE1 3.44Å; K389-E392 IonicContact NZ-OE1 2.86Å; K389-E392 PolarHBondContact NZ-OE1 2.85Å; K389-E392 IonicContact NZ-OE2 3.76Å; K389-E392 PolarHBondContact NZ-OE2 3.15Å; K389-E392 PolarHBondContact O-N 3.47Å
390	Y	67.7	Low	73.9	Confident	58 Å²	58	68.5 Å²	68.5	23%	0.227	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-13.4	-165.7	-66.7	-83.6	0	0	0	116.1	G378 V388 T395 N404 M409 Y411	G378-Y390 PolarHBondContact N-OH 2.95Å; V388-Y390 HydrophobicContact CB-CE1 4.41Å; V388-Y390 HydrophobicContact CB-CE2 4.07Å; V388-Y390 HydrophobicContact CG1-CD1 3.79Å; V388-Y390 HydrophobicContact CG1-CD2 4.11Å; V388-Y390 HydrophobicContact CG1-CE1 3.52Å; V388-Y390 HydrophobicContact CG1-CE2 3.85Å; V388-Y390 HydrophobicContact CG1-CG 4.07Å; Y390-T395 PolarHBondContact O-OG1 2.84Å; Y390-N404 PolarHBondContact N-OD1 2.94Å; Y390-M409 VanDerWaalsContact CE2-O 3.24Å; Y390-M409 WeakPolarHBondContact CE2-O 3.01Å; Y390-M409 PolarHBondContact OH-O 2.04Å; Y390-Y411 HydrophobicContact CD1-CD1 4.01Å; Y390-Y411 HydrophobicContact CG-CD1 4.22Å
391	C	75.6	Confident	74.4	Confident	39 Å²	39	69.8 Å²	69.8	26%	0.264	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	17.6	177.4	-61.7	0	0	0	0	114.1	K389 C402	K389-C391 PolarHBondContact O-N 2.83Å; K389-C391 VanDerWaalsContact O-N 3.11Å; C391-C402 VanDerWaalsContact CA-SG 3.51Å; C391-C402 HydrophobicContact CB-CB 3.77Å; C391-C402 WeakPolarHBondContact CB-SG 3.47Å; C391-C402 WeakPolarHBondContact SG-CB 3.3Å; C391-C402 CovalentContact SG-SG 2.05Å; C391-C402 PolarHBondContact SG-SG 3.35Å
392	E	69.4	Low	74.8	Confident	124 Å²	124	70.5 Å²	70.5	58%	0.579	36%	0.362	S	S	*	.	S	Bend	trans	-83.5	-22.8	169.8	-74.5	-172.9	157.3	0	0	113.1	K389	K389-E392 HydrophobicContact CB-CG 3.98Å; K389-E392 HydrophobicContact CD-CG 4.11Å; K389-E392 WeakPolarHBondContact CD-OE1 3.24Å; K389-E392 WeakPolarHBondContact CD-OE2 3Å; K389-E392 WeakPolarHBondContact CE-OE1 3.44Å; K389-E392 IonicContact NZ-OE1 2.86Å; K389-E392 PolarHBondContact NZ-OE1 2.85Å; K389-E392 IonicContact NZ-OE2 3.76Å; K389-E392 PolarHBondContact NZ-OE2 3.15Å; K389-E392 PolarHBondContact O-N 3.47Å
393	N	60	Low	75	Confident	135 Å²	135	70.4 Å²	70.4	72%	0.722	36%	0.363	S	S	*	.	S	Bend	trans	-111.2	52.3	-177.6	-71.1	55.6	0	0	0	112.1	T395	N393-T395 WeakPolarHBondContact O-CA 3.26Å; N393-T395 PolarHBondContact O-N 3.48Å; N393-T395 PolarHBondContact O-OG1 3.35Å
394	D	64.1	Low	74.5	Confident	107 Å²	107	72 Å²	72	57%	0.572	37%	0.374	S	S	*	.			trans	45.1	29.9	161.7	-139.7	9.6	0	0	0	117.5	C396 S397	D394-C396 PolarHBondContact O-N 3.42Å; D394-S397 VanDerWaalsContact CG-OG 3.29Å; D394-S397 PolarHBondContact O-N 2.78Å; D394-S397 WeakPolarHBondContact OD1-CB 3Å; D394-S397 PolarHBondContact OD1-OG 3.1Å; D394-S397 WeakPolarHBondContact OD2-CB 3.48Å
395	T	73	Confident	73.9	Confident	40 Å²	40	73.5 Å²	73.5	25%	0.245	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	1.6	-155.6	-42.4	0	0	0	0	115.3	Y390 N393 Y411 H423	Y390-T395 PolarHBondContact O-OG1 2.84Å; N393-T395 WeakPolarHBondContact O-CA 3.26Å; N393-T395 PolarHBondContact O-N 3.48Å; N393-T395 PolarHBondContact O-OG1 3.35Å; T395-Y411 HydrophobicContact CG2-CD2 4.41Å; T395-Y411 HydrophobicContact CG2-CE1 4.15Å; T395-Y411 HydrophobicContact CG2-CE2 3.76Å; T395-H423 PolarHBondContact O-ND1 2.92Å
396	C	76.3	Confident	73	Confident	1 Å²	1	75.6 Å²	75.6	1%	0.007	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.8	-3.6	178.4	-54.9	0	0	0	0	113.2	D394 N399 G400 C402 C413	D394-C396 PolarHBondContact O-N 3.42Å; C396-N399 PolarHBondContact O-N 3.23Å; C396-G400 WeakPolarHBondContact CB-O 3.4Å; C396-G400 PolarHBondContact O-N 3.37Å; C396-C402 HydrophobicContact CB-CB 4.24Å; C396-C402 VanDerWaalsContact SG-CB 3.59Å; C396-C413 VanDerWaalsContact CA-SG 3.52Å; C396-C413 HydrophobicContact CB-CB 3.61Å; C396-C413 WeakPolarHBondContact CB-SG 3.45Å; C396-C413 WeakPolarHBondContact SG-CA 3.37Å; C396-C413 WeakPolarHBondContact SG-CB 3.35Å; C396-C413 CovalentContact SG-SG 2.03Å; C396-C413 PolarHBondContact SG-SG 3.39Å
397	S	72.8	Confident	71.9	Confident	60 Å²	60	76.3 Å²	76.3	42%	0.42	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	151.7	-175.7	-82.6	0	0	0	0	112.3	D394	D394-S397 VanDerWaalsContact CG-OG 3.29Å; D394-S397 PolarHBondContact O-N 2.78Å; D394-S397 WeakPolarHBondContact OD1-CB 3Å; D394-S397 PolarHBondContact OD1-OG 3.1Å; D394-S397 WeakPolarHBondContact OD2-CB 3.48Å
398	P	75.2	Confident	71.2	Confident	94 Å²	94	74 Å²	74	61%	0.61	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	cis	-86.5	-0.4	-2.3	34.2	-34.1	0	0	0	113.9	R416	P398-R416 PolarHBondContact O-NH1 3Å
399	N	76.9	Confident	70.8	Confident	36 Å²	36	76 Å²	76	19%	0.193	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-5.7	-160.7	-71.1	-17.1	0	0	0	115.2	C396 R416 Y419 C424	C396-N399 PolarHBondContact O-N 3.23Å; N399-R416 WeakPolarHBondContact O-CB 3.33Å; N399-R416 PolarHBondContact O-N 2.8Å; N399-Y419 HydrophobicContact CB-CD1 4.38Å; N399-Y419 HydrophobicContact CB-CD2 3.79Å; N399-Y419 HydrophobicContact CB-CE2 4.33Å; N399-Y419 HydrophobicContact CB-CG 3.84Å; N399-Y419 WeakPolarHBondContact ND2-CD1 3.45Å; N399-Y419 WeakPolarHBondContact OD1-CE2 3.32Å; N399-C424 HydrophobicContact CB-CB 3.5Å; N399-C424 VanDerWaalsContact CB-CB 3.5Å; N399-C424 VanDerWaalsContact CB-O 3.25Å; N399-C424 WeakPolarHBondContact CB-O 3.03Å; N399-C424 PolarHBondContact ND2-O 3.12Å
400	G	80.1	Confident	70.6	Confident	6 Å²	6	72.9 Å²	72.9	6%	0.062	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	168.3	178.3	0	0	0	0	0	114.8	C396 H414	C396-G400 WeakPolarHBondContact CB-O 3.4Å; C396-G400 PolarHBondContact O-N 3.37Å; G400-H414 CarbonylContact C-O 3.31Å; G400-H414 WeakPolarHBondContact CA-O 3.24Å
401	E	84.4	Confident	71	Confident	139 Å²	139	72.3 Å²	72.3	65%	0.65	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101	126.2	-178.9	-173.5	178.4	169.5	0	0	110.4	H414	E401-H414 HydrophobicContact CB-CB 4.32Å; E401-H414 PolarHBondContact N-O 2.66Å; E401-H414 PolarHBondContact O-N 2.87Å
402	C	83.9	Confident	71.1	Confident	40 Å²	40	77.3 Å²	77.3	27%	0.27	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	124.2	-176.1	-169.5	0	0	0	0	112.1	C391 C396	C391-C402 VanDerWaalsContact CA-SG 3.51Å; C391-C402 HydrophobicContact CB-CB 3.77Å; C391-C402 WeakPolarHBondContact CB-SG 3.47Å; C391-C402 WeakPolarHBondContact SG-CB 3.3Å; C391-C402 CovalentContact SG-SG 2.05Å; C391-C402 PolarHBondContact SG-SG 3.35Å; C396-C402 HydrophobicContact CB-CB 4.24Å; C396-C402 VanDerWaalsContact SG-CB 3.59Å
403	Q	80.3	Confident	71.8	Confident	98 Å²	98	72.2 Å²	72.2	46%	0.458	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	120.4	172.5	-174.2	-179	16.5	0	0	110.7	V405 Y411 R412 H414	Q403-V405 PolarHBondContact O-N 2.79Å; Q403-Y411 CarbonylContact O-C 3.56Å; Q403-Y411 VanDerWaalsContact O-CA 3.3Å; Q403-Y411 WeakPolarHBondContact O-CA 3.39Å; Q403-R412 PolarHBondContact N-O 3.46Å; Q403-R412 PolarHBondContact O-N 2.04Å; Q403-H414 PolarHBondContact OE1-NE2 2.95Å
404	N	72.4	Confident	72.9	Confident	79 Å²	79	69 Å²	69	42%	0.422	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	126.4	167.4	-74.1	-53.2	0	0	0	110.2	Y390	Y390-N404 PolarHBondContact N-OD1 2.94Å
405	V	71.6	Confident	73.7	Confident	31 Å²	31	65.9 Å²	65.9	19%	0.188	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	80.7	177.6	-174	0	0	0	0	108.6	Q403 A407 L408 M409 T410 R412	Q403-V405 PolarHBondContact O-N 2.79Å; V405-A407 PolarHBondContact O-N 2.97Å; V405-A407 VanDerWaalsContact O-N 3.11Å; V405-L408 HydrophobicContact CG1-CB 4.14Å; V405-L408 HydrophobicContact CG1-CD1 4.27Å; V405-L408 HydrophobicContact CG1-CG 4.39Å; V405-L408 PolarHBondContact O-N 3.34Å; V405-M409 PolarHBondContact O-N 3.2Å; V405-M409 VanDerWaalsContact O-N 3.07Å; V405-T410 HydrophobicContact CB-CG2 4.05Å; V405-T410 PolarHBondContact N-O 3.12Å; V405-R412 HydrophobicContact CG2-CB 3.72Å
406	T	64.9	Low	74	Confident	125 Å²	125	71.5 Å²	71.5	77%	0.767	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-54.8	-34.2	-171.8	-33.3	0	0	0	0	113.6	L408 M409	T406-L408 VanDerWaalsContact C-N 3.25Å; T406-L408 PolarHBondContact O-N 3Å; T406-M409 PolarHBondContact O-N 3.31Å
407	A	56	Low	73.5	Confident	98 Å²	98	75.7 Å²	75.7	81%	0.81	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-69.2	-17	179.6	0	0	0	0	0	114.7	V405	V405-A407 PolarHBondContact O-N 2.97Å; V405-A407 VanDerWaalsContact O-N 3.11Å
408	L	54.8	Low	73	Confident	89 Å²	89	75.8 Å²	75.8	47%	0.466	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-122.4	4.3	179.1	-69.3	174.7	0	0	0	112.7	V405 T406 T410	V405-L408 HydrophobicContact CG1-CB 4.14Å; V405-L408 HydrophobicContact CG1-CD1 4.27Å; V405-L408 HydrophobicContact CG1-CG 4.39Å; V405-L408 PolarHBondContact O-N 3.34Å; T406-L408 VanDerWaalsContact C-N 3.25Å; T406-L408 PolarHBondContact O-N 3Å; L408-T410 VanDerWaalsContact C-N 3.29Å; L408-T410 HydrophobicContact CB-CG2 3.73Å; L408-T410 PolarHBondContact O-N 3.19Å
409	M	60.1	Low	72.7	Confident	76 Å²	76	74.9 Å²	74.9	37%	0.374	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.2	51.3	-177.8	-52.2	-165.1	84.9	0	0	112.6	P377 F379 Y390 V405 T406	P377-M409 HydrophobicContact CB-CB 4.03Å; F379-M409 HydrophobicContact CE2-CE 4.06Å; Y390-M409 VanDerWaalsContact CE2-O 3.24Å; Y390-M409 WeakPolarHBondContact CE2-O 3.01Å; Y390-M409 PolarHBondContact OH-O 2.04Å; V405-M409 PolarHBondContact O-N 3.2Å; V405-M409 VanDerWaalsContact O-N 3.07Å; T406-M409 PolarHBondContact O-N 3.31Å
410	T	63.5	Low	72	Confident	55 Å²	55	75.2 Å²	75.2	34%	0.337	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	-175.5	-176.8	-169.1	0	0	0	0	110	V405 L408	V405-T410 HydrophobicContact CB-CG2 4.05Å; V405-T410 PolarHBondContact N-O 3.12Å; L408-T410 VanDerWaalsContact C-N 3.29Å; L408-T410 HydrophobicContact CB-CG2 3.73Å; L408-T410 PolarHBondContact O-N 3.19Å
411	Y	75.2	Confident	71.4	Confident	46 Å²	46	76.9 Å²	76.9	18%	0.18	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	169.1	172.3	63.6	-77.2	0	0	0	111.7	Y390 T395 Q403 H423	Y390-Y411 HydrophobicContact CD1-CD1 4.01Å; Y390-Y411 HydrophobicContact CG-CD1 4.22Å; T395-Y411 HydrophobicContact CG2-CD2 4.41Å; T395-Y411 HydrophobicContact CG2-CE1 4.15Å; T395-Y411 HydrophobicContact CG2-CE2 3.76Å; Q403-Y411 CarbonylContact O-C 3.56Å; Q403-Y411 VanDerWaalsContact O-CA 3.3Å; Q403-Y411 WeakPolarHBondContact O-CA 3.39Å; Y411-H423 AromaticContact CZ-CE1 3.98Å; Y411-H423 PolarHBondContact OH-CE1 2.64Å; Y411-H423 PolarHBondContact OH-NE2 3.26Å
412	R	78.2	Confident	71	Confident	144 Å²	144	78.4 Å²	78.4	54%	0.543	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	130.9	171.2	171.2	179.9	-70.6	-178.1	-2.6	108.8	Q403 V405	Q403-R412 PolarHBondContact N-O 3.46Å; Q403-R412 PolarHBondContact O-N 2.04Å; V405-R412 HydrophobicContact CG2-CB 3.72Å
413	C	84	Confident	70.8	Confident	17 Å²	17	80.3 Å²	80.3	12%	0.115	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	125	170.5	-57.9	0	0	0	0	110.9	C396 C415 R422	C396-C413 VanDerWaalsContact CA-SG 3.52Å; C396-C413 HydrophobicContact CB-CB 3.61Å; C396-C413 WeakPolarHBondContact CB-SG 3.45Å; C396-C413 WeakPolarHBondContact SG-CA 3.37Å; C396-C413 WeakPolarHBondContact SG-CB 3.35Å; C396-C413 CovalentContact SG-SG 2.03Å; C396-C413 PolarHBondContact SG-SG 3.39Å; C413-C415 PolarHBondContact O-N 3.22Å; C413-R422 WeakPolarHBondContact CB-O 3.46Å; C413-R422 PolarHBondContact SG-O 3.16Å
414	H	83.4	Confident	70.9	Confident	69 Å²	69	75.6 Å²	75.6	32%	0.319	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	94.6	169	-67.2	-80.7	0	0	0	109.3	G400 E401 Q403 R416	G400-H414 CarbonylContact C-O 3.31Å; G400-H414 WeakPolarHBondContact CA-O 3.24Å; E401-H414 HydrophobicContact CB-CB 4.32Å; E401-H414 PolarHBondContact N-O 2.66Å; E401-H414 PolarHBondContact O-N 2.87Å; Q403-H414 PolarHBondContact OE1-NE2 2.95Å; H414-R416 PolarHBondContact O-N 3.14Å
415	C	80.9	Confident	71	Confident	40 Å²	40	76.3 Å²	76.3	27%	0.27	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	132.3	-175.3	-55	0	0	0	0	112.9	C413 Y419 C424	C413-C415 PolarHBondContact O-N 3.22Å; C415-Y419 VanDerWaalsContact CB-O 3.27Å; C415-Y419 WeakPolarHBondContact CB-O 3.41Å; C415-C424 WeakPolarHBondContact CA-SG 3.36Å; C415-C424 HydrophobicContact CB-CB 3.69Å; C415-C424 WeakPolarHBondContact CB-SG 3.29Å; C415-C424 WeakPolarHBondContact SG-CA 3.35Å; C415-C424 WeakPolarHBondContact SG-CB 3.09Å; C415-C424 CovalentContact SG-SG 2.03Å; C415-C424 PolarHBondContact SG-SG 2.85Å
416	R	80	Confident	70.8	Confident	158 Å²	158	80.4 Å²	80.4	60%	0.596	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-70.1	128.8	170.2	-63.8	171.2	174.2	160.5	-4.3	108.1	P398 N399 H414 Y419	P398-R416 PolarHBondContact O-NH1 3Å; N399-R416 WeakPolarHBondContact O-CB 3.33Å; N399-R416 PolarHBondContact O-N 2.8Å; H414-R416 PolarHBondContact O-N 3.14Å; R416-Y419 WeakPolarHBondContact O-CB 3.07Å; R416-Y419 VanDerWaalsContact O-CD2 3.25Å; R416-Y419 WeakPolarHBondContact O-CD2 3.5Å; R416-Y419 PolarHBondContact O-N 3.28Å
417	T	64.7	Low	70.7	Confident	89 Å²	89	77.9 Å²	77.9	55%	0.546	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	130.8	174.8	54.6	0	0	0	0	110.1	S446	T417-S446 WeakPolarHBondContact CB-O 3.16Å; T417-S446 WeakPolarHBondContact CG2-O 3.41Å; T417-S446 WeakPolarHBondContact OG1-CB 3.23Å
418	P	62.5	Low	70.7	Confident	62 Å²	62	76 Å²	76	40%	0.403	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	cis	-99.5	15	19.6	39.9	-37.6	0	0	0	115.6	H428	P418-H428 PolarHBondContact O-N 3.34Å
419	Y	69.7	Low	70.9	Confident	76 Å²	76	78.6 Å²	78.6	30%	0.298	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	152.4	-175.6	-55	-74.2	0	0	0	113.6	N399 C415 R416 H426 A427	N399-Y419 HydrophobicContact CB-CD1 4.38Å; N399-Y419 HydrophobicContact CB-CD2 3.79Å; N399-Y419 HydrophobicContact CB-CE2 4.33Å; N399-Y419 HydrophobicContact CB-CG 3.84Å; N399-Y419 WeakPolarHBondContact ND2-CD1 3.45Å; N399-Y419 WeakPolarHBondContact OD1-CE2 3.32Å; C415-Y419 VanDerWaalsContact CB-O 3.27Å; C415-Y419 WeakPolarHBondContact CB-O 3.41Å; R416-Y419 WeakPolarHBondContact O-CB 3.07Å; R416-Y419 VanDerWaalsContact O-CD2 3.25Å; R416-Y419 WeakPolarHBondContact O-CD2 3.5Å; R416-Y419 PolarHBondContact O-N 3.28Å; Y419-H426 CarbonylContact C-O 3.56Å; Y419-H426 VanDerWaalsContact CA-O 3.24Å; Y419-H426 WeakPolarHBondContact CA-O 3.34Å; Y419-A427 HydrophobicContact CD1-CB 4.37Å; Y419-A427 HydrophobicContact CE1-CB 4.42Å
420	A	61.9	Low	71	Confident	43 Å²	43	79.5 Å²	79.5	36%	0.355	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	174.1	-179.9	0	0	0	0	0	110	C424 E425 H426	A420-C424 CarbonylContact O-C 3.57Å; A420-C424 WeakPolarHBondContact O-CA 3.18Å; A420-E425 PolarHBondContact O-N 3.31Å; A420-E425 VanDerWaalsContact O-N 3.15Å; A420-H426 PolarHBondContact N-O 2.95Å; A420-H426 PolarHBondContact O-N 3.34Å
421	G	67.4	Low	71.3	Confident	41 Å²	41	78.1 Å²	78.1	42%	0.423	39%	0.387	S	S	.	.	S	Bend	trans	112.2	-172.9	-173.8	0	0	0	0	0	111.9	E425	G421-E425 VanDerWaalsContact C-OE2 3.23Å; G421-E425 VanDerWaalsContact CA-CD 3.49Å; G421-E425 WeakPolarHBondContact CA-OE1 3.42Å; G421-E425 VanDerWaalsContact CA-OE2 3.25Å; G421-E425 WeakPolarHBondContact CA-OE2 3.5Å
422	R	74.7	Confident	70.8	Confident	171 Å²	171	84.3 Å²	84.3	65%	0.645	42%	0.415	S	S	*	.	S	Bend	trans	-78.7	-34.1	178.8	176.6	-179.7	-78.2	-172.6	-1.3	112.1	C413 E425	C413-R422 WeakPolarHBondContact CB-O 3.46Å; C413-R422 PolarHBondContact SG-O 3.16Å; R422-E425 VanDerWaalsContact N-CD 3.34Å; R422-E425 PolarHBondContact N-OE1 3.43Å; R422-E425 PolarHBondContact N-OE2 3.3Å
423	H	80.5	Confident	69.8	Low	79 Å²	79	82.2 Å²	82.2	37%	0.366	43%	0.429	S	S	.	.	S	Bend	trans	-114.2	5.6	-177.7	-61.1	-93.9	0	0	0	112.7	T395 Y411 E425	T395-H423 PolarHBondContact O-ND1 2.92Å; Y411-H423 AromaticContact CZ-CE1 3.98Å; Y411-H423 PolarHBondContact OH-CE1 2.64Å; Y411-H423 PolarHBondContact OH-NE2 3.26Å; H423-E425 VanDerWaalsContact C-OE2 3.26Å; H423-E425 VanDerWaalsContact CA-OE2 3.31Å; H423-E425 WeakPolarHBondContact CA-OE2 3.45Å; H423-E425 PolarHBondContact N-OE2 2.84Å
424	C	81.9	Confident	68.9	Low	0 Å²	0	87.7 Å²	87.7	0%	0	46%	0.457	C	S	.	.	S	Bend	trans	71.2	39.3	-175.5	-45.9	0	0	0	0	113.9	N399 C415 A420	N399-C424 HydrophobicContact CB-CB 3.5Å; N399-C424 VanDerWaalsContact CB-CB 3.5Å; N399-C424 VanDerWaalsContact CB-O 3.25Å; N399-C424 WeakPolarHBondContact CB-O 3.03Å; N399-C424 PolarHBondContact ND2-O 3.12Å; C415-C424 WeakPolarHBondContact CA-SG 3.36Å; C415-C424 HydrophobicContact CB-CB 3.69Å; C415-C424 WeakPolarHBondContact CB-SG 3.29Å; C415-C424 WeakPolarHBondContact SG-CA 3.35Å; C415-C424 WeakPolarHBondContact SG-CB 3.09Å; C415-C424 CovalentContact SG-SG 2.03Å; C415-C424 PolarHBondContact SG-SG 2.85Å; A420-C424 CarbonylContact O-C 3.57Å; A420-C424 WeakPolarHBondContact O-CA 3.18Å
425	E	75.6	Confident	68.6	Low	93 Å²	93	85.7 Å²	85.7	44%	0.435	45%	0.451	S	S	.	.			trans	-85.7	-12.5	-172.7	66.2	-85.8	-155.9	0	0	115.5	A420 G421 R422 H423	A420-E425 PolarHBondContact O-N 3.31Å; A420-E425 VanDerWaalsContact O-N 3.15Å; G421-E425 VanDerWaalsContact C-OE2 3.23Å; G421-E425 VanDerWaalsContact CA-CD 3.49Å; G421-E425 WeakPolarHBondContact CA-OE1 3.42Å; G421-E425 VanDerWaalsContact CA-OE2 3.25Å; G421-E425 WeakPolarHBondContact CA-OE2 3.5Å; R422-E425 VanDerWaalsContact N-CD 3.34Å; R422-E425 PolarHBondContact N-OE1 3.43Å; R422-E425 PolarHBondContact N-OE2 3.3Å; H423-E425 VanDerWaalsContact C-OE2 3.26Å; H423-E425 VanDerWaalsContact CA-OE2 3.31Å; H423-E425 WeakPolarHBondContact CA-OE2 3.45Å; H423-E425 PolarHBondContact N-OE2 2.84Å
426	H	67.1	Low	68.8	Low	117 Å²	117	84 Å²	84	54%	0.542	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	132.8	-174.9	-56.1	-41.1	0	0	0	112.8	Y419 A420	Y419-H426 CarbonylContact C-O 3.56Å; Y419-H426 VanDerWaalsContact CA-O 3.24Å; Y419-H426 WeakPolarHBondContact CA-O 3.34Å; A420-H426 PolarHBondContact N-O 2.95Å; A420-H426 PolarHBondContact O-N 3.34Å
427	A	62.8	Low	68.8	Low	73 Å²	73	79.6 Å²	79.6	60%	0.603	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	130.5	171	0	0	0	0	0	111.7	Y419	Y419-A427 HydrophobicContact CD1-CB 4.37Å; Y419-A427 HydrophobicContact CE1-CB 4.42Å
428	H	56	Low	69.5	Low	58 Å²	58	77.8 Å²	77.8	27%	0.269	43%	0.432	S	S	.	.			trans	-89.5	114.6	-179.4	-174.9	-51.9	0	0	0	112.8	P418 Y430 R521	P418-H428 PolarHBondContact O-N 3.34Å; H428-Y430 HydrophobicContact CB-CE2 4.16Å; H428-Y430 AromaticContact CE1-CD1 3.47Å; H428-Y430 VanDerWaalsContact CE1-CD1 3.47Å; H428-Y430 WeakPolarHBondContact CE1-CD1 3.44Å; H428-Y430 AromaticContact CE1-CE1 3.18Å; H428-Y430 WeakPolarHBondContact CE1-CE1 3.02Å; H428-Y430 AromaticContact CE1-CE2 3.8Å; H428-Y430 AromaticContact CE1-CG 3.89Å; H428-Y430 AromaticContact CE1-CZ 3.36Å; H428-Y430 AromaticContact CG-CE2 3.81Å; H428-Y430 AromaticContact CG-CZ 3.72Å; H428-Y430 AromaticContact ND1-CD1 3.8Å; H428-Y430 AromaticContact ND1-CD2 3.49Å; H428-Y430 WeakPolarHBondContact ND1-CD2 3.26Å; H428-Y430 AromaticContact ND1-CE1 3.51Å; H428-Y430 AromaticContact ND1-CE2 3.18Å; H428-Y430 WeakPolarHBondContact ND1-CE2 3.28Å; H428-Y430 AromaticContact ND1-CG 3.79Å; H428-Y430 AromaticContact ND1-CZ 3.19Å; H428-Y430 AromaticContact NE2-CE1 3.87Å; H428-Y430 AromaticContact NE2-CZ 3.97Å; H428-Y430 WeakPolarHBondContact O-CD2 3.26Å; H428-Y430 WeakPolarHBondContact O-CE2 3.27Å; H428-R521 PolarHBondContact CE1-NH2 2.71Å; H428-R521 PolarHBondContact NE2-NH2 3.47Å
429	E	58	Low	70.4	Confident	144 Å²	144	78.4 Å²	78.4	67%	0.673	43%	0.429	S	S	*	.			trans	-86.2	137.3	175.2	-168.7	170.8	-133.4	0	0	113.1
430	Y	63.9	Low	70.9	Confident	94 Å²	94	75.3 Å²	75.3	37%	0.369	42%	0.421	S	S	.	.			trans	-120.7	-10.6	179.2	-59	-97.2	0	0	0	114.2	H428 N444	H428-Y430 HydrophobicContact CB-CE2 4.16Å; H428-Y430 AromaticContact CE1-CD1 3.47Å; H428-Y430 VanDerWaalsContact CE1-CD1 3.47Å; H428-Y430 WeakPolarHBondContact CE1-CD1 3.44Å; H428-Y430 AromaticContact CE1-CE1 3.18Å; H428-Y430 WeakPolarHBondContact CE1-CE1 3.02Å; H428-Y430 AromaticContact CE1-CE2 3.8Å; H428-Y430 AromaticContact CE1-CG 3.89Å; H428-Y430 AromaticContact CE1-CZ 3.36Å; H428-Y430 AromaticContact CG-CE2 3.81Å; H428-Y430 AromaticContact CG-CZ 3.72Å; H428-Y430 AromaticContact ND1-CD1 3.8Å; H428-Y430 AromaticContact ND1-CD2 3.49Å; H428-Y430 WeakPolarHBondContact ND1-CD2 3.26Å; H428-Y430 AromaticContact ND1-CE1 3.51Å; H428-Y430 AromaticContact ND1-CE2 3.18Å; H428-Y430 WeakPolarHBondContact ND1-CE2 3.28Å; H428-Y430 AromaticContact ND1-CG 3.79Å; H428-Y430 AromaticContact ND1-CZ 3.19Å; H428-Y430 AromaticContact NE2-CE1 3.87Å; H428-Y430 AromaticContact NE2-CZ 3.97Å; H428-Y430 WeakPolarHBondContact O-CD2 3.26Å; H428-Y430 WeakPolarHBondContact O-CE2 3.27Å; Y430-N444 WeakPolarHBondContact CA-OD1 3.26Å; Y430-N444 WeakPolarHBondContact CB-OD1 2.99Å; Y430-N444 HydrophobicContact CD2-CB 4.27Å; Y430-N444 PolarHBondContact N-OD1 3.09Å
431	C	68.2	Low	71.8	Confident	27 Å²	27	75.2 Å²	75.2	18%	0.182	42%	0.419	C	S	.	.			trans	-84.9	132.5	179.3	-71	0	0	0	0	111.5	C442 N444	C431-C442 VanDerWaalsContact CA-SG 3.57Å; C431-C442 HydrophobicContact CB-CB 3.69Å; C431-C442 WeakPolarHBondContact CB-SG 3.48Å; C431-C442 WeakPolarHBondContact SG-CB 3.44Å; C431-C442 CovalentContact SG-SG 2.04Å; C431-C442 PolarHBondContact SG-SG 3.16Å; C431-N444 PolarHBondContact N-OD1 3.29Å; C431-N444 VanDerWaalsContact N-OD1 3.13Å; C431-N444 PolarHBondContact SG-OD1 2.89Å
432	K	66.2	Low	72.5	Confident	175 Å²	175	74.8 Å²	74.8	76%	0.761	41%	0.41	S	S	*	.			trans	-120.7	164.7	168.6	-67.5	-170.1	175.7	-171.1	0	109.7	D434 S435	K432-D434 PolarHBondContact O-N 2.7Å; K432-S435 PolarHBondContact N-OG 3.02Å; K432-S435 WeakPolarHBondContact O-CB 3.46Å; K432-S435 PolarHBondContact O-N 3.02Å; K432-S435 PolarHBondContact O-OG 2.78Å; K432-S435 VanDerWaalsContact O-OG 3.1Å
433	A	55.7	Low	72.5	Confident	101 Å²	101	69.3 Å²	69.3	84%	0.835	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	-39	-169.9	0	0	0	0	0	115
434	D	66.3	Low	71.7	Confident	131 Å²	131	68.6 Å²	68.6	70%	0.701	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	6.1	-177.8	-63.7	-65.8	0	0	0	115.3	K432 C436 S437	K432-D434 PolarHBondContact O-N 2.7Å; D434-C436 PolarHBondContact O-N 3.39Å; D434-S437 PolarHBondContact O-N 2.92Å
435	S	77.5	Confident	70.8	Confident	28 Å²	28	71.7 Å²	71.7	20%	0.196	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-16.2	-171.8	-70.5	0	0	0	0	115.6	K432 C452	K432-S435 PolarHBondContact N-OG 3.02Å; K432-S435 WeakPolarHBondContact O-CB 3.46Å; K432-S435 PolarHBondContact O-N 3.02Å; K432-S435 PolarHBondContact O-OG 2.78Å; K432-S435 VanDerWaalsContact O-OG 3.1Å; S435-C452 PolarHBondContact O-SG 2.83Å
436	C	84.2	Confident	69.7	Low	4 Å²	4	71.1 Å²	71.1	3%	0.027	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.8	30.5	175.8	-58.5	0	0	0	0	112.6	D434 G438 H439 G440 C442 C452 F462	D434-C436 PolarHBondContact O-N 3.39Å; C436-G438 PolarHBondContact O-N 2.04Å; C436-H439 PolarHBondContact O-N 2.95Å; C436-G440 VanDerWaalsContact CB-O 3.32Å; C436-G440 WeakPolarHBondContact CB-O 3.44Å; C436-C442 VanDerWaalsContact SG-CA 3.56Å; C436-C442 VanDerWaalsContact SG-CB 3.6Å; C436-C452 WeakPolarHBondContact CA-SG 3.37Å; C436-C452 HydrophobicContact CB-CB 3.76Å; C436-C452 WeakPolarHBondContact CB-SG 3.28Å; C436-C452 VanDerWaalsContact SG-CA 3.54Å; C436-C452 WeakPolarHBondContact SG-CB 3.31Å; C436-C452 CovalentContact SG-SG 2.03Å; C436-C452 PolarHBondContact SG-SG 2.88Å; C436-F462 CarbonylContact C-O 3.5Å
437	S	80.7	Confident	69	Low	65 Å²	65	70 Å²	70	46%	0.455	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	31.3	176.9	-57.1	0	0	0	0	114.5	D434 H439 F462	D434-S437 PolarHBondContact O-N 2.92Å; S437-H439 PolarHBondContact O-CE1 3Å; S437-H439 PolarHBondContact O-N 3.05Å; S437-H439 PolarHBondContact O-ND1 3.23Å; S437-F462 WeakPolarHBondContact CB-O 3.44Å; S437-F462 PolarHBondContact OG-O 3.14Å
438	G	78.8	Confident	68.7	Low	52 Å²	52	68.3 Å²	68.3	54%	0.536	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	-6.6	-175.2	0	0	0	0	0	116.1	C436	C436-G438 PolarHBondContact O-N 2.04Å
439	H	81.2	Confident	69	Low	75 Å²	75	72 Å²	72	35%	0.347	42%	0.421	S	S	.	.	S	Bend	trans	-111.5	17.8	-167.8	-61.7	108.5	0	0	0	114.5	C436 S437 C454 Y455 F458 C463	C436-H439 PolarHBondContact O-N 2.95Å; S437-H439 PolarHBondContact O-CE1 3Å; S437-H439 PolarHBondContact O-N 3.05Å; S437-H439 PolarHBondContact O-ND1 3.23Å; H439-C454 WeakPolarHBondContact O-CA 3.06Å; H439-Y455 WeakPolarHBondContact O-CD2 3.38Å; H439-Y455 PolarHBondContact O-N 2.92Å; H439-F458 HydrophobicContact CB-CB 4.29Å; H439-F458 HydrophobicContact CB-CD1 3.68Å; H439-F458 HydrophobicContact CB-CD2 4.25Å; H439-F458 HydrophobicContact CB-CE1 3.99Å; H439-F458 HydrophobicContact CB-CG 3.82Å; H439-F458 HydrophobicContact CB-CZ 4.41Å; H439-F458 AromaticContact CD2-CD1 3.92Å; H439-F458 AromaticContact CD2-CE1 3.28Å; H439-F458 WeakPolarHBondContact CD2-CE1 3.36Å; H439-F458 AromaticContact CD2-CE2 3.72Å; H439-F458 AromaticContact CD2-CZ 3.17Å; H439-F458 WeakPolarHBondContact CD2-CZ 3.5Å; H439-F458 AromaticContact CG-CD1 3.7Å; H439-F458 AromaticContact CG-CE1 3.48Å; H439-F458 VanDerWaalsContact CG-CE1 3.48Å; H439-F458 AromaticContact CG-CZ 3.84Å; H439-F458 AromaticContact ND1-CE1 3.97Å; H439-F458 AromaticContact NE2-CE1 3.7Å; H439-F458 AromaticContact NE2-CZ 3.64Å; H439-C463 HydrophobicContact CB-CB 3.89Å; H439-C463 WeakPolarHBondContact O-CB 3.49Å
440	G	81.6	Confident	69.8	Low	11 Å²	11	67.5 Å²	67.5	11%	0.113	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.3	166	173.8	0	0	0	0	0	113.9	C436 I453	C436-G440 VanDerWaalsContact CB-O 3.32Å; C436-G440 WeakPolarHBondContact CB-O 3.44Å; G440-I453 CarbonylContact C-O 3.57Å; G440-I453 WeakPolarHBondContact CA-O 3.04Å
441	A	80.7	Confident	70.6	Confident	40 Å²	40	68 Å²	68	33%	0.331	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	132.7	172.9	0	0	0	0	0	110.6	C452 I453	A441-C452 CarbonylContact O-C 3.38Å; A441-C452 WeakPolarHBondContact O-CA 3.35Å; A441-I453 PolarHBondContact N-O 2.97Å; A441-I453 PolarHBondContact O-N 3.37Å
442	C	81.7	Confident	71.3	Confident	33 Å²	33	67.7 Å²	67.7	22%	0.223	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	136.7	175.5	-177.5	0	0	0	0	110.9	C431 C436	C431-C442 VanDerWaalsContact CA-SG 3.57Å; C431-C442 HydrophobicContact CB-CB 3.69Å; C431-C442 WeakPolarHBondContact CB-SG 3.48Å; C431-C442 WeakPolarHBondContact SG-CB 3.44Å; C431-C442 CovalentContact SG-SG 2.04Å; C431-C442 PolarHBondContact SG-SG 3.16Å; C436-C442 VanDerWaalsContact SG-CA 3.56Å; C436-C442 VanDerWaalsContact SG-CB 3.6Å
443	L	73.4	Confident	72.1	Confident	56 Å²	56	62.2 Å²	62.2	29%	0.293	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	135.5	170.6	-65.6	178.6	0	0	0	110.9	I450 K451 I453	L443-I450 WeakPolarHBondContact O-CA 3.44Å; L443-K451 HydrophobicContact CB-CB 4.48Å; L443-K451 PolarHBondContact N-O 3.16Å; L443-K451 PolarHBondContact O-N 2.8Å; L443-I453 HydrophobicContact CD1-CD1 3.55Å; L443-I453 HydrophobicContact CD1-CG1 4.09Å; L443-I453 HydrophobicContact CG-CD1 4.37Å
444	N	64.9	Low	73.5	Confident	63 Å²	63	59.1 Å²	59.1	34%	0.337	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	124.8	166.2	-57.6	-38.5	0	0	0	108.8	Y430 C431	Y430-N444 WeakPolarHBondContact CA-OD1 3.26Å; Y430-N444 WeakPolarHBondContact CB-OD1 2.99Å; Y430-N444 HydrophobicContact CD2-CB 4.27Å; Y430-N444 PolarHBondContact N-OD1 3.09Å; C431-N444 PolarHBondContact N-OD1 3.29Å; C431-N444 VanDerWaalsContact N-OD1 3.13Å; C431-N444 PolarHBondContact SG-OD1 2.89Å
445	L	62.4	Low	74.3	Confident	65 Å²	65	59.2 Å²	59.2	34%	0.34	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	146	168.5	-61.4	176.2	0	0	0	110.2	T447 G448 K449 K451	L445-T447 PolarHBondContact O-N 2.95Å; L445-G448 PolarHBondContact O-N 2.88Å; L445-K449 HydrophobicContact CB-CB 4.46Å; L445-K449 VanDerWaalsContact CB-O 3.23Å; L445-K449 WeakPolarHBondContact CB-O 3.4Å; L445-K449 HydrophobicContact CD1-CB 4.18Å; L445-K449 PolarHBondContact N-O 3.14Å; L445-K451 HydrophobicContact CD1-CB 3.98Å; L445-K451 HydrophobicContact CD2-CB 4.07Å; L445-K451 HydrophobicContact CD2-CD 4.01Å; L445-K451 HydrophobicContact CG-CB 3.93Å
446	S	51.7	Low	74.3	Confident	81 Å²	81	65.3 Å²	65.3	57%	0.566	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-18.2	171.5	49.5	0	0	0	0	114.8	T417 G448	T417-S446 WeakPolarHBondContact CB-O 3.16Å; T417-S446 WeakPolarHBondContact CG2-O 3.41Å; T417-S446 WeakPolarHBondContact OG1-CB 3.23Å; S446-G448 VanDerWaalsContact C-N 3.29Å; S446-G448 PolarHBondContact O-N 3.46Å
447	T	54.1	Low	73.8	Confident	93 Å²	93	65.6 Å²	65.6	57%	0.571	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	11.7	175.9	58.1	0	0	0	0	114.5	L445 K449	L445-T447 PolarHBondContact O-N 2.95Å; T447-K449 VanDerWaalsContact C-N 3.3Å; T447-K449 PolarHBondContact O-N 2.81Å
448	G	56.5	Low	73.9	Confident	38 Å²	38	64.8 Å²	64.8	39%	0.392	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	28.1	-176.7	0	0	0	0	0	113.4	L445 S446	L445-G448 PolarHBondContact O-N 2.88Å; S446-G448 VanDerWaalsContact C-N 3.29Å; S446-G448 PolarHBondContact O-N 3.46Å
449	K	61.6	Low	73.9	Confident	137 Å²	137	64.9 Å²	64.9	60%	0.596	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	146.8	-176.8	-66.5	178.8	-176.1	177.5	0	110.4	L445 T447	L445-K449 HydrophobicContact CB-CB 4.46Å; L445-K449 VanDerWaalsContact CB-O 3.23Å; L445-K449 WeakPolarHBondContact CB-O 3.4Å; L445-K449 HydrophobicContact CD1-CB 4.18Å; L445-K449 PolarHBondContact N-O 3.14Å; T447-K449 VanDerWaalsContact C-N 3.3Å; T447-K449 PolarHBondContact O-N 2.81Å
450	I	74.3	Confident	73.8	Confident	48 Å²	48	63 Å²	63	25%	0.246	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	145.1	169.9	58.7	170.3	0	0	0	111.5	L443 F462	L443-I450 WeakPolarHBondContact O-CA 3.44Å; I450-F462 HydrophobicContact CD1-CD1 4.3Å; I450-F462 HydrophobicContact CD1-CE1 3.95Å; I450-F462 HydrophobicContact CG1-CE1 4.36Å
451	K	80.5	Confident	73.7	Confident	106 Å²	106	69.1 Å²	69.1	46%	0.461	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	120.4	173.1	174.3	-177.5	175.7	-174.8	0	109.1	L443 L445	L443-K451 HydrophobicContact CB-CB 4.48Å; L443-K451 PolarHBondContact N-O 3.16Å; L443-K451 PolarHBondContact O-N 2.8Å; L445-K451 HydrophobicContact CD1-CB 3.98Å; L445-K451 HydrophobicContact CD2-CB 4.07Å; L445-K451 HydrophobicContact CD2-CD 4.01Å; L445-K451 HydrophobicContact CG-CB 3.93Å
452	C	83.4	Confident	73.9	Confident	19 Å²	19	71.7 Å²	71.7	13%	0.128	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	135.2	174.1	-62.9	0	0	0	0	111.8	S435 C436 A441 Q461 C463	S435-C452 PolarHBondContact O-SG 2.83Å; C436-C452 WeakPolarHBondContact CA-SG 3.37Å; C436-C452 HydrophobicContact CB-CB 3.76Å; C436-C452 WeakPolarHBondContact CB-SG 3.28Å; C436-C452 VanDerWaalsContact SG-CA 3.54Å; C436-C452 WeakPolarHBondContact SG-CB 3.31Å; C436-C452 CovalentContact SG-SG 2.03Å; C436-C452 PolarHBondContact SG-SG 2.88Å; A441-C452 CarbonylContact O-C 3.38Å; A441-C452 WeakPolarHBondContact O-CA 3.35Å; C452-Q461 WeakPolarHBondContact CB-O 3.29Å; C452-Q461 PolarHBondContact SG-O 3.3Å; C452-C463 VanDerWaalsContact CB-SG 3.54Å
453	I	81.9	Confident	74.1	Confident	61 Å²	61	70.1 Å²	70.1	31%	0.313	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	105.6	165.1	-62.1	-177.8	0	0	0	107.2	G440 A441 L443	G440-I453 CarbonylContact C-O 3.57Å; G440-I453 WeakPolarHBondContact CA-O 3.04Å; A441-I453 PolarHBondContact N-O 2.97Å; A441-I453 PolarHBondContact O-N 3.37Å; L443-I453 HydrophobicContact CD1-CD1 3.55Å; L443-I453 HydrophobicContact CD1-CG1 4.09Å; L443-I453 HydrophobicContact CG-CD1 4.37Å
454	C	85	Confident	74.5	Confident	35 Å²	35	70 Å²	70	24%	0.236	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	147.6	-174.8	-51.5	0	0	0	0	112.8	H439 F458 C463	H439-C454 WeakPolarHBondContact O-CA 3.06Å; C454-F458 HydrophobicContact CB-CB 3.94Å; C454-F458 WeakPolarHBondContact CB-O 3.37Å; C454-C463 WeakPolarHBondContact CA-SG 3.29Å; C454-C463 HydrophobicContact CB-CB 3.75Å; C454-C463 WeakPolarHBondContact CB-SG 3.36Å; C454-C463 WeakPolarHBondContact SG-CA 3.43Å; C454-C463 WeakPolarHBondContact SG-CB 3.45Å; C454-C463 CovalentContact SG-SG 2.04Å; C454-C463 PolarHBondContact SG-SG 2.83Å
455	Y	84.2	Confident	75.1	Confident	134 Å²	134	73.5 Å²	73.5	53%	0.525	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-67.5	162.2	172.8	-58.8	-45.5	0	0	0	111.5	H439 G457 F458	H439-Y455 WeakPolarHBondContact O-CD2 3.38Å; H439-Y455 PolarHBondContact O-N 2.92Å; Y455-G457 PolarHBondContact O-N 2.81Å; Y455-G457 VanDerWaalsContact O-N 3.1Å; Y455-F458 PolarHBondContact O-N 2.03Å
456	I	77	Confident	75.7	Confident	155 Å²	155	73.6 Å²	73.6	80%	0.795	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	119.5	-179.3	-59.5	175.3	0	0	0	109.1
457	G	74.1	Confident	76.2	Confident	11 Å²	11	72.3 Å²	72.3	11%	0.113	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.3	10	-175.8	0	0	0	0	0	115.6	Y455 N466 L467	Y455-G457 PolarHBondContact O-N 2.81Å; Y455-G457 VanDerWaalsContact O-N 3.1Å; G457-N466 CarbonylContact O-C 3.57Å; G457-N466 WeakPolarHBondContact O-CA 3.29Å; G457-L467 PolarHBondContact O-N 2.78Å
458	F	83.3	Confident	76.5	Confident	48 Å²	48	75.4 Å²	75.4	21%	0.211	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	148.1	173.2	-69	-92.7	0	0	0	112.6	H439 C454 Y455 C463 F465 N466	H439-F458 HydrophobicContact CB-CB 4.29Å; H439-F458 HydrophobicContact CB-CD1 3.68Å; H439-F458 HydrophobicContact CB-CD2 4.25Å; H439-F458 HydrophobicContact CB-CE1 3.99Å; H439-F458 HydrophobicContact CB-CG 3.82Å; H439-F458 HydrophobicContact CB-CZ 4.41Å; H439-F458 AromaticContact CD2-CD1 3.92Å; H439-F458 AromaticContact CD2-CE1 3.28Å; H439-F458 WeakPolarHBondContact CD2-CE1 3.36Å; H439-F458 AromaticContact CD2-CE2 3.72Å; H439-F458 AromaticContact CD2-CZ 3.17Å; H439-F458 WeakPolarHBondContact CD2-CZ 3.5Å; H439-F458 AromaticContact CG-CD1 3.7Å; H439-F458 AromaticContact CG-CE1 3.48Å; H439-F458 VanDerWaalsContact CG-CE1 3.48Å; H439-F458 AromaticContact CG-CZ 3.84Å; H439-F458 AromaticContact ND1-CE1 3.97Å; H439-F458 AromaticContact NE2-CE1 3.7Å; H439-F458 AromaticContact NE2-CZ 3.64Å; C454-F458 HydrophobicContact CB-CB 3.94Å; C454-F458 WeakPolarHBondContact CB-O 3.37Å; Y455-F458 PolarHBondContact O-N 2.03Å; F458-C463 HydrophobicContact CB-CB 4.42Å; F458-C463 WeakPolarHBondContact CD1-O 3.42Å; F458-F465 CarbonylContact C-O 3.52Å; F458-F465 VanDerWaalsContact CA-O 3.27Å; F458-F465 WeakPolarHBondContact CA-O 3.46Å; F458-N466 HydrophobicContact CD1-CB 4.43Å; F458-N466 HydrophobicContact CE1-CB 4.18Å
459	V	79.2	Confident	76.6	Confident	53 Å²	53	77.3 Å²	77.3	32%	0.321	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	172.3	179.2	-62.3	0	0	0	0	112.6	C463 G464 F465 L467	V459-C463 CarbonylContact O-C 3.55Å; V459-C463 WeakPolarHBondContact O-CA 3.33Å; V459-G464 PolarHBondContact O-N 2.89Å; V459-F465 HydrophobicContact CG2-CB 3.84Å; V459-F465 PolarHBondContact N-O 3.08Å; V459-F465 PolarHBondContact O-N 3.26Å; V459-F465 VanDerWaalsContact O-N 3.12Å; V459-L467 HydrophobicContact CG1-CB 4.39Å; V459-L467 HydrophobicContact CG1-CD1 3.86Å; V459-L467 HydrophobicContact CG1-CD2 3.98Å; V459-L467 HydrophobicContact CG1-CG 4.3Å; V459-L467 HydrophobicContact CG2-CD1 3.99Å
460	G	77.5	Confident	76	Confident	35 Å²	35	75.3 Å²	75.3	36%	0.361	40%	0.397	S	S	.	.	S	Bend	trans	99.6	161.4	-177.1	0	0	0	0	0	112.8	F462 C463	G460-F462 PolarHBondContact O-N 3.21Å; G460-F462 VanDerWaalsContact O-N 3.09Å; G460-C463 PolarHBondContact O-N 2.96Å
461	Q	79.9	Confident	74.8	Confident	141 Å²	141	76.4 Å²	76.4	66%	0.659	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-30.7	-174	-177.6	175.7	-12.8	0	0	113.9	C452	C452-Q461 WeakPolarHBondContact CB-O 3.29Å; C452-Q461 PolarHBondContact SG-O 3.3Å
462	F	84.5	Confident	73.2	Confident	94 Å²	94	75 Å²	75	41%	0.412	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	20.7	178	-47.5	-70	0	0	0	112.3	C436 S437 I450 G460 G464	C436-F462 CarbonylContact C-O 3.5Å; S437-F462 WeakPolarHBondContact CB-O 3.44Å; S437-F462 PolarHBondContact OG-O 3.14Å; I450-F462 HydrophobicContact CD1-CD1 4.3Å; I450-F462 HydrophobicContact CD1-CE1 3.95Å; I450-F462 HydrophobicContact CG1-CE1 4.36Å; G460-F462 PolarHBondContact O-N 3.21Å; G460-F462 VanDerWaalsContact O-N 3.09Å; F462-G464 PolarHBondContact O-N 3.43Å; F462-G464 VanDerWaalsContact O-N 3.17Å
463	C	85.7	Confident	71.6	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	43%	0.427	C	S	.	.	S	Bend	trans	60.5	20	178.1	-51.5	0	0	0	0	117	H439 C452 C454 F458 V459 G460 F465	H439-C463 HydrophobicContact CB-CB 3.89Å; H439-C463 WeakPolarHBondContact O-CB 3.49Å; C452-C463 VanDerWaalsContact CB-SG 3.54Å; C454-C463 WeakPolarHBondContact CA-SG 3.29Å; C454-C463 HydrophobicContact CB-CB 3.75Å; C454-C463 WeakPolarHBondContact CB-SG 3.36Å; C454-C463 WeakPolarHBondContact SG-CA 3.43Å; C454-C463 WeakPolarHBondContact SG-CB 3.45Å; C454-C463 CovalentContact SG-SG 2.04Å; C454-C463 PolarHBondContact SG-SG 2.83Å; F458-C463 HydrophobicContact CB-CB 4.42Å; F458-C463 WeakPolarHBondContact CD1-O 3.42Å; V459-C463 CarbonylContact O-C 3.55Å; V459-C463 WeakPolarHBondContact O-CA 3.33Å; G460-C463 PolarHBondContact O-N 2.96Å; C463-F465 VanDerWaalsContact C-N 3.3Å; C463-F465 PolarHBondContact O-N 2.92Å
464	G	81.9	Confident	70	Confident	53 Å²	53	81.8 Å²	81.8	55%	0.546	44%	0.444	S	S	.	.			trans	-73.7	-3.2	-176.7	0	0	0	0	0	117.1	V459 F462	V459-G464 PolarHBondContact O-N 2.89Å; F462-G464 PolarHBondContact O-N 3.43Å; F462-G464 VanDerWaalsContact O-N 3.17Å
465	F	77.7	Confident	68	Low	137 Å²	137	84.8 Å²	84.8	60%	0.601	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115	126.2	-177.6	-59.9	-82.1	0	0	0	112	F458 V459 C463	F458-F465 CarbonylContact C-O 3.52Å; F458-F465 VanDerWaalsContact CA-O 3.27Å; F458-F465 WeakPolarHBondContact CA-O 3.46Å; V459-F465 HydrophobicContact CG2-CB 3.84Å; V459-F465 PolarHBondContact N-O 3.08Å; V459-F465 PolarHBondContact O-N 3.26Å; V459-F465 VanDerWaalsContact O-N 3.12Å; C463-F465 VanDerWaalsContact C-N 3.3Å; C463-F465 PolarHBondContact O-N 2.92Å
466	N	75.8	Confident	66.2	Low	67 Å²	67	84.3 Å²	84.3	36%	0.358	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	123.1	175.9	-172.8	-50.9	0	0	0	111.1	G457 F458 Y468 A469	G457-N466 CarbonylContact O-C 3.57Å; G457-N466 WeakPolarHBondContact O-CA 3.29Å; F458-N466 HydrophobicContact CD1-CB 4.43Å; F458-N466 HydrophobicContact CE1-CB 4.18Å; N466-Y468 WeakPolarHBondContact OD1-CA 3.01Å; N466-Y468 WeakPolarHBondContact OD1-CB 3.11Å; N466-Y468 PolarHBondContact OD1-N 2.76Å; N466-A469 HydrophobicContact CB-CB 4.43Å; N466-A469 PolarHBondContact OD1-N 3.26Å
467	L	62.8	Low	64.4	Low	54 Å²	54	79.8 Å²	79.8	28%	0.283	45%	0.451	S	S	.	.	S	Bend	trans	-81.9	-23.1	-176.1	-159.4	68.3	0	0	0	113.1	G457 V459 A469 L470 I471	G457-L467 PolarHBondContact O-N 2.78Å; V459-L467 HydrophobicContact CG1-CB 4.39Å; V459-L467 HydrophobicContact CG1-CD1 3.86Å; V459-L467 HydrophobicContact CG1-CD2 3.98Å; V459-L467 HydrophobicContact CG1-CG 4.3Å; V459-L467 HydrophobicContact CG2-CD1 3.99Å; L467-A469 VanDerWaalsContact C-N 3.26Å; L467-A469 PolarHBondContact O-N 3.1Å; L467-L470 HydrophobicContact CD1-CB 4.38Å; L467-L470 HydrophobicContact CD1-CD1 4.24Å; L467-L470 CarbonylContact O-C 3.55Å; L467-L470 PolarHBondContact O-N 3.05Å; L467-I471 HydrophobicContact CD2-CD1 3.71Å; L467-I471 HydrophobicContact CG-CD1 3.63Å; L467-I471 HydrophobicContact CG-CG1 4.04Å; L467-I471 WeakPolarHBondContact O-CB 3.25Å; L467-I471 WeakPolarHBondContact O-CG1 3.47Å; L467-I471 PolarHBondContact O-N 2.9Å
468	Y	59.8	Low	62.8	Low	157 Å²	157	82.8 Å²	82.8	62%	0.616	48%	0.475	S	S	*	.	H	α-helix	trans	-67.4	-30.2	170.5	-69	-75.6	0	0	0	111.7	N466 L470	N466-Y468 WeakPolarHBondContact OD1-CA 3.01Å; N466-Y468 WeakPolarHBondContact OD1-CB 3.11Å; N466-Y468 PolarHBondContact OD1-N 2.76Å; Y468-L470 PolarHBondContact O-N 3.41Å
469	A	57.3	Low	60.9	Low	78 Å²	78	84.5 Å²	84.5	65%	0.645	50%	0.498	S	S	*	.	H	α-helix	trans	-69.4	-11.2	169.4	0	0	0	0	0	113.7	N466 L467	N466-A469 HydrophobicContact CB-CB 4.43Å; N466-A469 PolarHBondContact OD1-N 3.26Å; L467-A469 VanDerWaalsContact C-N 3.26Å; L467-A469 PolarHBondContact O-N 3.1Å
470	L	50.7	Low	59.3	Low	95 Å²	95	90.1 Å²	90.1	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-113	-25.2	-178.6	-68	170.5	0	0	0	114	L467 Y468 P473 F474	L467-L470 HydrophobicContact CD1-CB 4.38Å; L467-L470 HydrophobicContact CD1-CD1 4.24Å; L467-L470 CarbonylContact O-C 3.55Å; L467-L470 PolarHBondContact O-N 3.05Å; Y468-L470 PolarHBondContact O-N 3.41Å; L470-P473 WeakPolarHBondContact O-CD 3.48Å; L470-F474 WeakPolarHBondContact O-CD2 3.43Å
471	I	49.2	Very low	57.6	Low	71 Å²	71	94.3 Å²	94.3	36%	0.364	53%	0.532	S	S	.	.	H	α-helix	trans	-85.6	-23.6	-176.5	-74.6	173.6	0	0	0	113.2	L467 F474	L467-I471 HydrophobicContact CD2-CD1 3.71Å; L467-I471 HydrophobicContact CG-CD1 3.63Å; L467-I471 HydrophobicContact CG-CG1 4.04Å; L467-I471 WeakPolarHBondContact O-CB 3.25Å; L467-I471 WeakPolarHBondContact O-CG1 3.47Å; L467-I471 PolarHBondContact O-N 2.9Å; I471-F474 PolarHBondContact O-N 3.17Å
472	A	46	Very low	55.6	Low	77 Å²	77	91.2 Å²	91.2	64%	0.636	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.6	-34.8	-179	0	0	0	0	0	115.2
473	P	50.8	Low	53.6	Low	74 Å²	74	89.9 Å²	89.9	48%	0.481	55%	0.55	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.3	-32.5	173.4	-13.6	31.1	0	0	0	114.7	L470	L470-P473 WeakPolarHBondContact O-CD 3.48Å
474	F	48.2	Very low	51.1	Low	149 Å²	149	97.3 Å²	97.3	65%	0.654	59%	0.589	S	S	*	*	H	α-helix	trans	-86.3	-33.6	-158.4	-81	-87	0	0	0	115.4	L470 I471 L476 C477 A478	L470-F474 WeakPolarHBondContact O-CD2 3.43Å; I471-F474 PolarHBondContact O-N 3.17Å; F474-L476 PolarHBondContact O-N 2.98Å; F474-C477 PolarHBondContact O-N 3.31Å; F474-C477 VanDerWaalsContact O-N 3.11Å; F474-A478 PolarHBondContact O-N 3.49Å
475	C	42.2	Very low	48.7	Very low	97 Å²	97	101 Å²	101	66%	0.655	60%	0.601	S	S	*	*	H	α-helix	trans	-65.6	-22.8	176	-74.1	0	0	0	0	112.8
476	L	46	Very low	46.6	Very low	124 Å²	124	102.4 Å²	102.4	65%	0.649	61%	0.614	S	S	*	*	H	α-helix	trans	-73.8	-35.4	172.7	-68.7	167.2	0	0	0	111.9	F474	F474-L476 PolarHBondContact O-N 2.98Å
477	C	39.9	Very low	44.5	Very low	60 Å²	60	107.7 Å²	107.7	41%	0.405	64%	0.641	S	S	.	*	H	α-helix	trans	-68.3	-36.5	179.6	-65.8	0	0	0	0	113.4	F474 A479 F480 L481	F474-C477 PolarHBondContact O-N 3.31Å; F474-C477 VanDerWaalsContact O-N 3.11Å; C477-A479 PolarHBondContact O-N 2.65Å; C477-F480 PolarHBondContact O-N 2.89Å; C477-L481 HydrophobicContact CB-CD1 4.4Å; C477-L481 WeakPolarHBondContact O-CG 3.26Å; C477-L481 PolarHBondContact O-N 2.89Å
478	A	40.9	Very low	43	Very low	75 Å²	75	116.9 Å²	116.9	62%	0.62	67%	0.672	S	S	*	*	H	α-helix	trans	-61	-30.5	-179.2	0	0	0	0	0	113.2	F474 F480	F474-A478 PolarHBondContact O-N 3.49Å; A478-F480 VanDerWaalsContact C-N 3.34Å
479	A	43	Very low	41.7	Very low	84 Å²	84	115.1 Å²	115.1	69%	0.694	68%	0.683	S	S	*	*	H	α-helix	trans	-73.5	-21.8	175.5	0	0	0	0	0	113.7	C477	C477-A479 PolarHBondContact O-N 2.65Å
480	F	46.1	Very low	40.6	Very low	170 Å²	170	116.9 Å²	116.9	75%	0.746	69%	0.688	S	S	*	*	H	α-helix	trans	-96.5	-32.7	-178.7	-86.2	-96.4	0	0	0	113.5	C477 A478 G482 G483	C477-F480 PolarHBondContact O-N 2.89Å; A478-F480 VanDerWaalsContact C-N 3.34Å; F480-G482 VanDerWaalsContact C-N 3.26Å; F480-G482 PolarHBondContact O-N 2.98Å; F480-G483 PolarHBondContact O-N 3.21Å
481	L	41.9	Very low	39.6	Very low	123 Å²	123	123.6 Å²	123.6	64%	0.644	71%	0.706	S	S	*	*	H	α-helix	trans	-72.2	-15.9	-175.1	-69.2	169.8	0	0	0	114.1	C477 G483	C477-L481 HydrophobicContact CB-CD1 4.4Å; C477-L481 WeakPolarHBondContact O-CG 3.26Å; C477-L481 PolarHBondContact O-N 2.89Å; L481-G483 PolarHBondContact O-N 2.04Å; L481-G483 VanDerWaalsContact O-N 3.15Å
482	G	37.9	Very low	38.8	Very low	76 Å²	76	129.1 Å²	129.1	78%	0.784	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-3	175.1	0	0	0	0	0	115.7	F480	F480-G482 VanDerWaalsContact C-N 3.26Å; F480-G482 PolarHBondContact O-N 2.98Å
483	G	41.4	Very low	37.9	Very low	66 Å²	66	131.3 Å²	131.3	68%	0.68	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	-4.9	-176.6	0	0	0	0	0	116.5	F480 L481	F480-G483 PolarHBondContact O-N 3.21Å; L481-G483 PolarHBondContact O-N 2.04Å; L481-G483 VanDerWaalsContact O-N 3.15Å
484	L	34.8	Very low	36.9	Very low	156 Å²	156	136 Å²	136	82%	0.817	76%	0.759	S	S	*	*			trans	-127.7	63.8	-166.7	-81.7	163.7	0	0	0	113.1
485	V	31	Very low	35.9	Very low	131 Å²	131	136.6 Å²	136.6	79%	0.794	77%	0.774	S	S	*	*			trans	-128.3	63.8	173.4	-167.7	0	0	0	0	111
486	L	32.5	Very low	35.2	Very low	166 Å²	166	134.9 Å²	134.9	87%	0.869	77%	0.773	S	S	*	*			trans	-144.3	151	164.4	-74.4	-179.8	0	0	0	110.1
487	L	32.8	Very low	34.3	Very low	178 Å²	178	136.8 Å²	136.8	93%	0.932	78%	0.782	S	S	*	*			trans	83.3	147.3	179.8	-51.7	177.8	0	0	0	116.5
488	R	31.7	Very low	33.7	Very low	248 Å²	248	140.5 Å²	140.5	94%	0.936	80%	0.803	S	S	*	*			trans	-115.1	164.5	-155.4	-71.5	169	158.8	163.5	-9.5	113.3
489	S	31.2	Very low	33.1	Very low	119 Å²	119	146 Å²	146	83%	0.832	82%	0.815	S	S	*	*			trans	101.2	133	141.4	-153.3	0	0	0	0	117.3
490	P	33.9	Very low	32.3	Very low	116 Å²	116	145 Å²	145	75%	0.753	81%	0.813	S	S	*	*			trans	-111.7	158.9	-172.7	40.9	-34	0	0	0	115.1
491	R	31	Very low	31.4	Very low	235 Å²	235	143.9 Å²	143.9	89%	0.887	82%	0.819	S	S	*	*			trans	-170	159.4	146	-107.6	162.7	-165.5	-170	2.8	111.9
492	E	31.6	Very low	30.5	Very low	187 Å²	187	142.7 Å²	142.7	87%	0.874	82%	0.822	S	S	*	*			trans	68.7	137.3	171.6	-69.6	172.2	-151.1	0	0	118.9
493	P	28	Very low	30	Very low	124 Å²	124	145.5 Å²	145.5	81%	0.805	82%	0.824	S	S	*	*			trans	-98.6	145.4	-177.6	37.6	-32.9	0	0	0	113.3
494	L	29.9	Very low	29.2	Very low	173 Å²	173	148 Å²	148	91%	0.906	83%	0.826	S	S	*	*			trans	-118.5	135.5	163.8	-88.5	167.3	0	0	0	110.6	G496	L494-G496 PolarHBondContact O-N 3.33Å
495	V	26.2	Very low	28.7	Very low	160 Å²	160	148.4 Å²	148.4	97%	0.97	83%	0.828	S	S	*	*			trans	-72.2	109.6	-179.1	177.1	0	0	0	0	109.2
496	G	27.3	Very low	28.3	Very low	62 Å²	62	146.9 Å²	146.9	64%	0.639	82%	0.823	S	S	*	*			trans	-162	86.7	-173.3	0	0	0	0	0	115.2	L494	L494-G496 PolarHBondContact O-N 3.33Å
497	I	28.2	Very low	27.8	Very low	163 Å²	163	147 Å²	147	84%	0.836	82%	0.824	S	S	*	*	S	Bend	trans	58	93.6	152.2	-49.7	177.1	0	0	0	116.9
498	V	26.9	Very low	27.4	Very low	138 Å²	138	144 Å²	144	84%	0.836	82%	0.817	S	S	*	*			trans	49.9	106.6	147.7	-168.5	0	0	0	0	118.1
499	H	28.8	Very low	26.9	Very low	192 Å²	192	141.9 Å²	141.9	89%	0.889	82%	0.815	S	S	*	*			trans	-63.2	161.8	174.5	-74.3	-121.2	0	0	0	114.8
500	G	25.8	Very low	26.6	Very low	62 Å²	62	142 Å²	142	64%	0.639	81%	0.813	S	S	*	*			trans	-126.6	179.2	152.1	0	0	0	0	0	112.3
501	V	26.6	Very low	26.1	Very low	146 Å²	146	145 Å²	145	89%	0.885	81%	0.814	S	S	*	*			trans	70.6	105.6	155.3	-171.6	0	0	0	0	119.2
502	S	23.6	Very low	25.8	Very low	99 Å²	99	141 Å²	141	69%	0.692	81%	0.805	S	S	*	*			trans	69.9	98.5	136.8	-171.5	0	0	0	0	123.5
503	T	27.1	Very low	25.4	Very low	135 Å²	135	141 Å²	141	83%	0.828	80%	0.802	S	S	*	*			trans	-157.3	130.9	137	15.8	0	0	0	0	106.3
504	V	24.4	Very low	25.1	Very low	119 Å²	119	144.3 Å²	144.3	72%	0.721	81%	0.807	S	S	*	*			cis	70.2	128.1	41.5	-171.8	0	0	0	0	112.5
505	L	23.6	Very low	24.9	Very low	164 Å²	164	138.9 Å²	138.9	86%	0.859	79%	0.793	S	S	*	*			trans	86.4	139.9	-168.9	-58.1	163.7	0	0	0	114.7
506	S	22.4	Very low	24.7	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	78%	0.782	S	S	*	*			cis	-156.9	165.9	-22	-156.5	0	0	0	0	112.5
507	L	22.7	Very low	24.4	Very low	169 Å²	169	143.6 Å²	143.6	89%	0.885	79%	0.789	S	S	*	*			trans	-28.4	124.8	176.2	-67.2	153.4	0	0	0	118.2
508	S	24.1	Very low	24.2	Very low	114 Å²	114	141.7 Å²	141.7	80%	0.797	78%	0.784	S	S	*	*			trans	-158.1	146.2	130.5	55.8	0	0	0	0	111.4
509	K	21.8	Very low	24.1	Very low	204 Å²	204	142.5 Å²	142.5	89%	0.887	77%	0.774	S	S	*	*			trans	-104.9	129.5	168.8	-71.9	-177.4	178.2	-178.8	0	109
510	P	25.6	Very low	24.1	Very low	121 Å²	121	136.8 Å²	136.8	79%	0.786	77%	0.767	S	S	*	*			trans	-85.8	146.2	143.6	32.7	-27.9	0	0	0	109.7
511	K	23.5	Very low	24.1	Very low	178 Å²	178	143 Å²	143	77%	0.774	77%	0.771	S	S	*	*			trans	-88.1	168.5	165.9	-74	-176	174.9	-176.9	0	110.2
512	E	23	Very low	24.2	Very low	152 Å²	152	139 Å²	139	71%	0.71	75%	0.752	S	S	*	*			trans	86.3	149.1	137.7	-99.4	163.7	-115.1	0	0	121.6
513	K	24.2	Very low	24.7	Very low	187 Å²	187	135.8 Å²	135.8	81%	0.813	74%	0.736	S	S	*	*			trans	73.3	103.2	170	-63.7	-175.4	-179.1	-174.2	0	117.5
514	Q	22.4	Very low	25.1	Very low	193 Å²	193	135 Å²	135	90%	0.902	72%	0.721	S	S	*	*			trans	-61.8	155.8	167.6	-60.1	128.8	-56.1	0	0	111.5
515	G	24.1	Very low	25.8	Very low	60 Å²	60	129.8 Å²	129.8	62%	0.619	69%	0.689	S	S	*	*			trans	-173.9	89.7	173.4	0	0	0	0	0	110.7
516	V	21.7	Very low	26.7	Very low	122 Å²	122	124.2 Å²	124.2	74%	0.739	66%	0.663	S	S	*	*			trans	-86.8	123.1	-178.9	178.2	0	0	0	0	109.6	V518	V516-V518 HydrophobicContact CG1-CG2 4.15Å
517	Y	22.4	Very low	27.7	Very low	199 Å²	199	122.5 Å²	122.5	78%	0.78	65%	0.648	S	S	*	*			trans	-104.8	129.4	171.5	-67.4	-89.7	0	0	0	110
518	V	23.6	Very low	28.8	Very low	122 Å²	122	118.1 Å²	118.1	74%	0.739	63%	0.631	S	S	*	*			trans	-126.2	148	168	-175.5	0	0	0	0	108.9	V516	V516-V518 HydrophobicContact CG1-CG2 4.15Å
519	Y	25.4	Very low	29.8	Very low	156 Å²	156	116.8 Å²	116.8	61%	0.612	61%	0.613	S	S	*	*			trans	-122.9	123.6	-176.2	-75.2	-121.3	0	0	0	109.6	K677	Y519-K677 HydrophobicContact CD1-CD 4.45Å
520	G	27.4	Very low	31.2	Very low	72 Å²	72	108.8 Å²	108.8	74%	0.742	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-61.6	141.8	161.3	0	0	0	0	0	110.9
521	R	26	Very low	32.2	Very low	193 Å²	193	108.9 Å²	108.9	73%	0.728	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-81.8	145.8	175.5	-78.9	-175.8	177.2	179	0.9	110.9	H428	H428-R521 PolarHBondContact CE1-NH2 2.71Å; H428-R521 PolarHBondContact NE2-NH2 3.47Å
522	A	28.9	Very low	33.7	Very low	60 Å²	60	105.5 Å²	105.5	50%	0.496	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-64.3	129.2	163.9	0	0	0	0	0	110.2	F675	A522-F675 WeakPolarHBondContact CA-O 3.38Å; A522-F675 WeakPolarHBondContact CB-O 3.3Å
523	G	34.3	Very low	35.1	Very low	33 Å²	33	98.6 Å²	98.6	34%	0.34	52%	0.524	S	S	.	.			trans	-104.3	162.8	171.8	0	0	0	0	0	112.4
524	K	35.6	Very low	36	Very low	117 Å²	117	94.8 Å²	94.8	51%	0.509	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	123.4	175.2	170.9	165.8	178.5	132.1	0	108.9	E670 S672	K524-E670 IonicContact NZ-OE2 2.62Å; K524-S672 WeakPolarHBondContact CE-OG 3.39Å; K524-S672 PolarHBondContact NZ-OG 3.12Å
525	V	39.9	Very low	37.3	Very low	11 Å²	11	88.9 Å²	88.9	7%	0.067	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	120	178.7	-177.9	0	0	0	0	110.5	Y556 F561 L673 F675	V525-Y556 HydrophobicContact CG1-CE1 4.13Å; V525-F561 HydrophobicContact CG2-CE2 4.03Å; V525-F561 HydrophobicContact CG2-CZ 3.8Å; V525-L673 HydrophobicContact CB-CB 4.4Å; V525-L673 HydrophobicContact CB-CD1 4.23Å; V525-F675 HydrophobicContact CG2-CE2 4.34Å
526	P	41	Very low	38.1	Very low	47 Å²	47	90.3 Å²	90.3	31%	0.305	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	137.4	170	-25.3	35.4	0	0	0	114.4	S528 E529	P526-S528 WeakPolarHBondContact CB-OG 3.45Å; P526-S528 PolarHBondContact O-N 3.41Å; P526-S528 VanDerWaalsContact O-N 3.14Å; P526-E529 HydrophobicContact CB-CG 4.49Å; P526-E529 WeakPolarHBondContact CD-OE1 3.11Å; P526-E529 WeakPolarHBondContact CD-OE2 3.4Å; P526-E529 VanDerWaalsContact CG-OE1 3.31Å; P526-E529 WeakPolarHBondContact CG-OE1 3.09Å; P526-E529 PolarHBondContact O-N 2.61Å
527	V	44.7	Very low	39	Very low	62 Å²	62	87.9 Å²	87.9	38%	0.376	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-23.8	175.7	-179.3	0	0	0	0	112.7	E529 I530 Q531 M592	V527-E529 VanDerWaalsContact C-N 3.34Å; V527-E529 PolarHBondContact O-N 2.81Å; V527-I530 WeakPolarHBondContact O-CG1 3.28Å; V527-I530 PolarHBondContact O-N 2.87Å; V527-Q531 WeakPolarHBondContact O-CG 3.01Å; V527-Q531 PolarHBondContact O-N 3.33Å; V527-M592 HydrophobicContact CG1-CE 3.71Å
528	S	45.8	Very low	39.7	Very low	77 Å²	77	82.5 Å²	82.5	54%	0.538	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-32.5	178.3	44.2	0	0	0	0	113.9	P526 I530 Q531	P526-S528 WeakPolarHBondContact CB-OG 3.45Å; P526-S528 PolarHBondContact O-N 3.41Å; P526-S528 VanDerWaalsContact O-N 3.14Å; S528-I530 VanDerWaalsContact C-N 3.32Å; S528-I530 PolarHBondContact O-N 3.28Å; S528-Q531 PolarHBondContact O-N 3.49Å
529	E	44.4	Very low	40.4	Very low	86 Å²	86	83.8 Å²	83.8	40%	0.402	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-36.1	-177.8	-70.7	159.2	-161.7	0	0	110.9	P526 V527 H532 Y556	P526-E529 HydrophobicContact CB-CG 4.49Å; P526-E529 WeakPolarHBondContact CD-OE1 3.11Å; P526-E529 WeakPolarHBondContact CD-OE2 3.4Å; P526-E529 VanDerWaalsContact CG-OE1 3.31Å; P526-E529 WeakPolarHBondContact CG-OE1 3.09Å; P526-E529 PolarHBondContact O-N 2.61Å; V527-E529 VanDerWaalsContact C-N 3.34Å; V527-E529 PolarHBondContact O-N 2.81Å; E529-H532 PolarHBondContact O-CE1 3.15Å; E529-H532 VanDerWaalsContact O-CE1 3.26Å; E529-H532 PolarHBondContact O-ND1 2.77Å; E529-Y556 HydrophobicContact CB-CE2 4.18Å; E529-Y556 WeakPolarHBondContact CB-OH 3.01Å; E529-Y556 PolarHBondContact OE2-OH 3.06Å
530	I	50.5	Low	40.7	Very low	36 Å²	36	84.8 Å²	84.8	19%	0.185	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	4.2	177.3	61.9	172.4	0	0	0	114.4	V527 S528 H532 C533 Y556	V527-I530 WeakPolarHBondContact O-CG1 3.28Å; V527-I530 PolarHBondContact O-N 2.87Å; S528-I530 VanDerWaalsContact C-N 3.32Å; S528-I530 PolarHBondContact O-N 3.28Å; I530-H532 PolarHBondContact O-N 2.8Å; I530-C533 PolarHBondContact O-N 2.88Å; I530-Y556 HydrophobicContact CG2-CD1 3.56Å; I530-Y556 HydrophobicContact CG2-CD2 4.29Å; I530-Y556 HydrophobicContact CG2-CE1 3.72Å; I530-Y556 HydrophobicContact CG2-CE2 4.43Å; I530-Y556 HydrophobicContact CG2-CG 3.87Å
531	Q	47.6	Very low	40.7	Very low	123 Å²	123	91 Å²	91	58%	0.575	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-64.5	-26.1	179.6	-91.8	-174.8	-96.3	0	0	113.3	V527 S528 C533 K534	V527-Q531 WeakPolarHBondContact O-CG 3.01Å; V527-Q531 PolarHBondContact O-N 3.33Å; S528-Q531 PolarHBondContact O-N 3.49Å; Q531-C533 VanDerWaalsContact C-N 3.3Å; Q531-C533 PolarHBondContact O-N 2.78Å; Q531-K534 WeakPolarHBondContact O-CB 3.04Å; Q531-K534 PolarHBondContact O-N 3.26Å; Q531-K534 VanDerWaalsContact O-N 3.1Å
532	H	55.4	Low	40.8	Very low	108 Å²	108	89.7 Å²	89.7	50%	0.5	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-63.5	-33.8	-179.2	69.1	-87.7	0	0	0	112.6	E529 I530 K534 A535 C552	E529-H532 PolarHBondContact O-CE1 3.15Å; E529-H532 VanDerWaalsContact O-CE1 3.26Å; E529-H532 PolarHBondContact O-ND1 2.77Å; I530-H532 PolarHBondContact O-N 2.8Å; H532-K534 PolarHBondContact O-N 3.41Å; H532-A535 WeakPolarHBondContact O-CB 3.09Å; H532-A535 PolarHBondContact O-N 3.21Å; H532-A535 VanDerWaalsContact O-N 3.09Å; H532-C552 PolarHBondContact NE2-SG 2.98Å
533	C	50.9	Low	40.7	Very low	7 Å²	7	89.3 Å²	89.3	5%	0.047	49%	0.493	C	S	.	.	G	3₁₀ helix	trans	-59.2	-13.1	173.8	-59.4	0	0	0	0	114.2	I530 Q531 C552	I530-C533 PolarHBondContact O-N 2.88Å; Q531-C533 VanDerWaalsContact C-N 3.3Å; Q531-C533 PolarHBondContact O-N 2.78Å; C533-C552 WeakPolarHBondContact CA-SG 3.46Å; C533-C552 HydrophobicContact CB-CB 3.67Å; C533-C552 WeakPolarHBondContact CB-SG 3.22Å; C533-C552 VanDerWaalsContact SG-C 3.6Å; C533-C552 WeakPolarHBondContact SG-CB 3.26Å; C533-C552 CovalentContact SG-SG 2.04Å; C533-C552 PolarHBondContact SG-SG 3.31Å
534	K	44.8	Very low	40.4	Very low	107 Å²	107	98.6 Å²	98.6	47%	0.465	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-99.2	-5.5	-178.9	-154.4	171.7	-175	175.2	0	113.8	Q531 H532 M592	Q531-K534 WeakPolarHBondContact O-CB 3.04Å; Q531-K534 PolarHBondContact O-N 3.26Å; Q531-K534 VanDerWaalsContact O-N 3.1Å; H532-K534 PolarHBondContact O-N 3.41Å; K534-M592 HydrophobicContact CD-SD 3.87Å; K534-M592 PolarHBondContact NZ-SD 3.03Å
535	A	48.6	Very low	40.1	Very low	69 Å²	69	95.3 Å²	95.3	57%	0.57	52%	0.519	S	S	*	.	S	Bend	trans	-85.9	-21.6	-170.3	0	0	0	0	0	114.7	H532 S538	H532-A535 WeakPolarHBondContact O-CB 3.09Å; H532-A535 PolarHBondContact O-N 3.21Å; H532-A535 VanDerWaalsContact O-N 3.09Å; A535-S538 PolarHBondContact O-OG 2.04Å
536	V	41.8	Very low	39.7	Very low	89 Å²	89	98.8 Å²	98.8	54%	0.539	54%	0.535	S	S	.	.	S	Bend	trans	-85.4	-28.2	-173.1	-175.5	0	0	0	0	112.7	S538 Y548	V536-S538 VanDerWaalsContact C-N 3.27Å; V536-S538 PolarHBondContact O-N 3.16Å; V536-S538 VanDerWaalsContact O-N 3.16Å; V536-Y548 HydrophobicContact CB-CD1 4.5Å; V536-Y548 HydrophobicContact CB-CE1 4.41Å; V536-Y548 HydrophobicContact CG1-CE1 4.46Å; V536-Y548 HydrophobicContact CG2-CE1 4.01Å
537	T	39.3	Very low	39.6	Very low	71 Å²	71	102.3 Å²	102.3	44%	0.436	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	8.2	-169.6	49	0	0	0	0	115.6
538	S	38.7	Very low	39.1	Very low	86 Å²	86	105.1 Å²	105.1	60%	0.601	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-19	-171.7	50.6	0	0	0	0	115.4	A535 V536	A535-S538 PolarHBondContact O-OG 2.04Å; V536-S538 VanDerWaalsContact C-N 3.27Å; V536-S538 PolarHBondContact O-N 3.16Å; V536-S538 VanDerWaalsContact O-N 3.16Å
539	N	38.4	Very low	38.7	Very low	150 Å²	150	103.6 Å²	103.6	80%	0.802	54%	0.537	S	S	*	.	S	Bend	trans	-113.4	2.5	-163.5	-78.6	-13.4	0	0	0	116.4
540	Q	30.2	Very low	38.6	Very low	177 Å²	177	103.8 Å²	103.8	83%	0.827	54%	0.54	S	S	*	.			trans	-128.6	138.4	179.8	-72.8	-175.4	-17.5	0	0	113
541	K	28.8	Very low	38.4	Very low	202 Å²	202	107.4 Å²	107.4	88%	0.878	56%	0.556	S	S	*	*			trans	-90.6	120.8	176.3	-75.8	-179.9	176.2	176.2	0	110.9
542	L	26.6	Very low	38.2	Very low	165 Å²	165	102.6 Å²	102.6	86%	0.864	54%	0.535	S	S	*	.	S	Bend	trans	49.2	81.5	149.7	-74.3	153.8	0	0	0	116.6
543	G	26.6	Very low	37.8	Very low	52 Å²	52	100 Å²	100	54%	0.536	53%	0.527	S	S	.	.	S	Bend	trans	161	128.5	167.6	0	0	0	0	0	110.3	G545	G543-G545 PolarHBondContact O-N 2.82Å
544	Y	28.8	Very low	37.7	Very low	229 Å²	229	103.6 Å²	103.6	90%	0.898	55%	0.546	S	S	*	.	S	Bend	trans	57.9	-17.1	171.9	-63.1	-83.3	0	0	0	119.9	Q546	Y544-Q546 VanDerWaalsContact C-N 3.32Å; Y544-Q546 PolarHBondContact O-N 3.31Å
545	G	29.1	Very low	37.8	Very low	47 Å²	47	104.5 Å²	104.5	49%	0.485	55%	0.55	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	34.8	-171.6	0	0	0	0	0	118.5	G543	G543-G545 PolarHBondContact O-N 2.82Å
546	Q	32.6	Very low	37.9	Very low	85 Å²	85	103.1 Å²	103.1	40%	0.397	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-17.8	-173.1	-66.9	-160.9	-68.6	0	0	117.2	Y544	Y544-Q546 VanDerWaalsContact C-N 3.32Å; Y544-Q546 PolarHBondContact O-N 3.31Å
547	E	37.2	Very low	38	Very low	121 Å²	121	100.4 Å²	100.4	57%	0.565	52%	0.515	S	S	*	.	S	Bend	trans	-71.2	-37.6	178.9	-71.1	165.1	126.8	0	0	111.8	M549 I550 E551	E547-M549 VanDerWaalsContact C-N 3.26Å; E547-M549 PolarHBondContact O-N 3.49Å; E547-I550 PolarHBondContact O-N 2.96Å; E547-E551 PolarHBondContact O-N 3.13Å; E547-E551 VanDerWaalsContact O-N 3.17Å
548	Y	34.1	Very low	38.3	Very low	120 Å²	120	102.4 Å²	102.4	47%	0.471	52%	0.519	S	S	.	.	H	α-helix	trans	-52.7	-29.4	-171.1	-151	-91.6	0	0	0	116.1	V536 C552	V536-Y548 HydrophobicContact CB-CD1 4.5Å; V536-Y548 HydrophobicContact CB-CE1 4.41Å; V536-Y548 HydrophobicContact CG1-CE1 4.46Å; V536-Y548 HydrophobicContact CG2-CE1 4.01Å; Y548-C552 WeakPolarHBondContact O-CB 3.13Å; Y548-C552 PolarHBondContact O-N 3.46Å
549	M	39.2	Very low	38.5	Very low	46 Å²	46	103.9 Å²	103.9	23%	0.227	52%	0.52	C	S	.	.	H	α-helix	trans	-75.9	-37.4	178.6	-163.2	-159.6	-55.2	0	0	112.1	E547 V553 Y593	E547-M549 VanDerWaalsContact C-N 3.26Å; E547-M549 PolarHBondContact O-N 3.49Å; M549-V553 WeakPolarHBondContact O-CG2 3.46Å; M549-V553 PolarHBondContact O-N 3.02Å; M549-Y593 HydrophobicContact CE-CD2 4.34Å; M549-Y593 HydrophobicContact CE-CE1 4.41Å; M549-Y593 HydrophobicContact CE-CE2 4.1Å; M549-Y593 HydrophobicContact SD-CD1 4.12Å; M549-Y593 HydrophobicContact SD-CD2 3.65Å; M549-Y593 HydrophobicContact SD-CE1 4.45Å; M549-Y593 HydrophobicContact SD-CE2 4.02Å; M549-Y593 HydrophobicContact SD-CG 3.74Å
550	I	41.5	Very low	38.8	Very low	90 Å²	90	99.8 Å²	99.8	46%	0.462	50%	0.5	S	S	.	.	H	α-helix	trans	-71.5	-48	178.2	-62.7	175.6	0	0	0	108.3	E547 C552 V553 D554	E547-I550 PolarHBondContact O-N 2.96Å; I550-C552 VanDerWaalsContact C-N 3.29Å; I550-C552 PolarHBondContact O-N 3.39Å; I550-V553 PolarHBondContact O-N 2.79Å; I550-V553 VanDerWaalsContact O-N 3.09Å; I550-D554 WeakPolarHBondContact O-CB 3.49Å; I550-D554 PolarHBondContact O-N 2.75Å
551	E	45.5	Very low	39.2	Very low	112 Å²	112	94.3 Å²	94.3	52%	0.523	47%	0.474	S	S	.	.	H	α-helix	trans	-59	-38.2	177.5	-63.3	178.8	134.4	0	0	112.6	E547 K555	E547-E551 PolarHBondContact O-N 3.13Å; E547-E551 VanDerWaalsContact O-N 3.17Å; E551-K555 WeakPolarHBondContact O-CB 3.38Å; E551-K555 PolarHBondContact O-N 3.15Å
552	C	44.9	Very low	39.3	Very low	22 Å²	22	89.8 Å²	89.8	15%	0.149	47%	0.466	C	S	.	.	H	α-helix	trans	-66.4	-36.1	176	-174.5	0	0	0	0	113.1	H532 C533 Y548 I550 Y556	H532-C552 PolarHBondContact NE2-SG 2.98Å; C533-C552 WeakPolarHBondContact CA-SG 3.46Å; C533-C552 HydrophobicContact CB-CB 3.67Å; C533-C552 WeakPolarHBondContact CB-SG 3.22Å; C533-C552 VanDerWaalsContact SG-C 3.6Å; C533-C552 WeakPolarHBondContact SG-CB 3.26Å; C533-C552 CovalentContact SG-SG 2.04Å; C533-C552 PolarHBondContact SG-SG 3.31Å; Y548-C552 WeakPolarHBondContact O-CB 3.13Å; Y548-C552 PolarHBondContact O-N 3.46Å; I550-C552 VanDerWaalsContact C-N 3.29Å; I550-C552 PolarHBondContact O-N 3.39Å; C552-Y556 VanDerWaalsContact O-CB 3.28Å; C552-Y556 WeakPolarHBondContact O-CB 3.44Å; C552-Y556 PolarHBondContact O-N 3.27Å
553	V	47.2	Very low	39.5	Very low	52 Å²	52	88.1 Å²	88.1	32%	0.315	46%	0.462	S	S	.	.	H	α-helix	trans	-78.4	-41.7	177	173.4	0	0	0	0	111.5	M549 I550 Y556 C557	M549-V553 WeakPolarHBondContact O-CG2 3.46Å; M549-V553 PolarHBondContact O-N 3.02Å; I550-V553 PolarHBondContact O-N 2.79Å; I550-V553 VanDerWaalsContact O-N 3.09Å; V553-Y556 PolarHBondContact O-N 2.75Å; V553-C557 PolarHBondContact O-N 2.75Å; V553-C557 PolarHBondContact O-SG 3.01Å
554	D	47.3	Very low	39.6	Very low	84 Å²	84	87.4 Å²	87.4	45%	0.449	46%	0.455	S	S	.	.	H	α-helix	trans	-60.2	-46.8	174	-78.9	-5.5	0	0	0	110	I550 C557 E558	I550-D554 WeakPolarHBondContact O-CB 3.49Å; I550-D554 PolarHBondContact O-N 2.75Å; D554-C557 CarbonylContact O-C 3.59Å; D554-C557 WeakPolarHBondContact O-CA 3.24Å; D554-C557 WeakPolarHBondContact O-CB 3.37Å; D554-C557 PolarHBondContact O-N 2.72Å; D554-C557 VanDerWaalsContact O-N 3.11Å; D554-E558 PolarHBondContact O-N 3.11Å
555	K	48.5	Very low	39.7	Very low	126 Å²	126	85.1 Å²	85.1	55%	0.548	45%	0.445	S	S	.	.	H	α-helix	trans	-61.9	-43.9	174.6	-179.1	171.9	-179.4	176.9	0	112.5	E551 C557 E558 D559	E551-K555 WeakPolarHBondContact O-CB 3.38Å; E551-K555 PolarHBondContact O-N 3.15Å; K555-C557 PolarHBondContact O-N 3.09Å; K555-E558 PolarHBondContact O-N 3.4Å; K555-E558 VanDerWaalsContact O-N 3.15Å; K555-D559 VanDerWaalsContact CE-OD2 3.3Å; K555-D559 WeakPolarHBondContact CE-OD2 3.38Å; K555-D559 WeakPolarHBondContact CG-OD2 3.02Å; K555-D559 WeakPolarHBondContact O-CB 3.19Å; K555-D559 PolarHBondContact O-N 3.41Å
556	Y	49.9	Very low	39.7	Very low	39 Å²	39	85.9 Å²	85.9	15%	0.153	44%	0.436	C	S	.	.	H	α-helix	trans	-57.9	-37.5	173.5	178.2	-94.8	0	0	0	111.6	V525 E529 I530 C552 V553 T560	V525-Y556 HydrophobicContact CG1-CE1 4.13Å; E529-Y556 HydrophobicContact CB-CE2 4.18Å; E529-Y556 WeakPolarHBondContact CB-OH 3.01Å; E529-Y556 PolarHBondContact OE2-OH 3.06Å; I530-Y556 HydrophobicContact CG2-CD1 3.56Å; I530-Y556 HydrophobicContact CG2-CD2 4.29Å; I530-Y556 HydrophobicContact CG2-CE1 3.72Å; I530-Y556 HydrophobicContact CG2-CE2 4.43Å; I530-Y556 HydrophobicContact CG2-CG 3.87Å; C552-Y556 VanDerWaalsContact O-CB 3.28Å; C552-Y556 WeakPolarHBondContact O-CB 3.44Å; C552-Y556 PolarHBondContact O-N 3.27Å; V553-Y556 PolarHBondContact O-N 2.75Å; Y556-T560 WeakPolarHBondContact CE2-OG1 3.46Å; Y556-T560 WeakPolarHBondContact O-CB 3.4Å; Y556-T560 PolarHBondContact O-N 3.35Å; Y556-T560 PolarHBondContact O-OG1 3.32Å
557	C	43	Very low	39.6	Very low	33 Å²	33	88.5 Å²	88.5	22%	0.223	44%	0.442	C	S	.	.	H	α-helix	trans	-70.5	-39.6	174.2	-73.3	0	0	0	0	113.2	V553 D554 K555 F561 F566	V553-C557 PolarHBondContact O-N 2.75Å; V553-C557 PolarHBondContact O-SG 3.01Å; D554-C557 CarbonylContact O-C 3.59Å; D554-C557 WeakPolarHBondContact O-CA 3.24Å; D554-C557 WeakPolarHBondContact O-CB 3.37Å; D554-C557 PolarHBondContact O-N 2.72Å; D554-C557 VanDerWaalsContact O-N 3.11Å; K555-C557 PolarHBondContact O-N 3.09Å; C557-F561 CarbonylContact O-C 3.42Å; C557-F561 VanDerWaalsContact O-CA 3.29Å; C557-F561 WeakPolarHBondContact O-CA 3.06Å; C557-F561 WeakPolarHBondContact O-CB 3.39Å; C557-F561 PolarHBondContact O-N 2.98Å; C557-F566 HydrophobicContact CB-CD2 4.45Å
558	E	46.2	Very low	39.1	Very low	113 Å²	113	86.9 Å²	86.9	53%	0.528	44%	0.444	S	S	.	.	H	α-helix	trans	-64	-48.2	173.6	-69.8	-166.2	150.8	0	0	111.8	D554 K555	D554-E558 PolarHBondContact O-N 3.11Å; K555-E558 PolarHBondContact O-N 3.4Å; K555-E558 VanDerWaalsContact O-N 3.15Å
559	D	44.2	Very low	38.8	Very low	116 Å²	116	90.7 Å²	90.7	62%	0.62	46%	0.458	S	S	*	.	H	α-helix	trans	-67.9	-35.5	-177.7	-70.6	-22.6	0	0	0	112.1	K555	K555-D559 VanDerWaalsContact CE-OD2 3.3Å; K555-D559 WeakPolarHBondContact CE-OD2 3.38Å; K555-D559 WeakPolarHBondContact CG-OD2 3.02Å; K555-D559 WeakPolarHBondContact O-CB 3.19Å; K555-D559 PolarHBondContact O-N 3.41Å
560	T	43.2	Very low	38.2	Very low	64 Å²	64	94 Å²	94	39%	0.393	48%	0.475	S	S	.	.	H	α-helix	trans	-95.3	-29.6	-176.3	-47.1	0	0	0	0	113.5	Y556	Y556-T560 WeakPolarHBondContact CE2-OG1 3.46Å; Y556-T560 WeakPolarHBondContact O-CB 3.4Å; Y556-T560 PolarHBondContact O-N 3.35Å; Y556-T560 PolarHBondContact O-OG1 3.32Å
561	F	40.1	Very low	37.5	Very low	62 Å²	62	92.2 Å²	92.2	27%	0.272	47%	0.469	S	S	.	.			trans	-131.8	66.9	-176.2	-57.4	-77	0	0	0	111.6	V525 C557 V563 G564 F566 F675	V525-F561 HydrophobicContact CG2-CE2 4.03Å; V525-F561 HydrophobicContact CG2-CZ 3.8Å; C557-F561 CarbonylContact O-C 3.42Å; C557-F561 VanDerWaalsContact O-CA 3.29Å; C557-F561 WeakPolarHBondContact O-CA 3.06Å; C557-F561 WeakPolarHBondContact O-CB 3.39Å; C557-F561 PolarHBondContact O-N 2.98Å; F561-V563 PolarHBondContact O-N 3.11Å; F561-G564 PolarHBondContact O-N 3.46Å; F561-F566 HydrophobicContact CB-CE2 4.42Å; F561-F675 HydrophobicContact CZ-CE2 4.37Å
562	P	30.5	Very low	36.7	Very low	108 Å²	108	94.1 Å²	94.1	70%	0.701	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	17.8	-175.2	28.7	-38	0	0	0	115.6
563	V	30	Very low	36.1	Very low	130 Å²	130	100.3 Å²	100.3	79%	0.788	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.2	47	179.3	-74.4	0	0	0	0	111.9	F561	F561-V563 PolarHBondContact O-N 3.11Å
564	G	29.1	Very low	35.2	Very low	37 Å²	37	105.7 Å²	105.7	38%	0.381	54%	0.535	S	S	.	.			trans	-174.5	128.8	169.2	0	0	0	0	0	115.8	F561	F561-G564 PolarHBondContact O-N 3.46Å
565	Y	29.9	Very low	34.5	Very low	180 Å²	180	108.4 Å²	108.4	71%	0.706	55%	0.545	S	S	*	.			trans	-92.7	125.5	165.4	-65.9	-71.9	0	0	0	110.2
566	F	29	Very low	33.5	Very low	63 Å²	63	111.7 Å²	111.7	28%	0.276	56%	0.562	S	S	.	*			trans	-101.2	134.6	177.4	-56.2	-66.6	0	0	0	110.6	C557 F561 L662 F675	C557-F566 HydrophobicContact CB-CD2 4.45Å; F561-F566 HydrophobicContact CB-CE2 4.42Å; F566-L662 HydrophobicContact CE1-CD2 4.3Å; F566-F675 HydrophobicContact CD1-CE1 4.04Å; F566-F675 AromaticContact CE1-CD1 3.88Å; F566-F675 HydrophobicContact CE1-CD1 3.88Å; F566-F675 AromaticContact CE1-CE1 3.34Å; F566-F675 HydrophobicContact CE1-CE1 3.34Å; F566-F675 HydrophobicContact CE1-CZ 4.25Å; F566-F675 HydrophobicContact CE2-CE1 4.38Å; F566-F675 HydrophobicContact CZ-CD1 4.34Å; F566-F675 AromaticContact CZ-CE1 3.54Å; F566-F675 HydrophobicContact CZ-CE1 3.54Å; F566-F675 HydrophobicContact CZ-CZ 4Å
567	W	30.7	Very low	32.4	Very low	140 Å²	140	113.5 Å²	113.5	53%	0.53	59%	0.593	S	S	.	*			trans	-128	115.8	-177.1	-53.2	87.7	0	0	0	109.6	S690	W567-S690 VanDerWaalsContact O-CB 3.25Å; W567-S690 WeakPolarHBondContact O-CB 3.45Å; W567-S690 PolarHBondContact O-OG 2.96Å
568	S	28.4	Very low	31.7	Very low	88 Å²	88	121.7 Å²	121.7	62%	0.615	62%	0.619	S	S	*	*			trans	-75.9	139.6	165.8	50.1	0	0	0	0	109.6
569	W	26.1	Very low	31	Very low	200 Å²	200	122.2 Å²	122.2	76%	0.758	63%	0.63	S	S	*	*			trans	-116.4	125.2	172.3	-174.9	68	0	0	0	109.4	P571	W569-P571 HydrophobicContact CE3-CG 4.31Å; W569-P571 HydrophobicContact CH2-CB 3.77Å; W569-P571 HydrophobicContact CH2-CG 3.85Å; W569-P571 HydrophobicContact CZ2-CB 4.16Å; W569-P571 HydrophobicContact CZ3-CB 4.19Å; W569-P571 HydrophobicContact CZ3-CG 3.73Å
570	I	26.4	Very low	30.3	Very low	115 Å²	115	124.3 Å²	124.3	59%	0.59	64%	0.636	S	S	*	*			trans	-112.3	130.5	170.1	-57.9	178.4	0	0	0	105.9
571	P	28.4	Very low	29.7	Very low	52 Å²	52	130.4 Å²	130.4	34%	0.338	66%	0.66	S	S	.	*			trans	-68.4	138.3	173.9	-9.8	23.8	0	0	0	110.6	W569 F573	W569-P571 HydrophobicContact CE3-CG 4.31Å; W569-P571 HydrophobicContact CH2-CB 3.77Å; W569-P571 HydrophobicContact CH2-CG 3.85Å; W569-P571 HydrophobicContact CZ2-CB 4.16Å; W569-P571 HydrophobicContact CZ3-CB 4.19Å; W569-P571 HydrophobicContact CZ3-CG 3.73Å; P571-F573 HydrophobicContact CB-CD2 4.28Å; P571-F573 HydrophobicContact CB-CE2 4.04Å; P571-F573 HydrophobicContact CG-CE2 4.1Å; P571-F573 WeakPolarHBondContact O-CD2 3.49Å; P571-F573 PolarHBondContact O-N 2.67Å
572	D	27.2	Very low	29.4	Very low	152 Å²	152	131.8 Å²	131.8	81%	0.813	68%	0.677	S	S	*	*			trans	-61.4	123.4	165.5	-59.9	-65.4	0	0	0	109.5
573	F	32.5	Very low	29.5	Very low	153 Å²	153	130 Å²	130	67%	0.671	67%	0.665	S	S	*	*			trans	-116.7	101.6	173	-85.3	-81.1	0	0	0	109.4	P571 E575	P571-F573 HydrophobicContact CB-CD2 4.28Å; P571-F573 HydrophobicContact CB-CE2 4.04Å; P571-F573 HydrophobicContact CG-CE2 4.1Å; P571-F573 WeakPolarHBondContact O-CD2 3.49Å; P571-F573 PolarHBondContact O-N 2.67Å; F573-E575 PolarHBondContact O-N 3.28Å
574	D	29.3	Very low	29.7	Very low	164 Å²	164	127.6 Å²	127.6	88%	0.877	65%	0.651	S	S	*	*			trans	-71.6	57.3	174.2	-77.1	-29	0	0	0	112.3
575	E	32.9	Very low	29.9	Very low	142 Å²	142	133 Å²	133	66%	0.664	66%	0.664	S	S	*	*			trans	-156.2	74.9	167.8	-128.6	177.9	-115.7	0	0	113.7	F573 G577	F573-E575 PolarHBondContact O-N 3.28Å; E575-G577 PolarHBondContact O-N 2.69Å
576	E	26.1	Very low	30.2	Very low	194 Å²	194	129.4 Å²	129.4	91%	0.907	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	130.2	162.6	-72.2	-169	131.7	0	0	110.4
577	G	28.2	Very low	30.4	Very low	78 Å²	78	130.2 Å²	130.2	80%	0.804	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	118.1	16.8	161.6	0	0	0	0	0	119.1	E575	E575-G577 PolarHBondContact O-N 2.69Å
578	R	28.4	Very low	30.6	Very low	204 Å²	204	131 Å²	131	77%	0.77	67%	0.67	S	S	*	*			trans	-143.2	21.6	178.4	-137.7	-179.2	-65.2	160.5	7.7	119.1
579	V	30.6	Very low	30.6	Very low	125 Å²	125	135.1 Å²	135.1	76%	0.758	68%	0.68	S	S	*	*			trans	-119	50.8	175.3	-161.1	0	0	0	0	112.3
580	E	29.1	Very low	30.7	Very low	159 Å²	159	133.5 Å²	133.5	74%	0.743	68%	0.678	S	S	*	*			trans	-81.3	172	158.5	-63.1	-167	135.1	0	0	110.9	S582	E580-S582 PolarHBondContact O-N 2.85Å
581	Q	30.9	Very low	30.7	Very low	193 Å²	193	131.7 Å²	131.7	90%	0.902	67%	0.672	S	S	*	*	S	Bend	trans	74.2	-3.4	159.7	-50.7	179.8	15.7	0	0	120.7
582	S	33	Very low	30.6	Very low	90 Å²	90	133.2 Å²	133.2	63%	0.629	68%	0.676	S	S	*	*			trans	-121.5	-3.4	-169.2	59.9	0	0	0	0	119.5	E580	E580-S582 PolarHBondContact O-N 2.85Å
583	V	32.9	Very low	30.6	Very low	72 Å²	72	132.3 Å²	132.3	44%	0.436	66%	0.662	S	S	.	*	S	Bend	trans	-120.4	128	-179.4	-173.8	0	0	0	0	111.7	W588	V583-W588 HydrophobicContact CG1-CZ2 4.42Å; V583-W588 VanDerWaalsContact CG1-NE1 3.35Å
584	P	35.3	Very low	30.2	Very low	78 Å²	78	127.7 Å²	127.7	51%	0.506	66%	0.658	S	S	.	*			trans	-61.4	140.3	177.7	-23.7	34.4	0	0	0	113.9	D586 V587	P584-D586 VanDerWaalsContact C-N 3.29Å; P584-D586 WeakPolarHBondContact CB-OD1 3.49Å; P584-D586 PolarHBondContact O-N 2.86Å; P584-V587 HydrophobicContact CB-CG2 4.35Å; P584-V587 PolarHBondContact O-N 3.24Å
585	K	32.4	Very low	30.2	Very low	152 Å²	152	124.7 Å²	124.7	66%	0.661	64%	0.637	S	S	*	*	H	α-helix	trans	-64.8	-29.9	-174.1	-71.3	-173.1	172	-175.2	0	113.2	V587 W588	K585-V587 PolarHBondContact O-N 3.4Å; K585-W588 PolarHBondContact O-N 3.3Å
586	D	36.6	Very low	29.9	Very low	103 Å²	103	119.9 Å²	119.9	55%	0.551	62%	0.621	S	S	*	*	H	α-helix	trans	-69.8	-9	-179.3	55.7	-70.7	0	0	0	115.4	P584 K590	P584-D586 VanDerWaalsContact C-N 3.29Å; P584-D586 WeakPolarHBondContact CB-OD1 3.49Å; P584-D586 PolarHBondContact O-N 2.86Å; D586-K590 PolarHBondContact O-NZ 3.11Å
587	V	34	Very low	30.1	Very low	81 Å²	81	114.2 Å²	114.2	49%	0.491	60%	0.597	S	S	.	*	H	α-helix	trans	-82.9	-37.2	173.8	-177.1	0	0	0	0	111.5	P584 K585	P584-V587 HydrophobicContact CB-CG2 4.35Å; P584-V587 PolarHBondContact O-N 3.24Å; K585-V587 PolarHBondContact O-N 3.4Å
588	W	34	Very low	30.2	Very low	157 Å²	157	114.2 Å²	114.2	60%	0.595	58%	0.578	S	S	*	*	H	α-helix	trans	-73.6	-32	-168	-72.2	94.5	0	0	0	114.4	V583 K585 K590 T591	V583-W588 HydrophobicContact CG1-CZ2 4.42Å; V583-W588 VanDerWaalsContact CG1-NE1 3.35Å; K585-W588 PolarHBondContact O-N 3.3Å; W588-K590 PolarHBondContact O-N 3.4Å; W588-K590 VanDerWaalsContact O-N 3.09Å; W588-T591 PolarHBondContact O-N 3.12Å; W588-T591 PolarHBondContact O-OG1 3.11Å
589	E	28	Very low	30.5	Very low	173 Å²	173	107.8 Å²	107.8	81%	0.808	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-8	-174	-61	-175.8	150.3	0	0	114.9
590	K	28.1	Very low	30.7	Very low	167 Å²	167	106.1 Å²	106.1	73%	0.726	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	3.5	-179.1	-64.1	176.5	-170	102.6	0	113.3	D586 W588 M592	D586-K590 PolarHBondContact O-NZ 3.11Å; W588-K590 PolarHBondContact O-N 3.4Å; W588-K590 VanDerWaalsContact O-N 3.09Å; K590-M592 PolarHBondContact O-N 3.05Å
591	T	27.6	Very low	31	Very low	77 Å²	77	100.8 Å²	100.8	47%	0.472	54%	0.541	S	S	.	.			trans	-86.8	107.5	-173.8	-34	0	0	0	0	110.9	W588	W588-T591 PolarHBondContact O-N 3.12Å; W588-T591 PolarHBondContact O-OG1 3.11Å
592	M	25	Very low	31	Very low	83 Å²	83	96.6 Å²	96.6	41%	0.409	53%	0.531	S	S	.	.			trans	-129.3	144.9	167.4	-58.2	-153.9	-43.8	0	0	110	V527 K534 K590	V527-M592 HydrophobicContact CG1-CE 3.71Å; K534-M592 HydrophobicContact CD-SD 3.87Å; K534-M592 PolarHBondContact NZ-SD 3.03Å; K590-M592 PolarHBondContact O-N 3.05Å
593	Y	28	Very low	31.2	Very low	133 Å²	133	99.9 Å²	99.9	52%	0.522	54%	0.541	S	S	.	.	S	Bend	cis	-151.7	143.2	-32.9	-107.7	-61	0	0	0	105.7	M549	M549-Y593 HydrophobicContact CE-CD2 4.34Å; M549-Y593 HydrophobicContact CE-CE1 4.41Å; M549-Y593 HydrophobicContact CE-CE2 4.1Å; M549-Y593 HydrophobicContact SD-CD1 4.12Å; M549-Y593 HydrophobicContact SD-CD2 3.65Å; M549-Y593 HydrophobicContact SD-CE1 4.45Å; M549-Y593 HydrophobicContact SD-CE2 4.02Å; M549-Y593 HydrophobicContact SD-CG 3.74Å
594	G	25.2	Very low	31.2	Very low	56 Å²	56	100.2 Å²	100.2	58%	0.577	54%	0.544	S	S	*	.	S	Bend	trans	-172.7	9.7	-179.4	0	0	0	0	0	113.9
595	F	27.4	Very low	30.9	Very low	101 Å²	101	101.2 Å²	101.2	44%	0.443	55%	0.552	S	S	.	*			trans	-160.6	158.6	172.9	77.7	-33.1	0	0	0	107.5	I597	F595-I597 HydrophobicContact CD2-CD1 4.09Å; F595-I597 HydrophobicContact CD2-CG1 3.97Å; F595-I597 HydrophobicContact CE2-CD1 3.39Å; F595-I597 HydrophobicContact CE2-CG1 3.68Å; F595-I597 HydrophobicContact CZ-CD1 4.07Å; F595-I597 HydrophobicContact CZ-CG1 4.33Å
596	A	26.6	Very low	30.9	Very low	41 Å²	41	97.5 Å²	97.5	34%	0.339	54%	0.544	S	S	.	.			trans	-117.6	119.7	170.4	0	0	0	0	0	108.9
597	I	30.2	Very low	30.5	Very low	76 Å²	76	96.7 Å²	96.7	39%	0.39	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	132.8	166.1	-80.4	-173.3	0	0	0	108.3	F595 C599 C606	F595-I597 HydrophobicContact CD2-CD1 4.09Å; F595-I597 HydrophobicContact CD2-CG1 3.97Å; F595-I597 HydrophobicContact CE2-CD1 3.39Å; F595-I597 HydrophobicContact CE2-CG1 3.68Å; F595-I597 HydrophobicContact CZ-CD1 4.07Å; F595-I597 HydrophobicContact CZ-CG1 4.33Å; I597-C599 WeakPolarHBondContact CG2-SG 3.35Å; I597-C606 HydrophobicContact CG2-CB 3.67Å
598	L	31.6	Very low	30.3	Very low	77 Å²	77	96.9 Å²	96.9	40%	0.403	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	113	169.1	-78.8	166.9	0	0	0	109.2	C606 V607	L598-C606 CarbonylContact O-C 3.57Å; L598-C606 VanDerWaalsContact O-CA 3.26Å; L598-C606 WeakPolarHBondContact O-CA 3.07Å; L598-V607 PolarHBondContact N-O 3.09Å; L598-V607 PolarHBondContact O-N 2.99Å
599	C	34.3	Very low	30	Very low	70 Å²	70	95.3 Å²	95.3	47%	0.473	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.5	118	167.5	-56.5	0	0	0	0	109	I597 G601 C606	I597-C599 WeakPolarHBondContact CG2-SG 3.35Å; C599-G601 PolarHBondContact O-N 2.99Å; C599-G601 VanDerWaalsContact O-N 3.08Å; C599-C606 HydrophobicContact CB-CB 4.14Å; C599-C606 WeakPolarHBondContact CB-SG 3.24Å; C599-C606 WeakPolarHBondContact SG-CB 3.29Å; C599-C606 CovalentContact SG-SG 2.04Å; C599-C606 PolarHBondContact SG-SG 2.83Å
600	T	34.3	Very low	30	Very low	90 Å²	90	96.4 Å²	96.4	55%	0.552	55%	0.547	S	S	*	.			trans	-89.6	67.3	-171.6	41.4	0	0	0	0	113.1	V604	T600-V604 WeakPolarHBondContact O-CG2 3.46Å; T600-V604 VanDerWaalsContact OG1-CG1 3.28Å; T600-V604 WeakPolarHBondContact OG1-CG1 3.34Å
601	G	35	Very low	30	Very low	47 Å²	47	93 Å²	93	49%	0.485	54%	0.544	S	S	.	.	S	Bend	trans	88.8	-171.4	173.8	0	0	0	0	0	114.3	C599 N603	C599-G601 PolarHBondContact O-N 2.99Å; C599-G601 VanDerWaalsContact O-N 3.08Å; G601-N603 VanDerWaalsContact C-N 3.3Å; G601-N603 PolarHBondContact O-N 3.12Å; G601-N603 VanDerWaalsContact O-N 3.17Å
602	P	32.6	Very low	29.9	Very low	105 Å²	105	95.6 Å²	95.6	68%	0.682	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-10.3	-158.6	27	-35.4	0	0	0	116.5
603	N	36.5	Very low	29.9	Very low	158 Å²	158	101.2 Å²	101.2	85%	0.845	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.1	21.1	-169.8	-83.7	5.5	0	0	0	113.7	G601	G601-N603 VanDerWaalsContact C-N 3.3Å; G601-N603 PolarHBondContact O-N 3.12Å; G601-N603 VanDerWaalsContact O-N 3.17Å
604	V	33.6	Very low	29.8	Very low	80 Å²	80	100 Å²	100	49%	0.485	58%	0.583	S	S	.	*	S	Bend	trans	-128.5	146.1	-175.6	-169.1	0	0	0	0	111.5	T600	T600-V604 WeakPolarHBondContact O-CG2 3.46Å; T600-V604 VanDerWaalsContact OG1-CG1 3.28Å; T600-V604 WeakPolarHBondContact OG1-CG1 3.34Å
605	S	28.7	Very low	29.8	Very low	98 Å²	98	102 Å²	102	69%	0.685	58%	0.58	S	S	*	*			trans	-57.3	146.5	-178.8	33.5	0	0	0	0	113.5
606	C	30.9	Very low	29.7	Very low	74 Å²	74	104.2 Å²	104.2	50%	0.5	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.3	137.2	-180	-59.2	0	0	0	0	110.9	I597 L598 C599	I597-C606 HydrophobicContact CG2-CB 3.67Å; L598-C606 CarbonylContact O-C 3.57Å; L598-C606 VanDerWaalsContact O-CA 3.26Å; L598-C606 WeakPolarHBondContact O-CA 3.07Å; C599-C606 HydrophobicContact CB-CB 4.14Å; C599-C606 WeakPolarHBondContact CB-SG 3.24Å; C599-C606 WeakPolarHBondContact SG-CB 3.29Å; C599-C606 CovalentContact SG-SG 2.04Å; C599-C606 PolarHBondContact SG-SG 2.83Å
607	V	28.5	Very low	29.7	Very low	87 Å²	87	108.8 Å²	108.8	53%	0.527	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105	135.6	177.5	-179.2	0	0	0	0	110.2	L598	L598-V607 PolarHBondContact N-O 3.09Å; L598-V607 PolarHBondContact O-N 2.99Å
608	S	29.9	Very low	29.4	Very low	84 Å²	84	112.7 Å²	112.7	59%	0.587	63%	0.628	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.9	146.8	168.9	73	0	0	0	0	110.9
609	L	28.8	Very low	29.3	Very low	124 Å²	124	110.3 Å²	110.3	65%	0.649	62%	0.623	S	S	*	*			trans	-121	133.7	174.5	-74.8	169.7	0	0	0	109.8
610	R	27.8	Very low	29.1	Very low	196 Å²	196	117.5 Å²	117.5	74%	0.74	64%	0.64	S	S	*	*			trans	-90.6	125.1	-170.1	-164.3	-173.2	-156.5	-176.3	7.9	110.9
611	S	28	Very low	29.4	Very low	95 Å²	95	118.9 Å²	118.9	66%	0.664	64%	0.64	S	S	*	*			trans	-80.4	126.2	165.7	179.9	0	0	0	0	110.1	R613	S611-R613 PolarHBondContact O-N 3.3Å; S611-R613 VanDerWaalsContact O-N 3.1Å
612	N	25.3	Very low	29.3	Very low	132 Å²	132	120.4 Å²	120.4	71%	0.706	64%	0.642	S	S	*	*			trans	-82.2	29.6	-176.5	-85	-12.1	0	0	0	114.1
613	R	25.6	Very low	29.5	Very low	201 Å²	201	122.1 Å²	122.1	76%	0.758	64%	0.64	S	S	*	*			trans	-114.3	78.8	179.9	-65.8	-172.2	-177.2	176	3.9	111.8	S611	S611-R613 PolarHBondContact O-N 3.3Å; S611-R613 VanDerWaalsContact O-N 3.1Å
614	S	25	Very low	29.5	Very low	109 Å²	109	116.1 Å²	116.1	76%	0.762	61%	0.61	S	S	*	*			trans	-126.3	123.7	171.1	54.4	0	0	0	0	111.3
615	I	26.2	Very low	29.6	Very low	97 Å²	97	118.5 Å²	118.5	50%	0.497	61%	0.611	S	S	.	*			trans	-123	132.2	-178.5	-69.7	162.1	0	0	0	109	E700	I615-E700 WeakPolarHBondContact CD1-OE2 3.42Å; I615-E700 WeakPolarHBondContact CG2-OE1 3.3Å
616	I	24.8	Very low	30	Very low	148 Å²	148	120.2 Å²	120.2	76%	0.759	61%	0.612	S	S	*	*			trans	-97.2	117.8	-173.8	-59.3	172.2	0	0	0	109.4	Q618	I616-Q618 HydrophobicContact CG2-CG 4.31Å; I616-Q618 PolarHBondContact O-N 2.92Å
617	I	25.5	Very low	30.5	Very low	137 Å²	137	123 Å²	123	70%	0.703	62%	0.616	S	S	*	*			trans	-84.8	96.9	174.1	-54.9	177.4	0	0	0	109.6
618	Q	24.7	Very low	31	Very low	157 Å²	157	119.6 Å²	119.6	73%	0.734	60%	0.595	S	S	*	*			trans	-88.6	117.6	163	-78	-174.5	-31.6	0	0	110.2	I616	I616-Q618 HydrophobicContact CG2-CG 4.31Å; I616-Q618 PolarHBondContact O-N 2.92Å
619	G	29.2	Very low	31.5	Very low	28 Å²	28	123.1 Å²	123.1	29%	0.289	60%	0.6	S	S	.	*			trans	-75.8	167.9	169.6	0	0	0	0	0	112.5	H621	G619-H621 PolarHBondContact O-N 2.8Å
620	R	31.1	Very low	31.8	Very low	221 Å²	221	121 Å²	121	83%	0.834	59%	0.594	S	S	*	*	S	Bend	trans	-59.4	-13.6	-173.3	-137	178.2	-162.1	163	2.9	115.8
621	H	39.9	Very low	32.3	Very low	118 Å²	118	116.6 Å²	116.6	55%	0.546	59%	0.585	S	S	.	*			trans	-137.3	90.7	-179.3	-61.7	107.9	0	0	0	109.7	G619 E623 T624	G619-H621 PolarHBondContact O-N 2.8Å; H621-E623 VanDerWaalsContact C-N 3.31Å; H621-E623 PolarHBondContact O-N 3.39Å; H621-T624 VanDerWaalsContact CB-OG1 3.3Å; H621-T624 WeakPolarHBondContact CB-OG1 3.38Å; H621-T624 VanDerWaalsContact O-CB 3.3Å; H621-T624 WeakPolarHBondContact O-CB 3.28Å; H621-T624 PolarHBondContact O-N 2.81Å; H621-T624 VanDerWaalsContact O-N 3.12Å; H621-T624 PolarHBondContact O-OG1 3.41Å
622	P	31.8	Very low	32.5	Very low	80 Å²	80	118 Å²	118	52%	0.519	59%	0.591	S	S	.	*	G	3₁₀ helix	trans	-53	-44.7	-174.7	-29.2	36.3	0	0	0	113.7	T624 Y625	P622-T624 PolarHBondContact O-N 3.26Å; P622-Y625 PolarHBondContact O-N 2.82Å; P622-Y625 VanDerWaalsContact O-N 3.11Å
623	E	38.7	Very low	32.8	Very low	140 Å²	140	122.8 Å²	122.8	65%	0.654	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-58	-3.7	179.2	-58.2	175	-132.4	0	0	115.8	H621 D626 K627	H621-E623 VanDerWaalsContact C-N 3.31Å; H621-E623 PolarHBondContact O-N 3.39Å; E623-D626 WeakPolarHBondContact CA-OD2 3.07Å; E623-K627 WeakPolarHBondContact O-CD 3.43Å; E623-K627 WeakPolarHBondContact O-CE 3.4Å; E623-K627 PolarHBondContact O-NZ 2.72Å
624	T	34.9	Very low	33	Very low	33 Å²	33	125.4 Å²	125.4	20%	0.202	61%	0.609	C	S	.	*	G	3₁₀ helix	trans	-79	-31.7	177.1	-46.2	0	0	0	0	111.1	H621 P622 F648	H621-T624 VanDerWaalsContact CB-OG1 3.3Å; H621-T624 WeakPolarHBondContact CB-OG1 3.38Å; H621-T624 VanDerWaalsContact O-CB 3.3Å; H621-T624 WeakPolarHBondContact O-CB 3.28Å; H621-T624 PolarHBondContact O-N 2.81Å; H621-T624 VanDerWaalsContact O-N 3.12Å; H621-T624 PolarHBondContact O-OG1 3.41Å; P622-T624 PolarHBondContact O-N 3.26Å; T624-F648 HydrophobicContact CG2-CE1 3.86Å; T624-F648 HydrophobicContact CG2-CZ 4.05Å
625	Y	35.3	Very low	33.4	Very low	129 Å²	129	127.3 Å²	127.3	51%	0.506	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-80.5	-28.2	-176.6	-71.7	-86.4	0	0	0	113.1	P622 K627 C628	P622-Y625 PolarHBondContact O-N 2.82Å; P622-Y625 VanDerWaalsContact O-N 3.11Å; Y625-K627 PolarHBondContact O-N 2.8Å; Y625-K627 VanDerWaalsContact O-N 3.11Å; Y625-C628 PolarHBondContact O-N 2.78Å
626	D	39.1	Very low	33.5	Very low	134 Å²	134	131.9 Å²	131.9	72%	0.717	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-65.9	-12.5	178.7	-55.3	-47.3	0	0	0	113.5	E623	E623-D626 WeakPolarHBondContact CA-OD2 3.07Å
627	K	40.4	Very low	33.8	Very low	134 Å²	134	130.9 Å²	130.9	58%	0.583	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-89.9	-9.1	-176.8	-68.8	162.6	-175.5	138.2	0	113.5	E623 Y625 K629	E623-K627 WeakPolarHBondContact O-CD 3.43Å; E623-K627 WeakPolarHBondContact O-CE 3.4Å; E623-K627 PolarHBondContact O-NZ 2.72Å; Y625-K627 PolarHBondContact O-N 2.8Å; Y625-K627 VanDerWaalsContact O-N 3.11Å; K627-K629 PolarHBondContact O-N 3.47Å
628	C	39.6	Very low	33.8	Very low	14 Å²	14	130.7 Å²	130.7	10%	0.095	62%	0.621	C	S	.	*			trans	-83.4	102.5	175.3	-66.8	0	0	0	0	112	Y625 C645	Y625-C628 PolarHBondContact O-N 2.78Å; C628-C645 HydrophobicContact CB-CB 4.24Å; C628-C645 WeakPolarHBondContact CB-SG 3.11Å; C628-C645 VanDerWaalsContact SG-CA 3.57Å; C628-C645 WeakPolarHBondContact SG-CB 3.34Å; C628-C645 CovalentContact SG-SG 2.04Å; C628-C645 PolarHBondContact SG-SG 3.17Å
629	K	39.2	Very low	33.9	Very low	159 Å²	159	129.9 Å²	129.9	69%	0.691	62%	0.617	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-76.2	143.9	-177.1	-64.2	-170.4	176.4	-172	0	112.9	K627 N644	K627-K629 PolarHBondContact O-N 3.47Å; K629-N644 PolarHBondContact O-N 3.17Å
630	P	36.6	Very low	33.9	Very low	79 Å²	79	137 Å²	137	51%	0.513	64%	0.637	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.3	144.2	166.5	30.4	-34	0	0	0	110.5	Y641	P630-Y641 HydrophobicContact CB-CD1 4.32Å
631	L	36.7	Very low	33.7	Very low	104 Å²	104	134.6 Å²	134.6	55%	0.545	63%	0.629	S	S	.	*			trans	-111.3	112.7	172	-76.1	-179.2	0	0	0	110.9	R633 R642 N644	L631-R633 PolarHBondContact O-N 3.16Å; L631-R642 PolarHBondContact N-O 2.96Å; L631-N644 HydrophobicContact CD1-CB 3.72Å; L631-N644 HydrophobicContact CG-CB 3.93Å
632	P	33.7	Very low	33.4	Very low	124 Å²	124	136.3 Å²	136.3	81%	0.805	63%	0.63	S	S	*	*			trans	-74.2	124	172.7	29.7	-32.6	0	0	0	110.5
633	R	31.8	Very low	33.4	Very low	233 Å²	233	141 Å²	141	88%	0.879	64%	0.638	S	S	*	*			trans	-127	111	164.8	-95.3	-169	169.8	-165.5	-2.4	109.6	L631 I635	L631-R633 PolarHBondContact O-N 3.16Å; R633-I635 PolarHBondContact O-N 3.42Å; R633-I635 VanDerWaalsContact O-N 3.14Å
634	R	29.7	Very low	33.4	Very low	256 Å²	256	137.3 Å²	137.3	97%	0.966	62%	0.623	S	S	*	*			trans	-70.2	105.4	175	-70.4	-176.5	175.4	-174.6	-1.5	110.6
635	I	31.8	Very low	33.6	Very low	148 Å²	148	138.5 Å²	138.5	76%	0.759	63%	0.631	S	S	*	*			trans	-115.5	146.2	150	-60.2	179.9	0	0	0	105.4	R633	R633-I635 PolarHBondContact O-N 3.42Å; R633-I635 VanDerWaalsContact O-N 3.14Å
636	K	28.4	Very low	33.8	Very low	193 Å²	193	137 Å²	137	84%	0.839	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	150.4	-169.4	-65.4	-178.4	178.7	-179.7	0	111.6	F638	K636-F638 PolarHBondContact O-N 2.87Å
637	T	32	Very low	33.7	Very low	127 Å²	127	134.9 Å²	134.9	78%	0.779	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	73.8	-12.6	171.3	71.5	0	0	0	0	121.1
638	F	25.9	Very low	33.5	Very low	134 Å²	134	133.4 Å²	133.4	59%	0.588	64%	0.635	S	S	*	*			trans	-145.1	136.2	172.1	-66.1	-78.9	0	0	0	113.4	K636 Y640	K636-F638 PolarHBondContact O-N 2.87Å; F638-Y640 HydrophobicContact CB-CD2 4.34Å; F638-Y640 HydrophobicContact CB-CE1 4.26Å; F638-Y640 HydrophobicContact CB-CE2 3.53Å; F638-Y640 VanDerWaalsContact CB-CZ 3.48Å; F638-Y640 WeakPolarHBondContact CB-OH 3.48Å; F638-Y640 HydrophobicContact CG-CE2 4.5Å; F638-Y640 WeakPolarHBondContact CG-OH 3.38Å
639	E	26.9	Very low	33.3	Very low	139 Å²	139	143.2 Å²	143.2	65%	0.65	67%	0.67	S	S	*	*			trans	-96.9	128.8	170.5	-65.9	-155.8	146.4	0	0	111.4	Y641	E639-Y641 HydrophobicContact CB-CE2 4.37Å; E639-Y641 PolarHBondContact OE2-OH 3.2Å
640	Y	29.1	Very low	33	Very low	178 Å²	178	147.1 Å²	147.1	70%	0.698	68%	0.68	S	S	*	*			trans	-128.8	116.9	176.3	-53.7	-74.3	0	0	0	110.5	F638 R642	F638-Y640 HydrophobicContact CB-CD2 4.34Å; F638-Y640 HydrophobicContact CB-CE1 4.26Å; F638-Y640 HydrophobicContact CB-CE2 3.53Å; F638-Y640 VanDerWaalsContact CB-CZ 3.48Å; F638-Y640 WeakPolarHBondContact CB-OH 3.48Å; F638-Y640 HydrophobicContact CG-CE2 4.5Å; F638-Y640 WeakPolarHBondContact CG-OH 3.38Å; Y640-R642 PolarHBondContact O-N 2.81Å
641	Y	27.1	Very low	32.8	Very low	170 Å²	170	145.6 Å²	145.6	67%	0.667	68%	0.678	S	S	*	*			trans	-80	84	-174.3	-73.9	-90.2	0	0	0	112.9	P630 E639 R643	P630-Y641 HydrophobicContact CB-CD1 4.32Å; E639-Y641 HydrophobicContact CB-CE2 4.37Å; E639-Y641 PolarHBondContact OE2-OH 3.2Å; Y641-R643 PolarHBondContact O-N 3.17Å
642	R	31.8	Very low	32.5	Very low	155 Å²	155	145.9 Å²	145.9	59%	0.585	68%	0.676	S	S	*	*			trans	-76.4	101.5	169.4	-160.1	178.3	-163	176.3	8.7	110.2	L631 Y640 N644	L631-R642 PolarHBondContact N-O 2.96Å; Y640-R642 PolarHBondContact O-N 2.81Å; R642-N644 PolarHBondContact O-N 3.13Å
643	R	33.7	Very low	32.5	Very low	178 Å²	178	145.3 Å²	145.3	67%	0.672	67%	0.665	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-61.3	123.8	167	-68.7	-169	-175.4	-151.4	3.6	108.9	Y641	Y641-R643 PolarHBondContact O-N 3.17Å
644	N	37.7	Very low	32.6	Very low	63 Å²	63	141 Å²	141	34%	0.337	66%	0.659	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.1	112.4	173.9	-175.4	23.1	0	0	0	110.9	K629 L631 R642 S646	K629-N644 PolarHBondContact O-N 3.17Å; L631-N644 HydrophobicContact CD1-CB 3.72Å; L631-N644 HydrophobicContact CG-CB 3.93Å; R642-N644 PolarHBondContact O-N 3.13Å; N644-S646 PolarHBondContact ND2-OG 3.27Å; N644-S646 WeakPolarHBondContact OD1-CB 3.26Å; N644-S646 PolarHBondContact OD1-N 3.1Å; N644-S646 PolarHBondContact OD1-OG 2.79Å
645	C	40.1	Very low	32.8	Very low	57 Å²	57	136.1 Å²	136.1	39%	0.385	65%	0.652	S	S	.	*			trans	-100.7	15.9	175.9	-63.5	0	0	0	0	113.3	C628 A647 F648	C628-C645 HydrophobicContact CB-CB 4.24Å; C628-C645 WeakPolarHBondContact CB-SG 3.11Å; C628-C645 VanDerWaalsContact SG-CA 3.57Å; C628-C645 WeakPolarHBondContact SG-CB 3.34Å; C628-C645 CovalentContact SG-SG 2.04Å; C628-C645 PolarHBondContact SG-SG 3.17Å; C645-A647 PolarHBondContact O-N 2.94Å; C645-F648 HydrophobicContact CB-CD2 4.13Å; C645-F648 HydrophobicContact CB-CE2 3.82Å; C645-F648 WeakPolarHBondContact O-CD2 3.24Å
646	S	38.2	Very low	32.8	Very low	97 Å²	97	134.4 Å²	134.4	68%	0.678	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	12	-176.6	77.1	0	0	0	0	116	N644	N644-S646 PolarHBondContact ND2-OG 3.27Å; N644-S646 WeakPolarHBondContact OD1-CB 3.26Å; N644-S646 PolarHBondContact OD1-N 3.1Å; N644-S646 PolarHBondContact OD1-OG 2.79Å
647	A	37.4	Very low	32.7	Very low	91 Å²	91	128.8 Å²	128.8	75%	0.752	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-11.6	179.4	0	0	0	0	0	113.5	C645 R649	C645-A647 PolarHBondContact O-N 2.94Å; A647-R649 PolarHBondContact O-N 3.32Å
648	F	36.8	Very low	32.5	Very low	102 Å²	102	130.5 Å²	130.5	45%	0.447	63%	0.63	S	S	.	*			trans	-66.2	123.9	-179.5	-68.4	-60.1	0	0	0	112	T624 C645	T624-F648 HydrophobicContact CG2-CE1 3.86Å; T624-F648 HydrophobicContact CG2-CZ 4.05Å; C645-F648 HydrophobicContact CB-CD2 4.13Å; C645-F648 HydrophobicContact CB-CE2 3.82Å; C645-F648 WeakPolarHBondContact O-CD2 3.24Å
649	R	34.7	Very low	33.1	Very low	220 Å²	220	127.5 Å²	127.5	83%	0.83	62%	0.617	S	S	*	*			trans	-67.6	141.7	174.4	-77.7	-175.9	170.4	-172.4	-1.9	110.3	A647 G651 F652	A647-R649 PolarHBondContact O-N 3.32Å; R649-G651 PolarHBondContact O-N 2.94Å; R649-F652 PolarHBondContact O-N 2.78Å
650	R	32.9	Very low	33.5	Very low	242 Å²	242	125.6 Å²	125.6	91%	0.913	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	-13.2	-176.7	-69.3	-178.2	177.4	168	-1.4	116.4
651	G	32.4	Very low	33.9	Very low	46 Å²	46	123.7 Å²	123.7	47%	0.474	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.2	-19.4	176.7	0	0	0	0	0	115.1	R649 L653	R649-G651 PolarHBondContact O-N 2.94Å; G651-L653 PolarHBondContact O-N 3.07Å
652	F	29.7	Very low	34.5	Very low	111 Å²	111	118.3 Å²	118.3	49%	0.487	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.8	-11.9	-173.4	-164.9	-97.7	0	0	0	114	R649	R649-F652 PolarHBondContact O-N 2.78Å
653	L	33.6	Very low	35	Very low	112 Å²	112	111 Å²	111	59%	0.586	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	8.2	-175.1	-62.9	170.8	0	0	0	113.8	G651 V657	G651-L653 PolarHBondContact O-N 3.07Å; L653-V657 HydrophobicContact CB-CG2 4.19Å; L653-V657 HydrophobicContact CD2-CG2 3.87Å
654	L	35.6	Very low	35.5	Very low	142 Å²	142	104 Å²	104	74%	0.743	53%	0.531	S	S	*	.	S	Bend	trans	-96.9	-23.1	-173.1	-78.2	162.5	0	0	0	114.5
655	D	33.9	Very low	35.9	Very low	153 Å²	153	101.6 Å²	101.6	82%	0.818	52%	0.518	S	S	*	.	S	Bend	trans	-113.1	-3.7	-170.7	-56.7	-50.6	0	0	0	114.3
656	D	30.5	Very low	36.1	Very low	112 Å²	112	100.5 Å²	100.5	60%	0.599	51%	0.51	S	S	*	.	S	Bend	trans	-143.3	16.3	-167.8	-133.1	-3.1	0	0	0	113.6
657	V	27.7	Very low	36.6	Very low	75 Å²	75	97.2 Å²	97.2	46%	0.455	48%	0.484	S	S	.	.			trans	-135.1	73.1	-166.7	-165.3	0	0	0	0	113.8	L653	L653-V657 HydrophobicContact CB-CG2 4.19Å; L653-V657 HydrophobicContact CD2-CG2 3.87Å
658	D	27.9	Very low	36.6	Very low	163 Å²	163	98.2 Å²	98.2	87%	0.872	48%	0.476	S	S	*	.			trans	-108.3	30.9	173.6	-138.7	9.4	0	0	0	112
659	K	36.5	Very low	37.1	Very low	71 Å²	71	102.4 Å²	102.4	31%	0.309	50%	0.497	S	S	.	.			trans	-133.4	117.5	-170.5	-60.1	-152.4	-178.1	-163.3	0	111.4	H693 E694 G695	K659-H693 WeakPolarHBondContact CD-NE2 3.15Å; K659-E694 WeakPolarHBondContact CA-O 3.5Å; K659-E694 WeakPolarHBondContact CB-O 3.1Å; K659-E694 WeakPolarHBondContact CG-O 3.06Å; K659-G695 PolarHBondContact NZ-O 2.83Å
660	H	35.7	Very low	37.7	Very low	100 Å²	100	96.3 Å²	96.3	46%	0.463	48%	0.478	S	S	.	.			trans	-88.9	135.4	178.7	-66.3	-16.3	0	0	0	111.6	E694	H660-E694 HydrophobicContact CB-CB 4.34Å; H660-E694 HydrophobicContact CB-CG 4.39Å; H660-E694 WeakPolarHBondContact CB-OE2 3.26Å; H660-E694 IonicContact CD2-OE2 3.73Å; H660-E694 PolarHBondContact CD2-OE2 3.39Å; H660-E694 IonicContact CG-OE2 3.64Å; H660-E694 PolarHBondContact O-N 3.4Å
661	Y	39	Very low	38.2	Very low	138 Å²	138	94.7 Å²	94.7	54%	0.541	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	125.8	174	-61.5	-87.4	0	0	0	110.6	A678	Y661-A678 VanDerWaalsContact CB-CB 3.45Å; Y661-A678 HydrophobicContact CG-CB 4.33Å; Y661-A678 PolarHBondContact O-N 3.1Å
662	L	39.1	Very low	38.5	Very low	57 Å²	57	92.8 Å²	92.8	30%	0.298	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	116.7	176.2	-165.7	79.9	0	0	0	109.3	F566 F675 T676 C691 G692	F566-L662 HydrophobicContact CE1-CD2 4.3Å; L662-F675 HydrophobicContact CD2-CB 4.36Å; L662-F675 HydrophobicContact CD2-CD1 4.13Å; L662-T676 CarbonylContact C-O 3.45Å; L662-T676 WeakPolarHBondContact CA-O 3.4Å; L662-C691 CarbonylContact O-C 3.47Å; L662-C691 WeakPolarHBondContact O-CA 3.48Å; L662-G692 PolarHBondContact N-O 3.12Å; L662-G692 PolarHBondContact O-N 2.99Å
663	C	42.7	Very low	39.1	Very low	1 Å²	1	90.3 Å²	90.3	1%	0.007	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	130.4	168.4	-62.7	0	0	0	0	110.6	L665 F675 T676 C681 V689 S690	C663-L665 HydrophobicContact CB-CD2 4.32Å; C663-L665 HydrophobicContact CB-CG 4.45Å; C663-F675 CarbonylContact O-C 3.58Å; C663-F675 WeakPolarHBondContact O-CA 3.21Å; C663-T676 HydrophobicContact CB-CG2 3.96Å; C663-T676 PolarHBondContact N-O 3.14Å; C663-T676 PolarHBondContact O-N 2.91Å; C663-C681 HydrophobicContact CB-CB 4.28Å; C663-C681 WeakPolarHBondContact CB-SG 3.33Å; C663-C681 WeakPolarHBondContact SG-CB 3.36Å; C663-C681 CovalentContact SG-SG 2.03Å; C663-C681 PolarHBondContact SG-SG 3.28Å; C663-V689 HydrophobicContact CB-CG1 4.03Å; C663-S690 CarbonylContact C-O 3.51Å; C663-S690 WeakPolarHBondContact CA-O 3.46Å
664	L	43	Very low	39.5	Very low	30 Å²	30	89 Å²	89	16%	0.157	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	128	150.4	175.6	72.6	0	0	0	108.3	L673 W674 F675 V689 S690	L664-L673 HydrophobicContact CD1-CB 4.06Å; L664-L673 HydrophobicContact CD1-CD2 3.95Å; L664-L673 HydrophobicContact CD2-CD2 4.34Å; L664-L673 HydrophobicContact CG-CD2 4.49Å; L664-W674 CarbonylContact C-O 3.53Å; L664-W674 WeakPolarHBondContact CA-O 3.42Å; L664-F675 HydrophobicContact CB-CD1 4.49Å; L664-F675 HydrophobicContact CB-CE1 4.47Å; L664-F675 HydrophobicContact CD1-CD1 3.96Å; L664-F675 HydrophobicContact CD1-CE1 3.52Å; L664-F675 HydrophobicContact CD1-CZ 4Å; L664-V689 WeakPolarHBondContact O-CA 3.22Å; L664-S690 PolarHBondContact N-O 3.17Å; L664-S690 PolarHBondContact O-N 2.98Å
665	L	46.6	Very low	39.9	Very low	13 Å²	13	83.3 Å²	83.3	7%	0.068	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.7	173.5	-62.7	178.1	0	0	0	109.4	C663 W674 T676 Y686 V689	C663-L665 HydrophobicContact CB-CD2 4.32Å; C663-L665 HydrophobicContact CB-CG 4.45Å; L665-W674 HydrophobicContact CB-CB 4.08Å; L665-W674 PolarHBondContact N-O 3.45Å; L665-W674 PolarHBondContact O-N 2.95Å; L665-T676 HydrophobicContact CD1-CG2 3.64Å; L665-T676 HydrophobicContact CG-CG2 4.05Å; L665-Y686 HydrophobicContact CD2-CD1 3.94Å; L665-Y686 HydrophobicContact CD2-CG 4.01Å; L665-V689 HydrophobicContact CD2-CB 4.5Å; L665-V689 HydrophobicContact CD2-CG1 4.24Å; L665-V689 HydrophobicContact CD2-CG2 3.9Å
666	V	44.5	Very low	40.4	Very low	35 Å²	35	77.5 Å²	77.5	21%	0.212	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	115.8	170.9	-176.5	0	0	0	0	109	L668 L673 T687 L688	V666-L668 HydrophobicContact CG1-CD2 4.01Å; V666-L673 HydrophobicContact CG2-CD2 4.22Å; V666-T687 PolarHBondContact O-N 3.07Å; V666-L688 HydrophobicContact CB-CB 4.2Å; V666-L688 HydrophobicContact CG2-CB 4.01Å; V666-L688 PolarHBondContact N-O 3.22Å
667	I	48	Very low	40.9	Very low	27 Å²	27	74.8 Å²	74.8	14%	0.138	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	97.6	175.3	-53.5	-169	0	0	0	108.7	E669 E670 R671 S672 W674	I667-E669 VanDerWaalsContact C-N 3.28Å; I667-E669 HydrophobicContact CG2-CB 4.48Å; I667-E669 PolarHBondContact O-N 3.29Å; I667-E670 HydrophobicContact CG2-CB 4.15Å; I667-E670 HydrophobicContact CG2-CG 3.9Å; I667-E670 PolarHBondContact O-N 2.97Å; I667-R671 PolarHBondContact O-N 2.83Å; I667-S672 PolarHBondContact N-O 3.32Å; I667-W674 HydrophobicContact CD1-CD2 4.25Å; I667-W674 HydrophobicContact CD1-CG 4.04Å; I667-W674 HydrophobicContact CG1-CG 4.39Å
668	L	38.8	Very low	41.5	Very low	112 Å²	112	72.5 Å²	72.5	59%	0.586	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-61.4	-34	-176.2	-67	-179.6	0	0	0	113.2	V666 E670 R671 T687	V666-L668 HydrophobicContact CG1-CD2 4.01Å; L668-E670 VanDerWaalsContact C-N 3.29Å; L668-E670 PolarHBondContact O-N 2.05Å; L668-R671 PolarHBondContact O-N 3.31Å; L668-T687 HydrophobicContact CD1-CG2 3.73Å; L668-T687 WeakPolarHBondContact CD1-OG1 3.49Å
669	E	46.8	Very low	42.2	Very low	190 Å²	190	71.1 Å²	71.1	89%	0.888	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-64	-32.9	179.9	-62	-177.1	170.4	0	0	112.6	I667	I667-E669 VanDerWaalsContact C-N 3.28Å; I667-E669 HydrophobicContact CG2-CB 4.48Å; I667-E669 PolarHBondContact O-N 3.29Å
670	E	47	Very low	42.6	Very low	92 Å²	92	73.8 Å²	73.8	43%	0.43	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-99	-5.1	-176.4	-64.5	-167.6	160.1	0	0	114.4	K524 I667 L668 S672 W674	K524-E670 IonicContact NZ-OE2 2.62Å; I667-E670 HydrophobicContact CG2-CB 4.15Å; I667-E670 HydrophobicContact CG2-CG 3.9Å; I667-E670 PolarHBondContact O-N 2.97Å; L668-E670 VanDerWaalsContact C-N 3.29Å; L668-E670 PolarHBondContact O-N 2.05Å; E670-S672 VanDerWaalsContact C-N 3.3Å; E670-S672 VanDerWaalsContact CB-OG 3.29Å; E670-S672 WeakPolarHBondContact CB-OG 3.18Å; E670-S672 PolarHBondContact O-N 2.83Å; E670-S672 PolarHBondContact OE2-OG 2.57Å; E670-W674 WeakPolarHBondContact OE2-CZ2 3.43Å; E670-W674 PolarHBondContact OE2-NE1 2.96Å
671	R	43.7	Very low	42.9	Very low	208 Å²	208	69.7 Å²	69.7	79%	0.785	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	44.3	-170.1	-57.2	-176.9	178.1	-169.9	-1.1	113.3	I667 L668	I667-R671 PolarHBondContact O-N 2.83Å; L668-R671 PolarHBondContact O-N 3.31Å
672	S	38.8	Very low	43.2	Very low	7 Å²	7	68.8 Å²	68.8	5%	0.049	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	143	-177.8	39.4	0	0	0	0	115.2	K524 I667 E670 W674	K524-S672 WeakPolarHBondContact CE-OG 3.39Å; K524-S672 PolarHBondContact NZ-OG 3.12Å; I667-S672 PolarHBondContact N-O 3.32Å; E670-S672 VanDerWaalsContact C-N 3.3Å; E670-S672 VanDerWaalsContact CB-OG 3.29Å; E670-S672 WeakPolarHBondContact CB-OG 3.18Å; E670-S672 PolarHBondContact O-N 2.83Å; E670-S672 PolarHBondContact OE2-OG 2.57Å; S672-W674 PolarHBondContact OG-NE1 2.84Å
673	L	40.9	Very low	43.4	Very low	58 Å²	58	69.3 Å²	69.3	30%	0.304	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	135.9	161.5	-61.9	164.8	0	0	0	108.7	V525 L664 V666	V525-L673 HydrophobicContact CB-CB 4.4Å; V525-L673 HydrophobicContact CB-CD1 4.23Å; L664-L673 HydrophobicContact CD1-CB 4.06Å; L664-L673 HydrophobicContact CD1-CD2 3.95Å; L664-L673 HydrophobicContact CD2-CD2 4.34Å; L664-L673 HydrophobicContact CG-CD2 4.49Å; V666-L673 HydrophobicContact CG2-CD2 4.22Å
674	W	42.9	Very low	43.6	Very low	86 Å²	86	77.2 Å²	77.2	33%	0.326	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	144.3	179.7	-84.7	80.6	0	0	0	110	L664 L665 I667 E670 S672	L664-W674 CarbonylContact C-O 3.53Å; L664-W674 WeakPolarHBondContact CA-O 3.42Å; L665-W674 HydrophobicContact CB-CB 4.08Å; L665-W674 PolarHBondContact N-O 3.45Å; L665-W674 PolarHBondContact O-N 2.95Å; I667-W674 HydrophobicContact CD1-CD2 4.25Å; I667-W674 HydrophobicContact CD1-CG 4.04Å; I667-W674 HydrophobicContact CG1-CG 4.39Å; E670-W674 WeakPolarHBondContact OE2-CZ2 3.43Å; E670-W674 PolarHBondContact OE2-NE1 2.96Å; S672-W674 PolarHBondContact OG-NE1 2.84Å
675	F	43.2	Very low	43.5	Very low	21 Å²	21	83.9 Å²	83.9	9%	0.092	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	136.7	175.2	-57	-79.1	0	0	0	111.4	A522 V525 F561 F566 L662 C663 L664	A522-F675 WeakPolarHBondContact CA-O 3.38Å; A522-F675 WeakPolarHBondContact CB-O 3.3Å; V525-F675 HydrophobicContact CG2-CE2 4.34Å; F561-F675 HydrophobicContact CZ-CE2 4.37Å; F566-F675 HydrophobicContact CD1-CE1 4.04Å; F566-F675 AromaticContact CE1-CD1 3.88Å; F566-F675 HydrophobicContact CE1-CD1 3.88Å; F566-F675 AromaticContact CE1-CE1 3.34Å; F566-F675 HydrophobicContact CE1-CE1 3.34Å; F566-F675 HydrophobicContact CE1-CZ 4.25Å; F566-F675 HydrophobicContact CE2-CE1 4.38Å; F566-F675 HydrophobicContact CZ-CD1 4.34Å; F566-F675 AromaticContact CZ-CE1 3.54Å; F566-F675 HydrophobicContact CZ-CE1 3.54Å; F566-F675 HydrophobicContact CZ-CZ 4Å; L662-F675 HydrophobicContact CD2-CB 4.36Å; L662-F675 HydrophobicContact CD2-CD1 4.13Å; C663-F675 CarbonylContact O-C 3.58Å; C663-F675 WeakPolarHBondContact O-CA 3.21Å; L664-F675 HydrophobicContact CB-CD1 4.49Å; L664-F675 HydrophobicContact CB-CE1 4.47Å; L664-F675 HydrophobicContact CD1-CD1 3.96Å; L664-F675 HydrophobicContact CD1-CE1 3.52Å; L664-F675 HydrophobicContact CD1-CZ 4Å
676	T	44.1	Very low	43.4	Very low	32 Å²	32	86.7 Å²	86.7	20%	0.196	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	167	178.2	-165.6	0	0	0	0	112.9	L662 C663 L665 Y680	L662-T676 CarbonylContact C-O 3.45Å; L662-T676 WeakPolarHBondContact CA-O 3.4Å; C663-T676 HydrophobicContact CB-CG2 3.96Å; C663-T676 PolarHBondContact N-O 3.14Å; C663-T676 PolarHBondContact O-N 2.91Å; L665-T676 HydrophobicContact CD1-CG2 3.64Å; L665-T676 HydrophobicContact CG-CG2 4.05Å; T676-Y680 WeakPolarHBondContact OG1-CD2 3.36Å
677	K	41.2	Very low	43	Very low	54 Å²	54	89.3 Å²	89.3	24%	0.235	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	143.1	173.8	-59.6	-169.6	174.4	-167.9	0	110.3	Y519 N679 Y680	Y519-K677 HydrophobicContact CD1-CD 4.45Å; K677-N679 PolarHBondContact O-N 2.83Å; K677-Y680 HydrophobicContact CB-CD2 4.1Å; K677-Y680 HydrophobicContact CB-CE2 4.33Å; K677-Y680 PolarHBondContact O-N 3.15Å
678	A	41.1	Very low	42.3	Very low	27 Å²	27	93.2 Å²	93.2	22%	0.223	46%	0.461	C	S	.	.	G	3₁₀ helix	trans	-50.4	-31.2	-175.5	0	0	0	0	0	115.5	Y661 Y680 C681	Y661-A678 VanDerWaalsContact CB-CB 3.45Å; Y661-A678 HydrophobicContact CG-CB 4.33Å; Y661-A678 PolarHBondContact O-N 3.1Å; A678-Y680 PolarHBondContact O-N 3.3Å; A678-Y680 VanDerWaalsContact O-N 3.09Å; A678-C681 VanDerWaalsContact CA-SG 3.59Å; A678-C681 WeakPolarHBondContact O-CB 3.41Å; A678-C681 PolarHBondContact O-N 2.85Å; A678-C681 PolarHBondContact O-SG 3.11Å
679	N	42.8	Very low	42.1	Very low	135 Å²	135	90.3 Å²	90.3	72%	0.722	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-55.2	-26.4	176.6	-52.7	13.8	0	0	0	113.4	K677	K677-N679 PolarHBondContact O-N 2.83Å
680	Y	45.3	Very low	41.6	Very low	126 Å²	126	81.9 Å²	81.9	49%	0.494	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-87.3	-16.1	178.7	-65.7	-78.1	0	0	0	113.6	T676 K677 A678 I682 G683	T676-Y680 WeakPolarHBondContact OG1-CD2 3.36Å; K677-Y680 HydrophobicContact CB-CD2 4.1Å; K677-Y680 HydrophobicContact CB-CE2 4.33Å; K677-Y680 PolarHBondContact O-N 3.15Å; A678-Y680 PolarHBondContact O-N 3.3Å; A678-Y680 VanDerWaalsContact O-N 3.09Å; Y680-I682 PolarHBondContact O-N 2.86Å; Y680-G683 PolarHBondContact O-N 2.82Å
681	C	42.3	Very low	40.8	Very low	15 Å²	15	80.9 Å²	80.9	10%	0.101	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	33.4	-175.4	-40.5	0	0	0	0	112.4	C663 A678 Y686 V689	C663-C681 HydrophobicContact CB-CB 4.28Å; C663-C681 WeakPolarHBondContact CB-SG 3.33Å; C663-C681 WeakPolarHBondContact SG-CB 3.36Å; C663-C681 CovalentContact SG-SG 2.03Å; C663-C681 PolarHBondContact SG-SG 3.28Å; A678-C681 VanDerWaalsContact CA-SG 3.59Å; A678-C681 WeakPolarHBondContact O-CB 3.41Å; A678-C681 PolarHBondContact O-N 2.85Å; A678-C681 PolarHBondContact O-SG 3.11Å; C681-Y686 PolarHBondContact O-OH 3.3Å; C681-V689 HydrophobicContact CB-CG1 4.43Å
682	I	44.1	Very low	40.4	Very low	119 Å²	119	71.1 Å²	71.1	61%	0.61	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.1	-18.2	-173.2	-49.7	180	0	0	0	110.7	Y680	Y680-I682 PolarHBondContact O-N 2.86Å
683	G	43.9	Very low	40.1	Very low	68 Å²	68	75.2 Å²	75.2	70%	0.701	40%	0.395	S	S	*	.	S	Bend	trans	-135.4	19.2	-167.6	0	0	0	0	0	117.2	Y680	Y680-G683 PolarHBondContact O-N 2.82Å
684	W	45.7	Very low	39.7	Very low	166 Å²	166	77.8 Å²	77.8	63%	0.629	41%	0.405	S	S	*	.	S	Bend	trans	-124.7	154.4	177.1	-70.6	76	0	0	0	110.8	Y686	W684-Y686 HydrophobicContact CB-CD1 4.09Å; W684-Y686 WeakPolarHBondContact O-CD1 3.33Å; W684-Y686 WeakPolarHBondContact O-CE1 3.37Å; W684-Y686 PolarHBondContact O-N 3.09Å
685	N	42.8	Very low	39.2	Very low	170 Å²	170	75.5 Å²	75.5	91%	0.909	41%	0.409	S	S	*	.			trans	-80.9	103.9	166.2	-83.8	-2.8	0	0	0	108.8
686	Y	44.5	Very low	38.5	Very low	73 Å²	73	79.2 Å²	79.2	29%	0.286	43%	0.433	S	S	.	.			trans	-122	151	175.1	45	-106.8	0	0	0	109.4	L665 C681 W684 V689	L665-Y686 HydrophobicContact CD2-CD1 3.94Å; L665-Y686 HydrophobicContact CD2-CG 4.01Å; C681-Y686 PolarHBondContact O-OH 3.3Å; W684-Y686 HydrophobicContact CB-CD1 4.09Å; W684-Y686 WeakPolarHBondContact O-CD1 3.33Å; W684-Y686 WeakPolarHBondContact O-CE1 3.37Å; W684-Y686 PolarHBondContact O-N 3.09Å; Y686-V689 HydrophobicContact CD1-CG2 4.31Å; Y686-V689 HydrophobicContact CD2-CG2 3.24Å; Y686-V689 HydrophobicContact CE1-CG2 4.36Å; Y686-V689 HydrophobicContact CE2-CG2 3.31Å; Y686-V689 HydrophobicContact CG-CG2 3.81Å
687	T	35.5	Very low	37.8	Very low	90 Å²	90	86.1 Å²	86.1	55%	0.552	46%	0.457	S	S	*	.	S	Bend	trans	-97.9	-29.2	-179.4	-28.9	0	0	0	0	112.9	V666 L668	V666-T687 PolarHBondContact O-N 3.07Å; L668-T687 HydrophobicContact CD1-CG2 3.73Å; L668-T687 WeakPolarHBondContact CD1-OG1 3.49Å
688	L	33.4	Very low	37.6	Very low	108 Å²	108	88.4 Å²	88.4	57%	0.565	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.1	150.6	166	-76.2	94.2	0	0	0	110.6	V666	V666-L688 HydrophobicContact CB-CB 4.2Å; V666-L688 HydrophobicContact CG2-CB 4.01Å; V666-L688 PolarHBondContact N-O 3.22Å
689	V	34.5	Very low	36.9	Very low	52 Å²	52	93.1 Å²	93.1	32%	0.315	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	131.7	167.6	-171.3	0	0	0	0	108.1	C663 L664 L665 C681 Y686	C663-V689 HydrophobicContact CB-CG1 4.03Å; L664-V689 WeakPolarHBondContact O-CA 3.22Å; L665-V689 HydrophobicContact CD2-CB 4.5Å; L665-V689 HydrophobicContact CD2-CG1 4.24Å; L665-V689 HydrophobicContact CD2-CG2 3.9Å; C681-V689 HydrophobicContact CB-CG1 4.43Å; Y686-V689 HydrophobicContact CD1-CG2 4.31Å; Y686-V689 HydrophobicContact CD2-CG2 3.24Å; Y686-V689 HydrophobicContact CE1-CG2 4.36Å; Y686-V689 HydrophobicContact CE2-CG2 3.31Å; Y686-V689 HydrophobicContact CG-CG2 3.81Å
690	S	35.7	Very low	36.5	Very low	13 Å²	13	92.4 Å²	92.4	9%	0.091	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	146	167	147.3	0	0	0	0	107.7	W567 C663 L664	W567-S690 VanDerWaalsContact O-CB 3.25Å; W567-S690 WeakPolarHBondContact O-CB 3.45Å; W567-S690 PolarHBondContact O-OG 2.96Å; C663-S690 CarbonylContact C-O 3.51Å; C663-S690 WeakPolarHBondContact CA-O 3.46Å; L664-S690 PolarHBondContact N-O 3.17Å; L664-S690 PolarHBondContact O-N 2.98Å
691	C	30.6	Very low	36	Very low	70 Å²	70	97.2 Å²	97.2	47%	0.473	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	110.2	-175.6	-69.4	0	0	0	0	111.2	L662	L662-C691 CarbonylContact O-C 3.47Å; L662-C691 WeakPolarHBondContact O-CA 3.48Å
692	G	34.9	Very low	35.7	Very low	4 Å²	4	104 Å²	104	4%	0.041	55%	0.552	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.1	163.7	164.3	0	0	0	0	0	112	L662	L662-G692 PolarHBondContact N-O 3.12Å; L662-G692 PolarHBondContact O-N 2.99Å
693	H	32.9	Very low	35.4	Very low	93 Å²	93	107.8 Å²	107.8	43%	0.431	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-139	123.4	-174.1	144	-58.5	0	0	0	110	K659 G695	K659-H693 WeakPolarHBondContact CD-NE2 3.15Å; H693-G695 PolarHBondContact CE1-O 2.81Å; H693-G695 VanDerWaalsContact CE1-O 3.31Å
694	E	33.4	Very low	35.2	Very low	111 Å²	111	109.4 Å²	109.4	52%	0.519	56%	0.555	S	S	.	*			trans	-78.4	136.7	167.9	-66.9	178	-176.3	0	0	110.2	K659 H660	K659-E694 WeakPolarHBondContact CA-O 3.5Å; K659-E694 WeakPolarHBondContact CB-O 3.1Å; K659-E694 WeakPolarHBondContact CG-O 3.06Å; H660-E694 HydrophobicContact CB-CB 4.34Å; H660-E694 HydrophobicContact CB-CG 4.39Å; H660-E694 WeakPolarHBondContact CB-OE2 3.26Å; H660-E694 IonicContact CD2-OE2 3.73Å; H660-E694 PolarHBondContact CD2-OE2 3.39Å; H660-E694 IonicContact CG-OE2 3.64Å; H660-E694 PolarHBondContact O-N 3.4Å
695	G	32.2	Very low	35.3	Very low	39 Å²	39	108 Å²	108	40%	0.402	55%	0.554	S	S	.	*			trans	131.9	109.7	164.4	0	0	0	0	0	115.2	K659 H693	K659-G695 PolarHBondContact NZ-O 2.83Å; H693-G695 PolarHBondContact CE1-O 2.81Å; H693-G695 VanDerWaalsContact CE1-O 3.31Å
696	T	27.9	Very low	35.6	Very low	98 Å²	98	101 Å²	101	60%	0.601	52%	0.521	S	S	*	.			trans	-72.3	158.1	-176.2	36.1	0	0	0	0	114.9
697	Y	29.8	Very low	35.9	Very low	177 Å²	177	99 Å²	99	69%	0.694	52%	0.518	S	S	*	.			trans	62.8	159	166.5	-62.1	-59	0	0	0	118.8
698	P	36.2	Very low	36.4	Very low	102 Å²	102	98.6 Å²	98.6	66%	0.662	51%	0.513	S	S	*	.			cis	-138.8	117.6	-41.1	34.7	-17.1	0	0	0	114.2
699	C	27.1	Very low	37	Very low	127 Å²	127	96.8 Å²	96.8	86%	0.858	50%	0.5	S	S	*	.	S	Bend	trans	-130.9	-18	177.3	-78	0	0	0	0	118.2	R701	C699-R701 PolarHBondContact O-N 3.47Å
700	E	34.5	Very low	37.8	Very low	119 Å²	119	96.6 Å²	96.6	56%	0.556	50%	0.497	S	S	*	.			trans	-93.3	25.3	-172.5	-64.4	-152.8	115.4	0	0	115.8	I615 N702	I615-E700 WeakPolarHBondContact CD1-OE2 3.42Å; I615-E700 WeakPolarHBondContact CG2-OE1 3.3Å; E700-N702 PolarHBondContact O-N 3.11Å
701	R	33.5	Very low	37.9	Very low	227 Å²	227	100.3 Å²	100.3	86%	0.857	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	51.8	178.3	-163.4	-167	-72.4	177.8	-2.3	112.3	C699	C699-R701 PolarHBondContact O-N 3.47Å
702	N	36.9	Very low	38.2	Very low	158 Å²	158	104.4 Å²	104.4	85%	0.845	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-157.8	8.6	-178.2	-110.1	-12	0	0	0	115.8	E700	E700-N702 PolarHBondContact O-N 3.11Å
703	R	36.7	Very low	38.4	Very low	198 Å²	198	108.9 Å²	108.9	75%	0.747	55%	0.553	S	S	*	*	S	Bend	trans	-138.9	-8.8	178.5	-72.5	-167.1	179.4	179.2	3.7	117.2
704	T	40.1	Very low	38.7	Very low	102 Å²	102	110.1 Å²	110.1	63%	0.626	56%	0.563	S	S	*	*			trans	-80.7	135.6	169.6	36.1	0	0	0	0	110.5
705	F	48.2	Very low	39.3	Very low	137 Å²	137	111.4 Å²	111.4	60%	0.601	56%	0.563	S	S	*	*			trans	-111.7	-26.3	178.2	-165.4	-102.6	0	0	0	112.3	Y720 T722	F705-Y720 HydrophobicContact CD1-CD2 4.38Å; F705-Y720 HydrophobicContact CD1-CE2 4.13Å; F705-Y720 PolarHBondContact N-O 3.12Å; F705-T722 VanDerWaalsContact CB-N 3.26Å; F705-T722 HydrophobicContact CD1-CG2 3.91Å; F705-T722 HydrophobicContact CD2-CG2 3.62Å; F705-T722 VanDerWaalsContact CD2-OG1 3.29Å; F705-T722 WeakPolarHBondContact CD2-OG1 3.14Å; F705-T722 HydrophobicContact CE1-CG2 3.84Å; F705-T722 HydrophobicContact CE2-CG2 3.54Å; F705-T722 HydrophobicContact CG-CG2 3.81Å; F705-T722 HydrophobicContact CZ-CG2 3.65Å
706	G	49.3	Very low	40	Very low	22 Å²	22	111.3 Å²	111.3	23%	0.227	56%	0.555	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-174.3	-171.7	167.8	0	0	0	0	0	112.2	Y720	G706-Y720 PolarHBondContact N-O 3Å; G706-Y720 PolarHBondContact O-N 3.16Å; G706-Y720 VanDerWaalsContact O-O 3.05Å
707	C	50.2	Low	40.8	Very low	32 Å²	32	110.2 Å²	110.2	22%	0.216	55%	0.548	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	154.9	169.3	96.7	0	0	0	0	110.6	F709 C716 S718 Y719 Y720	C707-F709 PolarHBondContact O-N 3.47Å; C707-C716 HydrophobicContact CB-CB 3.68Å; C707-C716 WeakPolarHBondContact CB-SG 3.12Å; C707-C716 WeakPolarHBondContact SG-CB 3.46Å; C707-C716 CovalentContact SG-SG 2.04Å; C707-C716 PolarHBondContact SG-SG 3.48Å; C707-S718 CarbonylContact C-O 3.48Å; C707-S718 WeakPolarHBondContact CA-O 3.36Å; C707-S718 VanDerWaalsContact CB-O 3.29Å; C707-S718 WeakPolarHBondContact CB-O 3.39Å; C707-Y719 HydrophobicContact CB-CD1 3.52Å; C707-Y719 HydrophobicContact CB-CE1 3.84Å; C707-Y719 HydrophobicContact CB-CG 4.18Å; C707-Y720 VanDerWaalsContact C-CE1 3.49Å; C707-Y720 WeakPolarHBondContact O-CE1 3.3Å
708	N	47	Very low	41.2	Very low	82 Å²	82	104.3 Å²	104.3	44%	0.439	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	101.8	164.2	-63.1	-29.1	0	0	0	106.4	C716 V717 S718 Y720	N708-C716 CarbonylContact O-C 3.56Å; N708-C716 WeakPolarHBondContact O-CA 3.06Å; N708-V717 HydrophobicContact CB-CG2 4.4Å; N708-V717 VanDerWaalsContact O-CG2 3.29Å; N708-V717 WeakPolarHBondContact O-CG2 3.48Å; N708-V717 PolarHBondContact O-N 3.17Å; N708-S718 WeakPolarHBondContact CB-OG 3.31Å; N708-S718 PolarHBondContact N-O 2.84Å; N708-S718 PolarHBondContact ND2-OG 3.28Å; N708-S718 PolarHBondContact O-N 2.78Å; N708-Y720 WeakPolarHBondContact OD1-CE1 3.48Å
709	F	44.7	Very low	41.9	Very low	69 Å²	69	106.9 Å²	106.9	30%	0.303	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	131.3	177.7	-159.7	-99.5	0	0	0	109.5	C707 H711 N714	C707-F709 PolarHBondContact O-N 3.47Å; F709-H711 AromaticContact CD1-CD2 3.62Å; F709-H711 AromaticContact CD1-NE2 3.84Å; F709-N714 WeakPolarHBondContact CZ-OD1 3.06Å
710	N	51	Low	42.6	Very low	48 Å²	48	106 Å²	106	26%	0.257	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	118.3	168.2	179.4	-62.1	0	0	0	107.3	D712 L713 N714 R715 V717	N710-D712 PolarHBondContact OD1-N 3.12Å; N710-D712 VanDerWaalsContact OD1-N 3.16Å; N710-L713 HydrophobicContact CB-CB 4.29Å; N710-L713 WeakPolarHBondContact OD1-CB 3.3Å; N710-L713 WeakPolarHBondContact OD1-CG 3.37Å; N710-L713 PolarHBondContact OD1-N 3.26Å; N710-N714 PolarHBondContact O-N 3.11Å; N710-N714 VanDerWaalsContact O-N 3.09Å; N710-R715 PolarHBondContact N-O 2.87Å; N710-R715 PolarHBondContact O-N 2.8Å; N710-V717 HydrophobicContact CB-CB 4.31Å; N710-V717 HydrophobicContact CB-CG1 3.47Å; N710-V717 VanDerWaalsContact CB-CG1 3.47Å; N710-V717 HydrophobicContact CB-CG2 3.87Å
711	H	38.9	Very low	43	Very low	92 Å²	92	108 Å²	108	43%	0.426	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-37.6	-172.2	-72.3	-128.7	0	0	0	111.1	D367 F709 N714	D367-H711 IonicContact OD1-CE1 2.75Å; D367-H711 PolarHBondContact OD1-CE1 3.2Å; D367-H711 IonicContact OD1-ND1 2.72Å; D367-H711 PolarHBondContact OD1-ND1 3.21Å; D367-H711 VanDerWaalsContact OD1-ND1 3.12Å; D367-H711 IonicContact OD2-ND1 3.17Å; F709-H711 AromaticContact CD1-CD2 3.62Å; F709-H711 AromaticContact CD1-NE2 3.84Å; H711-N714 PolarHBondContact O-N 2.83Å
712	D	36.6	Very low	43.5	Very low	156 Å²	156	101.3 Å²	101.3	83%	0.834	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-37.6	179.2	-47.8	-76.1	0	0	0	113.1	N710 N714	N710-D712 PolarHBondContact OD1-N 3.12Å; N710-D712 VanDerWaalsContact OD1-N 3.16Å; D712-N714 VanDerWaalsContact C-N 3.34Å
713	L	39.2	Very low	43.6	Very low	98 Å²	98	102.6 Å²	102.6	51%	0.513	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-2.7	176.9	-61	179.7	0	0	0	113.1	N710 R715 V717	N710-L713 HydrophobicContact CB-CB 4.29Å; N710-L713 WeakPolarHBondContact OD1-CB 3.3Å; N710-L713 WeakPolarHBondContact OD1-CG 3.37Å; N710-L713 PolarHBondContact OD1-N 3.26Å; L713-R715 HydrophobicContact CB-CG 3.96Å; L713-R715 PolarHBondContact O-N 3.01Å; L713-R715 VanDerWaalsContact O-N 3.16Å; L713-V717 HydrophobicContact CD1-CG1 4.14Å
714	N	39	Very low	43.6	Very low	118 Å²	118	95.9 Å²	95.9	63%	0.631	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.5	43.6	-177.7	-158.2	-3.9	0	0	0	113.5	F709 N710 H711 D712	F709-N714 WeakPolarHBondContact CZ-OD1 3.06Å; N710-N714 PolarHBondContact O-N 3.11Å; N710-N714 VanDerWaalsContact O-N 3.09Å; H711-N714 PolarHBondContact O-N 2.83Å; D712-N714 VanDerWaalsContact C-N 3.34Å
715	R	46.7	Very low	43.2	Very low	139 Å²	139	93.9 Å²	93.9	53%	0.525	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	149.7	-178.3	71.6	-176.9	-173.6	156	2.3	112.9	N710 L713 V717	N710-R715 PolarHBondContact N-O 2.87Å; N710-R715 PolarHBondContact O-N 2.8Å; L713-R715 HydrophobicContact CB-CG 3.96Å; L713-R715 PolarHBondContact O-N 3.01Å; L713-R715 VanDerWaalsContact O-N 3.16Å; R715-V717 HydrophobicContact CG-CG1 4.28Å; R715-V717 PolarHBondContact O-N 2.86Å; R715-V717 VanDerWaalsContact O-N 3.14Å
716	C	47.1	Very low	42.6	Very low	36 Å²	36	94 Å²	94	24%	0.243	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	113.1	161.3	-67.2	0	0	0	0	109.5	C707 N708 Y719	C707-C716 HydrophobicContact CB-CB 3.68Å; C707-C716 WeakPolarHBondContact CB-SG 3.12Å; C707-C716 WeakPolarHBondContact SG-CB 3.46Å; C707-C716 CovalentContact SG-SG 2.04Å; C707-C716 PolarHBondContact SG-SG 3.48Å; N708-C716 CarbonylContact O-C 3.56Å; N708-C716 WeakPolarHBondContact O-CA 3.06Å; C716-Y719 HydrophobicContact CB-CD1 4.46Å; C716-Y719 HydrophobicContact CB-CE1 3.8Å; C716-Y719 HydrophobicContact CB-CE2 3.9Å; C716-Y719 VanDerWaalsContact CB-CZ 3.49Å
717	V	43.5	Very low	41.9	Very low	75 Å²	75	98.6 Å²	98.6	46%	0.455	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-22.5	175.5	-75.5	0	0	0	0	112.5	N708 N710 L713 R715	N708-V717 HydrophobicContact CB-CG2 4.4Å; N708-V717 VanDerWaalsContact O-CG2 3.29Å; N708-V717 WeakPolarHBondContact O-CG2 3.48Å; N708-V717 PolarHBondContact O-N 3.17Å; N710-V717 HydrophobicContact CB-CB 4.31Å; N710-V717 HydrophobicContact CB-CG1 3.47Å; N710-V717 VanDerWaalsContact CB-CG1 3.47Å; N710-V717 HydrophobicContact CB-CG2 3.87Å; L713-V717 HydrophobicContact CD1-CG1 4.14Å; R715-V717 HydrophobicContact CG-CG1 4.28Å; R715-V717 PolarHBondContact O-N 2.86Å; R715-V717 VanDerWaalsContact O-N 3.14Å
718	S	39.5	Very low	41.3	Very low	54 Å²	54	106.2 Å²	106.2	38%	0.378	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	161.3	165	45.4	0	0	0	0	111	C707 N708	C707-S718 CarbonylContact C-O 3.48Å; C707-S718 WeakPolarHBondContact CA-O 3.36Å; C707-S718 VanDerWaalsContact CB-O 3.29Å; C707-S718 WeakPolarHBondContact CB-O 3.39Å; N708-S718 WeakPolarHBondContact CB-OG 3.31Å; N708-S718 PolarHBondContact N-O 2.84Å; N708-S718 PolarHBondContact ND2-OG 3.28Å; N708-S718 PolarHBondContact O-N 2.78Å
719	Y	49.9	Very low	40.5	Very low	156 Å²	156	110.7 Å²	110.7	61%	0.612	55%	0.553	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-116	142.5	178.3	-67.1	-90.2	0	0	0	110.2	C707 C716	C707-Y719 HydrophobicContact CB-CD1 3.52Å; C707-Y719 HydrophobicContact CB-CE1 3.84Å; C707-Y719 HydrophobicContact CB-CG 4.18Å; C716-Y719 HydrophobicContact CB-CD1 4.46Å; C716-Y719 HydrophobicContact CB-CE1 3.8Å; C716-Y719 HydrophobicContact CB-CE2 3.9Å; C716-Y719 VanDerWaalsContact CB-CZ 3.49Å
720	Y	41.3	Very low	39.9	Very low	108 Å²	108	116.6 Å²	116.6	42%	0.424	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.3	154.2	175.4	62	-101.7	0	0	0	112.4	F705 G706 C707 N708	F705-Y720 HydrophobicContact CD1-CD2 4.38Å; F705-Y720 HydrophobicContact CD1-CE2 4.13Å; F705-Y720 PolarHBondContact N-O 3.12Å; G706-Y720 PolarHBondContact N-O 3Å; G706-Y720 PolarHBondContact O-N 3.16Å; G706-Y720 VanDerWaalsContact O-O 3.05Å; C707-Y720 VanDerWaalsContact C-CE1 3.49Å; C707-Y720 WeakPolarHBondContact O-CE1 3.3Å; N708-Y720 WeakPolarHBondContact OD1-CE1 3.48Å
721	Y	44.8	Very low	38.7	Very low	162 Å²	162	124.4 Å²	124.4	64%	0.635	61%	0.606	S	S	*	*			trans	-128.4	147.7	-178	42.1	-87.5	0	0	0	107.8	K723	Y721-K723 PolarHBondContact O-N 2.03Å
722	T	43.4	Very low	38.2	Very low	85 Å²	85	128.9 Å²	128.9	52%	0.521	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-56.8	117.8	161.5	17.8	0	0	0	0	106.7	F705 A724	F705-T722 VanDerWaalsContact CB-N 3.26Å; F705-T722 HydrophobicContact CD1-CG2 3.91Å; F705-T722 HydrophobicContact CD2-CG2 3.62Å; F705-T722 VanDerWaalsContact CD2-OG1 3.29Å; F705-T722 WeakPolarHBondContact CD2-OG1 3.14Å; F705-T722 HydrophobicContact CE1-CG2 3.84Å; F705-T722 HydrophobicContact CE2-CG2 3.54Å; F705-T722 HydrophobicContact CG-CG2 3.81Å; F705-T722 HydrophobicContact CZ-CG2 3.65Å; T722-A724 PolarHBondContact O-N 3.27Å
723	K	39	Very low	37.7	Very low	185 Å²	185	133 Å²	133	80%	0.804	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-54.2	118.6	170	-166.8	171.6	-174.3	172.9	0	106.1	Y721	Y721-K723 PolarHBondContact O-N 2.03Å
724	A	36.3	Very low	37.1	Very low	57 Å²	57	134.5 Å²	134.5	47%	0.471	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-53.3	154.8	172.7	0	0	0	0	0	108.6	T722	T722-A724 PolarHBondContact O-N 3.27Å
725	A	31.4	Very low	36.6	Very low	61 Å²	61	134.5 Å²	134.5	50%	0.504	65%	0.653	S	S	.	*	P	Polyproline II helix	trans	-52.5	150.7	174.7	0	0	0	0	0	109.9	D727	A725-D727 WeakPolarHBondContact CB-OD1 3.23Å; A725-D727 PolarHBondContact O-N 3.3Å
726	P	35.1	Very low	36	Very low	138 Å²	138	137.4 Å²	137.4	90%	0.896	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	16	-175.3	-22.4	35.3	0	0	0	115.4
727	D	35.6	Very low	35	Very low	120 Å²	120	142.4 Å²	142.4	64%	0.642	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-12.5	-175.6	64.8	-17.8	0	0	0	113.9	A725	A725-D727 WeakPolarHBondContact CB-OD1 3.23Å; A725-D727 PolarHBondContact O-N 3.3Å
728	R	36.7	Very low	34.5	Very low	192 Å²	192	149.9 Å²	149.9	73%	0.725	72%	0.715	S	S	*	*	S	Bend	trans	-89.5	0.9	-175.5	-69.1	-164.9	174.3	-135.5	-4.4	116.8
729	E	31.7	Very low	33.9	Very low	176 Å²	176	150.2 Å²	150.2	82%	0.822	73%	0.727	S	S	*	*			trans	-108.6	65	173.7	-69	-164.4	146.2	0	0	112.5
730	K	30.5	Very low	33	Very low	192 Å²	192	148.2 Å²	148.2	84%	0.835	74%	0.736	S	S	*	*			trans	-148.8	96.3	160.3	-126.2	173	-173.1	178.4	0	113.3	Q732	K730-Q732 PolarHBondContact O-N 2.71Å
731	Y	27.4	Very low	32.5	Very low	212 Å²	212	149.4 Å²	149.4	83%	0.831	76%	0.755	S	S	*	*			trans	-72.4	115.7	164.4	-78	-99.2	0	0	0	109.8
732	Q	28.3	Very low	32	Very low	186 Å²	186	147.6 Å²	147.6	87%	0.869	77%	0.765	S	S	*	*			trans	-150.8	150.9	149.8	-119.5	171	-5.5	0	0	110.2	K730 C734	K730-Q732 PolarHBondContact O-N 2.71Å; Q732-C734 PolarHBondContact O-N 2.96Å
733	R	25	Very low	32.1	Very low	243 Å²	243	150.6 Å²	150.6	92%	0.917	78%	0.778	S	S	*	*			trans	-70.6	123.6	-164.9	-65.2	174.5	178.7	152.7	-0.8	112.2
734	C	28	Very low	32.7	Very low	129 Å²	129	145.1 Å²	145.1	87%	0.872	76%	0.762	S	S	*	*			trans	-128.6	132.7	152.4	-74.5	0	0	0	0	107.5	Q732	Q732-C734 PolarHBondContact O-N 2.96Å
735	T	28.2	Very low	34.2	Very low	118 Å²	118	146.1 Å²	146.1	72%	0.724	77%	0.765	S	S	*	*			trans	-93.9	154.4	178.1	43.6	0	0	0	0	111.2
736	F	33.6	Very low	36.4	Very low	200 Å²	200	145.2 Å²	145.2	88%	0.877	76%	0.755	S	S	*	*			trans	84.3	130.9	178.4	-58.8	-79.5	0	0	0	116.9
737	D	26.7	Very low	38.5	Very low	142 Å²	142	140.3 Å²	140.3	76%	0.759	72%	0.724	S	S	*	*			trans	-64.2	145.1	169.3	-69.4	-82	0	0	0	112.1
738	Y	32.4	Very low	40.7	Very low	231 Å²	231	142.1 Å²	142.1	91%	0.906	73%	0.734	S	S	*	*				-147	139.2	120.9	-82.9	-65	0	0	0	109.7
739	G	26.9	Very low	43	Very low	61 Å²	61	136.4 Å²	136.4	63%	0.629	72%	0.723	S	S	*	*			trans	-85.3	168.8	177.6	0	0	0	0	0	113.2
740	S	30.7	Very low	45.6	Very low	114 Å²	114	130.1 Å²	130.1	80%	0.797	69%	0.692	S	S	*	*	S	Bend	trans	60.8	116.9	178.9	56.3	0	0	0	0	116.8
741	T	31.9	Very low	48.3	Very low	134 Å²	134	123.4 Å²	123.4	82%	0.822	67%	0.667	S	S	*	*			trans	41.4	90	159.3	51	0	0	0	0	116.8	N743	T741-N743 VanDerWaalsContact C-N 3.28Å; T741-N743 PolarHBondContact O-N 2.88Å
742	C	33.4	Very low	51.3	Low	123 Å²	123	122.1 Å²	122.1	83%	0.831	67%	0.669	S	S	*	*			trans	-64.7	85.9	166.1	-61.7	0	0	0	0	110.9	C744	C742-C744 VanDerWaalsContact C-N 3.25Å; C742-C744 PolarHBondContact O-N 3.4Å
743	N	44.8	Very low	54.2	Low	149 Å²	149	117 Å²	117	80%	0.797	64%	0.642	S	S	*	*			trans	-79.6	75	173	-170	37.3	0	0	0	109.4	T741 S745	T741-N743 VanDerWaalsContact C-N 3.28Å; T741-N743 PolarHBondContact O-N 2.88Å; N743-S745 PolarHBondContact O-N 2.73Å
744	C	52.9	Low	57.2	Low	70 Å²	70	107.7 Å²	107.7	47%	0.473	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-64.5	117.3	178.2	-61.6	0	0	0	0	110	C742 C746 I771	C742-C744 VanDerWaalsContact C-N 3.25Å; C742-C744 PolarHBondContact O-N 3.4Å; C744-C746 PolarHBondContact O-N 2.84Å; C744-I771 HydrophobicContact CB-CG2 4.09Å
745	S	67.3	Low	60	Low	78 Å²	78	106.5 Å²	106.5	55%	0.545	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-59.6	126.2	175.2	-60.1	0	0	0	0	110.5	N743 I772	N743-S745 PolarHBondContact O-N 2.73Å; S745-I772 WeakPolarHBondContact O-CB 3.42Å; S745-I772 PolarHBondContact O-N 3.17Å
746	C	76.6	Confident	62.7	Low	41 Å²	41	105.1 Å²	105.1	28%	0.277	59%	0.586	S	S	.	*	B	Isolated β-bridge	trans	-92.6	148.3	177.5	-54.8	0	0	0	0	110.2	C744 Y750 I772 C792	C744-C746 PolarHBondContact O-N 2.84Å; C746-Y750 HydrophobicContact CB-CE2 4.4Å; C746-Y750 WeakPolarHBondContact CB-OH 3.46Å; C746-Y750 PolarHBondContact SG-OH 3.01Å; C746-I772 WeakPolarHBondContact O-CD1 3.3Å; C746-C792 WeakPolarHBondContact CA-SG 3.06Å; C746-C792 HydrophobicContact CB-CB 3.62Å; C746-C792 WeakPolarHBondContact CB-SG 3.3Å; C746-C792 WeakPolarHBondContact SG-CB 3.4Å; C746-C792 CovalentContact SG-SG 2.03Å; C746-C792 PolarHBondContact SG-SG 2.74Å
747	S	80.7	Confident	64.9	Low	35 Å²	35	97.3 Å²	97.3	25%	0.245	56%	0.556	C	S	.	*	P	Polyproline II helix	trans	-67.1	142.9	168.2	-173.9	0	0	0	0	110.3	S749 Y750 A769 P770	S747-S749 WeakPolarHBondContact CB-OG 3.46Å; S747-S749 PolarHBondContact O-N 3.31Å; S747-S749 VanDerWaalsContact O-N 3.14Å; S747-S749 PolarHBondContact OG-N 3.49Å; S747-S749 PolarHBondContact OG-OG 3.44Å; S747-Y750 WeakPolarHBondContact O-CE2 3.19Å; S747-A769 WeakPolarHBondContact O-CB 3.18Å; S747-P770 PolarHBondContact N-O 2.99Å
748	D	81.4	Confident	67.3	Low	159 Å²	159	95.3 Å²	95.3	85%	0.85	55%	0.554	S	S	*	*	S	Bend	trans	-63.3	-14.3	171	-63.3	-56.6	0	0	0	112.9	Y750	D748-Y750 PolarHBondContact O-N 2.92Å
749	S	84.5	Confident	69	Low	71 Å²	71	87 Å²	87	50%	0.497	53%	0.527	S	S	.	.			trans	-72.1	52.6	177.3	63.2	0	0	0	0	114.2	S747	S747-S749 WeakPolarHBondContact CB-OG 3.46Å; S747-S749 PolarHBondContact O-N 3.31Å; S747-S749 VanDerWaalsContact O-N 3.14Å; S747-S749 PolarHBondContact OG-N 3.49Å; S747-S749 PolarHBondContact OG-OG 3.44Å
750	Y	86.4	Confident	71.1	Confident	44 Å²	44	85 Å²	85	17%	0.173	50%	0.503	C	S	.	.	P	Polyproline II helix	trans	-65.3	143.8	172.6	-78.2	-85.3	0	0	0	112.6	C746 S747 D748 R767 I768 A769 Q794	C746-Y750 HydrophobicContact CB-CE2 4.4Å; C746-Y750 WeakPolarHBondContact CB-OH 3.46Å; C746-Y750 PolarHBondContact SG-OH 3.01Å; S747-Y750 WeakPolarHBondContact O-CE2 3.19Å; D748-Y750 PolarHBondContact O-N 2.92Å; Y750-R767 HydrophobicContact CD1-CB 4.47Å; Y750-R767 HydrophobicContact CD1-CG 3.76Å; Y750-R767 HydrophobicContact CG-CG 4.36Å; Y750-I768 CarbonylContact C-O 3.46Å; Y750-I768 WeakPolarHBondContact CA-O 3.36Å; Y750-A769 HydrophobicContact CD1-CB 3.52Å; Y750-A769 HydrophobicContact CD2-CB 4.01Å; Y750-A769 HydrophobicContact CE1-CB 3.53Å; Y750-A769 HydrophobicContact CE2-CB 4.03Å; Y750-A769 HydrophobicContact CG-CB 3.76Å; Y750-Q794 HydrophobicContact CE1-CB 4.22Å; Y750-Q794 HydrophobicContact CE1-CG 3.67Å; Y750-Q794 VanDerWaalsContact CZ-NE2 3.3Å; Y750-Q794 PolarHBondContact OH-NE2 3.48Å; Y750-Q794 VanDerWaalsContact OH-NE2 3.07Å
751	T	87.8	Confident	73.1	Confident	52 Å²	52	82.9 Å²	82.9	32%	0.319	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-60	164.3	166.1	64.8	0	0	0	0	111.2	I768	T751-I768 HydrophobicContact CG2-CD1 4.38Å; T751-I768 HydrophobicContact CG2-CG1 3.58Å; T751-I768 PolarHBondContact N-O 2.79Å; T751-I768 PolarHBondContact OG1-N 3.46Å; T751-I768 VanDerWaalsContact OG1-N 3.08Å
752	Q	89.4	Confident	75	Confident	184 Å²	184	79.4 Å²	79.4	86%	0.86	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-56.3	152.7	160.3	-67	-173.1	-9.1	0	0	110.5
753	W	89.6	Confident	77.2	Confident	80 Å²	80	73.8 Å²	73.8	30%	0.303	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-65.5	145.1	173	-70.5	106.2	0	0	0	111.1	R765 M766 R767 Q794 E796	W753-R765 HydrophobicContact CD2-CG 4.27Å; W753-R765 HydrophobicContact CE3-CB 4.41Å; W753-R765 HydrophobicContact CE3-CG 3.71Å; W753-R765 HydrophobicContact CZ3-CG 4.21Å; W753-M766 VanDerWaalsContact CE3-C 3.44Å; W753-R767 HydrophobicContact CD2-CB 4.16Å; W753-R767 HydrophobicContact CD2-CG 3.96Å; W753-R767 HydrophobicContact CE3-CB 3.95Å; W753-R767 HydrophobicContact CE3-CG 3.78Å; W753-R767 HydrophobicContact CH2-CG 3.91Å; W753-R767 HydrophobicContact CZ2-CG 4.09Å; W753-R767 HydrophobicContact CZ3-CB 4.36Å; W753-R767 HydrophobicContact CZ3-CG 3.76Å; W753-Q794 HydrophobicContact CH2-CB 4.23Å; W753-E796 HydrophobicContact CH2-CB 3.72Å; W753-E796 HydrophobicContact CZ2-CB 4.42Å; W753-E796 WeakPolarHBondContact CZ2-OE2 3.37Å; W753-E796 HydrophobicContact CZ3-CB 3.8Å
754	T	88.4	Confident	79.1	Confident	47 Å²	47	69.2 Å²	69.2	29%	0.288	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-61.3	165.7	162.7	62.7	0	0	0	0	111	R765 M766 F785	T754-R765 WeakPolarHBondContact OG1-CA 3.34Å; T754-R765 WeakPolarHBondContact OG1-CB 3.31Å; T754-M766 HydrophobicContact CG2-CG 3.88Å; T754-M766 WeakPolarHBondContact CG2-O 3.38Å; T754-M766 PolarHBondContact N-O 3.27Å; T754-M766 PolarHBondContact OG1-N 3.3Å; T754-F785 HydrophobicContact CG2-CE1 3.64Å; T754-F785 HydrophobicContact CG2-CZ 3.55Å
755	S	86	Confident	80.8	Confident	103 Å²	103	68.8 Å²	68.8	72%	0.72	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-53.4	154.5	156.8	45.2	0	0	0	0	111.2
756	W	85	Confident	81.8	Confident	90 Å²	90	67 Å²	67	34%	0.341	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-63	140.1	166.4	-72	112.5	0	0	0	110.4	S758 T764 R765 E796 N798	W756-S758 PolarHBondContact O-N 2.72Å; W756-T764 CarbonylContact C-O 3.6Å; W756-R765 HydrophobicContact CD2-CB 4.31Å; W756-R765 HydrophobicContact CD2-CG 4.12Å; W756-R765 HydrophobicContact CE3-CB 4.02Å; W756-R765 HydrophobicContact CE3-CG 3.84Å; W756-R765 HydrophobicContact CH2-CG 3.9Å; W756-R765 HydrophobicContact CZ2-CG 4.2Å; W756-R765 HydrophobicContact CZ3-CB 4.33Å; W756-R765 HydrophobicContact CZ3-CG 3.71Å; W756-E796 HydrophobicContact CH2-CB 4.36Å; W756-E796 HydrophobicContact CH2-CG 3.9Å; W756-N798 HydrophobicContact CE3-CB 4.02Å; W756-N798 HydrophobicContact CH2-CB 3.68Å; W756-N798 HydrophobicContact CZ2-CB 4.29Å; W756-N798 HydrophobicContact CZ3-CB 3.51Å
757	S	80.1	Confident	82.4	Confident	35 Å²	35	68.3 Å²	68.3	25%	0.245	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-66.5	124.4	173.5	67.6	0	0	0	0	109.9	T759 S763 T764 L803	S757-T759 VanDerWaalsContact C-N 3.35Å; S757-S763 PolarHBondContact N-OG 3.29Å; S757-S763 WeakPolarHBondContact O-CB 3.46Å; S757-S763 PolarHBondContact O-OG 2.04Å; S757-T764 PolarHBondContact N-O 3.42Å; S757-T764 PolarHBondContact OG-N 3.26Å; S757-T764 PolarHBondContact OG-OG1 2.91Å; S757-L803 VanDerWaalsContact O-CD1 3.29Å; S757-L803 WeakPolarHBondContact O-CD1 3.43Å
758	S	76.9	Confident	82.8	Confident	101 Å²	101	66.7 Å²	66.7	71%	0.706	36%	0.358	S	S	*	.			trans	-94.7	11.8	-177.5	60.1	0	0	0	0	113.3	W756	W756-S758 PolarHBondContact O-N 2.72Å
759	T	68.5	Low	83	Confident	57 Å²	57	59.1 Å²	59.1	35%	0.35	32%	0.318	S	S	.	.	S	Bend	trans	-86.1	-58.4	-174.1	-43.3	0	0	0	0	111.8	S757 Y809	S757-T759 VanDerWaalsContact C-N 3.35Å; T759-Y809 HydrophobicContact CG2-CD1 4.39Å; T759-Y809 HydrophobicContact CG2-CE1 3.93Å; T759-Y809 HydrophobicContact CG2-CE2 4.48Å; T759-Y809 WeakPolarHBondContact O-CE2 3.14Å; T759-Y809 PolarHBondContact O-OH 2.97Å
760	C	71.4	Confident	82.9	Confident	17 Å²	17	57.1 Å²	57.1	12%	0.115	30%	0.303	C	S	.	.	S	Bend	trans	-159	162	-172.2	58.6	0	0	0	0	111.7	P762 E804 C806 Y809	C760-P762 CarbonylContact O-C 3.53Å; C760-E804 CarbonylContact C-O 3.52Å; C760-E804 WeakPolarHBondContact CA-O 3.41Å; C760-E804 WeakPolarHBondContact CB-O 3.04Å; C760-C806 HydrophobicContact CB-CB 3.86Å; C760-C806 WeakPolarHBondContact CB-SG 3.33Å; C760-C806 VanDerWaalsContact SG-CA 3.51Å; C760-C806 WeakPolarHBondContact SG-CB 3.45Å; C760-C806 CovalentContact SG-SG 2.04Å; C760-C806 PolarHBondContact SG-SG 3.34Å; C760-Y809 HydrophobicContact CB-CD2 3.59Å; C760-Y809 HydrophobicContact CB-CE2 3.78Å; C760-Y809 HydrophobicContact CB-CG 4.45Å
761	K	73.1	Confident	82.4	Confident	70 Å²	70	57.5 Å²	57.5	30%	0.304	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-85.7	139.6	179.9	166.1	174.8	168.1	145.3	0	111.3	P799 L803 E804 E805 C806	K761-P799 WeakPolarHBondContact CE-O 3.02Å; K761-P799 PolarHBondContact NZ-O 3.4Å; K761-L803 HydrophobicContact CB-CB 4.31Å; K761-L803 WeakPolarHBondContact CB-O 3Å; K761-E804 PolarHBondContact N-O 3.49Å; K761-E805 HydrophobicContact CD-CG 4.45Å; K761-C806 PolarHBondContact O-N 2.95Å; K761-C806 PolarHBondContact O-SG 3.3Å
762	P	70.8	Confident	81.6	Confident	62 Å²	62	59.3 Å²	59.3	40%	0.403	31%	0.314	S	S	.	.	S	Bend	cis	-71.7	131.9	-3.1	30.1	-34.4	0	0	0	111.8	C760 T764	C760-P762 CarbonylContact O-C 3.53Å; P762-T764 WeakPolarHBondContact O-CG2 3.01Å
763	S	79.7	Confident	80.3	Confident	4 Å²	4	53.5 Å²	53.5	3%	0.028	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	141.2	174	-177.7	0	0	0	0	109.9	S757 N798 S801	S757-S763 PolarHBondContact N-OG 3.29Å; S757-S763 WeakPolarHBondContact O-CB 3.46Å; S757-S763 PolarHBondContact O-OG 2.04Å; S763-N798 PolarHBondContact N-O 2.61Å; S763-N798 PolarHBondContact O-N 2.8Å; S763-S801 PolarHBondContact N-OG 2.98Å
764	T	84.2	Confident	78.6	Confident	53 Å²	53	55.6 Å²	55.6	33%	0.325	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	147.6	-174.3	61.2	0	0	0	0	112.2	W756 S757 P762 E796 T797	W756-T764 CarbonylContact C-O 3.6Å; S757-T764 PolarHBondContact N-O 3.42Å; S757-T764 PolarHBondContact OG-N 3.26Å; S757-T764 PolarHBondContact OG-OG1 2.91Å; P762-T764 WeakPolarHBondContact O-CG2 3.01Å; T764-E796 VanDerWaalsContact CA-O 3.31Å; T764-E796 WeakPolarHBondContact CA-O 3.01Å; T764-T797 HydrophobicContact CG2-CG2 3.92Å
765	R	88.5	Confident	77	Confident	61 Å²	61	57.9 Å²	57.9	23%	0.23	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	157.4	167.5	65	179.1	-172.8	-170	-8.5	110.2	W753 T754 W756 T795 E796	W753-R765 HydrophobicContact CD2-CG 4.27Å; W753-R765 HydrophobicContact CE3-CB 4.41Å; W753-R765 HydrophobicContact CE3-CG 3.71Å; W753-R765 HydrophobicContact CZ3-CG 4.21Å; T754-R765 WeakPolarHBondContact OG1-CA 3.34Å; T754-R765 WeakPolarHBondContact OG1-CB 3.31Å; W756-R765 HydrophobicContact CD2-CB 4.31Å; W756-R765 HydrophobicContact CD2-CG 4.12Å; W756-R765 HydrophobicContact CE3-CB 4.02Å; W756-R765 HydrophobicContact CE3-CG 3.84Å; W756-R765 HydrophobicContact CH2-CG 3.9Å; W756-R765 HydrophobicContact CZ2-CG 4.2Å; W756-R765 HydrophobicContact CZ3-CB 4.33Å; W756-R765 HydrophobicContact CZ3-CG 3.71Å; R765-T795 CarbonylContact O-C 3.53Å; R765-T795 WeakPolarHBondContact O-CA 3.25Å; R765-E796 HydrophobicContact CG-CB 4Å; R765-E796 IonicContact CZ-OE1 3.73Å; R765-E796 IonicContact CZ-OE2 3.12Å; R765-E796 PolarHBondContact N-O 2.94Å; R765-E796 IonicContact NE-OE1 2.65Å; R765-E796 IonicContact NE-OE2 3.63Å; R765-E796 PolarHBondContact NE-OE2 3.15Å; R765-E796 IonicContact NH2-OE1 3.49Å; R765-E796 PolarHBondContact NH2-OE1 2.96Å; R765-E796 IonicContact NH2-OE2 3.92Å; R765-E796 PolarHBondContact NH2-OE2 2.87Å; R765-E796 PolarHBondContact O-N 2.89Å
766	M	88.1	Confident	75.4	Confident	41 Å²	41	61.4 Å²	61.4	20%	0.202	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	159.7	-179.4	65.3	173.7	-66.5	0	0	113.2	W753 T754 I768 F785 K788 A793 Q794	W753-M766 VanDerWaalsContact CE3-C 3.44Å; T754-M766 HydrophobicContact CG2-CG 3.88Å; T754-M766 WeakPolarHBondContact CG2-O 3.38Å; T754-M766 PolarHBondContact N-O 3.27Å; T754-M766 PolarHBondContact OG1-N 3.3Å; M766-I768 HydrophobicContact CE-CG2 3.69Å; M766-F785 HydrophobicContact CE-CD1 4.31Å; M766-F785 HydrophobicContact CE-CE1 4.01Å; M766-F785 HydrophobicContact CG-CE1 4.04Å; M766-F785 HydrophobicContact SD-CD1 4.41Å; M766-F785 HydrophobicContact SD-CE1 4.07Å; M766-K788 HydrophobicContact CE-CD 4.47Å; M766-A793 HydrophobicContact CE-CB 4.34Å; M766-Q794 CarbonylContact C-O 3.11Å; M766-Q794 WeakPolarHBondContact CA-O 3.43Å; M766-Q794 WeakPolarHBondContact CB-O 3.44Å
767	R	90.1	Very high	73.7	Confident	69 Å²	69	65.3 Å²	65.3	26%	0.26	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	154.8	168	61.8	179.7	-172.7	164.8	-0.1	110	Y750 W753 A793 Q794	Y750-R767 HydrophobicContact CD1-CB 4.47Å; Y750-R767 HydrophobicContact CD1-CG 3.76Å; Y750-R767 HydrophobicContact CG-CG 4.36Å; W753-R767 HydrophobicContact CD2-CB 4.16Å; W753-R767 HydrophobicContact CD2-CG 3.96Å; W753-R767 HydrophobicContact CE3-CB 3.95Å; W753-R767 HydrophobicContact CE3-CG 3.78Å; W753-R767 HydrophobicContact CH2-CG 3.91Å; W753-R767 HydrophobicContact CZ2-CG 4.09Å; W753-R767 HydrophobicContact CZ3-CB 4.36Å; W753-R767 HydrophobicContact CZ3-CG 3.76Å; R767-A793 WeakPolarHBondContact O-CA 3.29Å; R767-Q794 HydrophobicContact CG-CB 4.05Å; R767-Q794 VanDerWaalsContact CZ-OE1 3.27Å; R767-Q794 PolarHBondContact N-O 2.03Å; R767-Q794 PolarHBondContact O-N 2.82Å
768	I	88.4	Confident	72.5	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.005	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	154.4	-176	62.1	-177.1	0	0	0	112	Y750 T751 M766 C783 S784 C791 C792 A793	Y750-I768 CarbonylContact C-O 3.46Å; Y750-I768 WeakPolarHBondContact CA-O 3.36Å; T751-I768 HydrophobicContact CG2-CD1 4.38Å; T751-I768 HydrophobicContact CG2-CG1 3.58Å; T751-I768 PolarHBondContact N-O 2.79Å; T751-I768 PolarHBondContact OG1-N 3.46Å; T751-I768 VanDerWaalsContact OG1-N 3.08Å; M766-I768 HydrophobicContact CE-CG2 3.69Å; I768-C783 HydrophobicContact CD1-CB 3.93Å; I768-C783 HydrophobicContact CG1-CB 4.13Å; I768-S784 VanDerWaalsContact CD1-O 3.27Å; I768-S784 WeakPolarHBondContact CD1-O 3.11Å; I768-C791 HydrophobicContact CB-CB 4.4Å; I768-C792 CarbonylContact C-O 3.55Å; I768-C792 WeakPolarHBondContact CA-O 3.49Å; I768-A793 HydrophobicContact CG2-CB 4.22Å
769	A	86.4	Confident	71.7	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	154.3	174.7	0	0	0	0	0	111.3	S747 Y750 C783 C792	S747-A769 WeakPolarHBondContact O-CB 3.18Å; Y750-A769 HydrophobicContact CD1-CB 3.52Å; Y750-A769 HydrophobicContact CD2-CB 4.01Å; Y750-A769 HydrophobicContact CE1-CB 3.53Å; Y750-A769 HydrophobicContact CE2-CB 4.03Å; Y750-A769 HydrophobicContact CG-CB 3.76Å; A769-C783 VanDerWaalsContact C-SG 3.52Å; A769-C783 PolarHBondContact O-SG 2.02Å; A769-C792 HydrophobicContact CB-CB 4.33Å; A769-C792 PolarHBondContact N-O 3.27Å; A769-C792 WeakPolarHBondContact O-CB 3.04Å; A769-C792 PolarHBondContact O-N 3.44Å
770	P	82.8	Confident	71.4	Confident	28 Å²	28	71 Å²	71	18%	0.182	39%	0.385	C	S	.	.			trans	-57.3	144	167.6	-23.3	34	0	0	0	112.1	S747	S747-P770 PolarHBondContact N-O 2.99Å
771	I	75.8	Confident	71.1	Confident	53 Å²	53	71.8 Å²	71.8	27%	0.272	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-76	135.3	167.6	-59.5	173	0	0	0	108	C744 Q773 Q790	C744-I771 HydrophobicContact CB-CG2 4.09Å; I771-Q773 PolarHBondContact O-N 3.48Å; I771-Q790 WeakPolarHBondContact CD1-O 3.17Å
772	I	71.2	Confident	71.3	Confident	90 Å²	90	76 Å²	76	46%	0.462	41%	0.41	S	S	.	.			trans	-74.4	112.2	171.2	-59.7	176.1	0	0	0	107.7	S745 C746	S745-I772 WeakPolarHBondContact O-CB 3.42Å; S745-I772 PolarHBondContact O-N 3.17Å; C746-I772 WeakPolarHBondContact O-CD1 3.3Å
773	Q	62	Low	71.5	Confident	61 Å²	61	74.2 Å²	74.2	29%	0.285	40%	0.398	S	S	.	.			trans	-65.2	134.2	171.7	-56.3	-85.6	14.2	0	0	108.3	I771 N775 L778 S779	I771-Q773 PolarHBondContact O-N 3.48Å; Q773-N775 PolarHBondContact O-N 3.26Å; Q773-L778 HydrophobicContact CG-CB 4.02Å; Q773-S779 PolarHBondContact NE2-O 3.1Å
774	P	53.3	Low	71.7	Confident	125 Å²	125	75.7 Å²	75.7	81%	0.812	41%	0.408	S	S	*	.	S	Bend	trans	-72.8	-14	179.5	28.7	-34.8	0	0	0	113.8
775	N	54.5	Low	71.2	Confident	95 Å²	95	78 Å²	78	51%	0.508	41%	0.414	S	S	.	.	S	Bend	trans	-126.3	137	174.2	-63.2	7.2	0	0	0	109.3	Q773 E777	Q773-N775 PolarHBondContact O-N 3.26Å; N775-E777 PolarHBondContact O-N 2.79Å
776	D	52.6	Low	70.5	Confident	176 Å²	176	83.9 Å²	83.9	94%	0.941	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	4.3	178.5	-63.5	-63.6	0	0	0	115	L778	D776-L778 VanDerWaalsContact C-N 3.34Å
777	E	50.3	Low	69.8	Low	172 Å²	172	83.9 Å²	83.9	80%	0.804	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-10.5	-177.9	-61.5	-177.1	126.4	0	0	113.8	N775	N775-E777 PolarHBondContact O-N 2.79Å
778	L	54.8	Low	69	Low	111 Å²	111	85.6 Å²	85.6	58%	0.581	45%	0.454	S	S	*	.	S	Bend	trans	-115.8	131.7	-178.5	-76	162.1	0	0	0	110.8	Q773 D776	Q773-L778 HydrophobicContact CG-CB 4.02Å; D776-L778 VanDerWaalsContact C-N 3.34Å
779	S	60.1	Low	68.1	Low	98 Å²	98	91.8 Å²	91.8	69%	0.685	49%	0.492	S	S	*	.			trans	-63.1	146.4	-178.5	46.3	0	0	0	0	112.4	Q773 V781	Q773-S779 PolarHBondContact NE2-O 3.1Å; S779-V781 PolarHBondContact O-N 2.98Å
780	P	61.5	Low	67.2	Low	105 Å²	105	97.1 Å²	97.1	68%	0.682	52%	0.517	S	S	*	.			trans	-59	133.8	175.2	-25.1	34.7	0	0	0	111.7	H782	P780-H782 PolarHBondContact O-N 3.39Å; P780-H782 VanDerWaalsContact O-N 3.15Å
781	V	66	Low	67	Low	32 Å²	32	96.5 Å²	96.5	19%	0.194	51%	0.513	C	S	.	.			trans	-67.5	114.3	176.5	-177.7	0	0	0	0	109.4	S779 C783 Q790	S779-V781 PolarHBondContact O-N 2.98Å; V781-C783 PolarHBondContact O-N 2.83Å; V781-C783 VanDerWaalsContact O-N 3.11Å; V781-C783 PolarHBondContact O-SG 3.47Å; V781-Q790 HydrophobicContact CG1-CB 3.85Å
782	H	75.8	Confident	67.3	Low	160 Å²	160	94.6 Å²	94.6	74%	0.741	51%	0.505	S	S	*	.			trans	-74.1	100.2	176.6	-176.6	-69.9	0	0	0	110.3	P780 N787	P780-H782 PolarHBondContact O-N 3.39Å; P780-H782 VanDerWaalsContact O-N 3.15Å; H782-N787 PolarHBondContact O-ND2 3.39Å
783	C	75.7	Confident	67.8	Low	24 Å²	24	93 Å²	93	16%	0.162	51%	0.505	C	S	.	.			trans	-79.3	129.1	-171.1	-70.8	0	0	0	0	114.5	I768 A769 V781 C791	I768-C783 HydrophobicContact CD1-CB 3.93Å; I768-C783 HydrophobicContact CG1-CB 4.13Å; A769-C783 VanDerWaalsContact C-SG 3.52Å; A769-C783 PolarHBondContact O-SG 2.02Å; V781-C783 PolarHBondContact O-N 2.83Å; V781-C783 VanDerWaalsContact O-N 3.11Å; V781-C783 PolarHBondContact O-SG 3.47Å; C783-C791 WeakPolarHBondContact CA-SG 3.46Å; C783-C791 HydrophobicContact CB-CB 4.03Å; C783-C791 WeakPolarHBondContact CB-SG 2.99Å; C783-C791 WeakPolarHBondContact SG-CB 3.26Å; C783-C791 CovalentContact SG-SG 2.03Å; C783-C791 PolarHBondContact SG-SG 3.5Å
784	S	82.8	Confident	68.9	Low	34 Å²	34	93.5 Å²	93.5	24%	0.238	51%	0.507	C	S	.	.			trans	-132.9	168.6	168.9	84.6	0	0	0	0	110	I768 E786 N787 K788	I768-S784 VanDerWaalsContact CD1-O 3.27Å; I768-S784 WeakPolarHBondContact CD1-O 3.11Å; S784-E786 PolarHBondContact O-N 2.85Å; S784-E786 WeakPolarHBondContact OG-CB 3.28Å; S784-E786 PolarHBondContact OG-N 2.04Å; S784-E786 VanDerWaalsContact OG-N 3.15Å; S784-N787 PolarHBondContact N-OD1 3.09Å; S784-N787 PolarHBondContact O-N 2.66Å; S784-N787 PolarHBondContact O-OD1 3.4Å; S784-N787 VanDerWaalsContact O-OD1 3.1Å; S784-N787 PolarHBondContact OG-N 3.3Å; S784-N787 PolarHBondContact OG-OD1 3.18Å; S784-K788 PolarHBondContact O-N 2.8Å
785	F	75	Confident	70.5	Confident	102 Å²	102	92 Å²	92	45%	0.447	50%	0.496	S	S	.	.	S	Bend	trans	-68.2	-16.8	174.5	-75.6	-80.8	0	0	0	113.4	T754 M766	T754-F785 HydrophobicContact CG2-CE1 3.64Å; T754-F785 HydrophobicContact CG2-CZ 3.55Å; M766-F785 HydrophobicContact CE-CD1 4.31Å; M766-F785 HydrophobicContact CE-CE1 4.01Å; M766-F785 HydrophobicContact CG-CE1 4.04Å; M766-F785 HydrophobicContact SD-CD1 4.41Å; M766-F785 HydrophobicContact SD-CE1 4.07Å
786	E	74.2	Confident	72	Confident	185 Å²	185	90.7 Å²	90.7	86%	0.864	49%	0.487	S	S	*	.	S	Bend	trans	-79	-40.9	178.2	-54.5	171.7	141.5	0	0	111.3	S784	S784-E786 PolarHBondContact O-N 2.85Å; S784-E786 WeakPolarHBondContact OG-CB 3.28Å; S784-E786 PolarHBondContact OG-N 2.04Å; S784-E786 VanDerWaalsContact OG-N 3.15Å
787	N	72.6	Confident	73.5	Confident	40 Å²	40	86.6 Å²	86.6	21%	0.214	47%	0.468	C	S	.	.	S	Bend	trans	-100.4	19.6	178.9	75.2	-5.3	0	0	0	114	H782 S784 T789 Q790	H782-N787 PolarHBondContact O-ND2 3.39Å; S784-N787 PolarHBondContact N-OD1 3.09Å; S784-N787 PolarHBondContact O-N 2.66Å; S784-N787 PolarHBondContact O-OD1 3.4Å; S784-N787 VanDerWaalsContact O-OD1 3.1Å; S784-N787 PolarHBondContact OG-N 3.3Å; S784-N787 PolarHBondContact OG-OD1 3.18Å; N787-T789 PolarHBondContact O-N 2.87Å; N787-Q790 WeakPolarHBondContact O-CB 3.44Å; N787-Q790 PolarHBondContact O-N 3.11Å
788	K	72.5	Confident	75	Confident	105 Å²	105	80.7 Å²	80.7	46%	0.457	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-50.2	-20.1	-174.8	69.5	-178.3	-178.7	-177.2	0	116.4	M766 S784 Q790 C791	M766-K788 HydrophobicContact CE-CD 4.47Å; S784-K788 PolarHBondContact O-N 2.8Å; K788-Q790 VanDerWaalsContact C-N 3.26Å; K788-Q790 PolarHBondContact O-N 3.48Å; K788-C791 PolarHBondContact O-N 2.66Å
789	T	69.8	Low	75.6	Confident	132 Å²	132	79.1 Å²	79.1	81%	0.81	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-73.9	-11.9	174.8	49.3	0	0	0	0	114	N787	N787-T789 PolarHBondContact O-N 2.87Å
790	Q	69.1	Low	76.1	Confident	112 Å²	112	79.4 Å²	79.4	52%	0.523	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-100	3.5	176.3	-57.9	-178.3	-37.6	0	0	112.6	I771 V781 N787 K788	I771-Q790 WeakPolarHBondContact CD1-O 3.17Å; V781-Q790 HydrophobicContact CG1-CB 3.85Å; N787-Q790 WeakPolarHBondContact O-CB 3.44Å; N787-Q790 PolarHBondContact O-N 3.11Å; K788-Q790 VanDerWaalsContact C-N 3.26Å; K788-Q790 PolarHBondContact O-N 3.48Å
791	C	78.6	Confident	76.6	Confident	14 Å²	14	75.1 Å²	75.1	10%	0.095	41%	0.413	C	S	.	.	S	Bend	trans	-122.9	155.9	-170	-65.8	0	0	0	0	111.3	I768 C783 K788 A793	I768-C791 HydrophobicContact CB-CB 4.4Å; C783-C791 WeakPolarHBondContact CA-SG 3.46Å; C783-C791 HydrophobicContact CB-CB 4.03Å; C783-C791 WeakPolarHBondContact CB-SG 2.99Å; C783-C791 WeakPolarHBondContact SG-CB 3.26Å; C783-C791 CovalentContact SG-SG 2.03Å; C783-C791 PolarHBondContact SG-SG 3.5Å; K788-C791 PolarHBondContact O-N 2.66Å; C791-A793 PolarHBondContact O-N 2.99Å
792	C	80.5	Confident	76.9	Confident	14 Å²	14	83.5 Å²	83.5	10%	0.095	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	134.8	160.3	-78.9	0	0	0	0	109.4	C746 I768 A769	C746-C792 WeakPolarHBondContact CA-SG 3.06Å; C746-C792 HydrophobicContact CB-CB 3.62Å; C746-C792 WeakPolarHBondContact CB-SG 3.3Å; C746-C792 WeakPolarHBondContact SG-CB 3.4Å; C746-C792 CovalentContact SG-SG 2.03Å; C746-C792 PolarHBondContact SG-SG 2.74Å; I768-C792 CarbonylContact C-O 3.55Å; I768-C792 WeakPolarHBondContact CA-O 3.49Å; A769-C792 HydrophobicContact CB-CB 4.33Å; A769-C792 PolarHBondContact N-O 3.27Å; A769-C792 WeakPolarHBondContact O-CB 3.04Å; A769-C792 PolarHBondContact O-N 3.44Å
793	A	83.3	Confident	76.6	Confident	57 Å²	57	78.5 Å²	78.5	47%	0.471	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	129.7	172.7	0	0	0	0	0	109.7	M766 R767 I768 C791	M766-A793 HydrophobicContact CE-CB 4.34Å; R767-A793 WeakPolarHBondContact O-CA 3.29Å; I768-A793 HydrophobicContact CG2-CB 4.22Å; C791-A793 PolarHBondContact O-N 2.99Å
794	Q	85.1	Confident	76.1	Confident	70 Å²	70	83.3 Å²	83.3	33%	0.327	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	135.2	167.1	-74.2	-177.7	-2.9	0	0	108.9	Y750 W753 M766 R767	Y750-Q794 HydrophobicContact CE1-CB 4.22Å; Y750-Q794 HydrophobicContact CE1-CG 3.67Å; Y750-Q794 VanDerWaalsContact CZ-NE2 3.3Å; Y750-Q794 PolarHBondContact OH-NE2 3.48Å; Y750-Q794 VanDerWaalsContact OH-NE2 3.07Å; W753-Q794 HydrophobicContact CH2-CB 4.23Å; M766-Q794 CarbonylContact C-O 3.11Å; M766-Q794 WeakPolarHBondContact CA-O 3.43Å; M766-Q794 WeakPolarHBondContact CB-O 3.44Å; R767-Q794 HydrophobicContact CG-CB 4.05Å; R767-Q794 VanDerWaalsContact CZ-OE1 3.27Å; R767-Q794 PolarHBondContact N-O 2.03Å; R767-Q794 PolarHBondContact O-N 2.82Å
795	T	85.6	Confident	75	Confident	94 Å²	94	86.6 Å²	86.6	58%	0.577	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	133.7	176.6	-55.2	0	0	0	0	108.7	R765	R765-T795 CarbonylContact O-C 3.53Å; R765-T795 WeakPolarHBondContact O-CA 3.25Å
796	E	87.2	Confident	74.1	Confident	67 Å²	67	84.6 Å²	84.6	31%	0.313	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	136.2	176.1	-169.7	-175.5	155.7	0	0	109	W753 W756 T764 R765	W753-E796 HydrophobicContact CH2-CB 3.72Å; W753-E796 HydrophobicContact CZ2-CB 4.42Å; W753-E796 WeakPolarHBondContact CZ2-OE2 3.37Å; W753-E796 HydrophobicContact CZ3-CB 3.8Å; W756-E796 HydrophobicContact CH2-CB 4.36Å; W756-E796 HydrophobicContact CH2-CG 3.9Å; T764-E796 VanDerWaalsContact CA-O 3.31Å; T764-E796 WeakPolarHBondContact CA-O 3.01Å; R765-E796 HydrophobicContact CG-CB 4Å; R765-E796 IonicContact CZ-OE1 3.73Å; R765-E796 IonicContact CZ-OE2 3.12Å; R765-E796 PolarHBondContact N-O 2.94Å; R765-E796 IonicContact NE-OE1 2.65Å; R765-E796 IonicContact NE-OE2 3.63Å; R765-E796 PolarHBondContact NE-OE2 3.15Å; R765-E796 IonicContact NH2-OE1 3.49Å; R765-E796 PolarHBondContact NH2-OE1 2.96Å; R765-E796 IonicContact NH2-OE2 3.92Å; R765-E796 PolarHBondContact NH2-OE2 2.87Å; R765-E796 PolarHBondContact O-N 2.89Å
797	T	83.7	Confident	73.1	Confident	90 Å²	90	81 Å²	81	55%	0.552	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113	127.9	-178.6	47.1	0	0	0	0	110	T764 P799	T764-T797 HydrophobicContact CG2-CG2 3.92Å; T797-P799 WeakPolarHBondContact O-CD 3.28Å
798	N	81.2	Confident	71.6	Confident	49 Å²	49	83.8 Å²	83.8	26%	0.262	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	98.3	171.7	-179.4	6.2	0	0	0	109.5	W756 S763 S800 S801	W756-N798 HydrophobicContact CE3-CB 4.02Å; W756-N798 HydrophobicContact CH2-CB 3.68Å; W756-N798 HydrophobicContact CZ2-CB 4.29Å; W756-N798 HydrophobicContact CZ3-CB 3.51Å; S763-N798 PolarHBondContact N-O 2.61Å; S763-N798 PolarHBondContact O-N 2.8Å; N798-S800 PolarHBondContact O-N 2.88Å; N798-S800 WeakPolarHBondContact OD1-CA 3.43Å; N798-S800 WeakPolarHBondContact OD1-CB 3.45Å; N798-S800 PolarHBondContact OD1-N 2.97Å; N798-S801 PolarHBondContact O-OG 3.3Å
799	P	67.6	Low	70.4	Confident	78 Å²	78	83.1 Å²	83.1	51%	0.506	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-9.7	175.2	30.9	-35.6	0	0	0	113.4	K761 T797	K761-P799 WeakPolarHBondContact CE-O 3.02Å; K761-P799 PolarHBondContact NZ-O 3.4Å; T797-P799 WeakPolarHBondContact O-CD 3.28Å
800	S	70.1	Confident	68.7	Low	103 Å²	103	82.7 Å²	82.7	72%	0.72	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	12.4	-178	-51.1	0	0	0	0	113.6	N798	N798-S800 PolarHBondContact O-N 2.88Å; N798-S800 WeakPolarHBondContact OD1-CA 3.43Å; N798-S800 WeakPolarHBondContact OD1-CB 3.45Å; N798-S800 PolarHBondContact OD1-N 2.97Å
801	S	71.8	Confident	67.1	Low	16 Å²	16	87.2 Å²	87.2	11%	0.112	47%	0.47	C	S	.	.			trans	-67.4	137.8	171.8	57.4	0	0	0	0	111.7	S763 N798 L803	S763-S801 PolarHBondContact N-OG 2.98Å; N798-S801 PolarHBondContact O-OG 3.3Å; S801-L803 PolarHBondContact O-N 3.02Å; S801-L803 VanDerWaalsContact O-N 3.08Å
802	E	73	Confident	65.1	Low	207 Å²	207	88 Å²	88	97%	0.967	48%	0.48	S	S	*	.	S	Bend	trans	-71	5.1	176.3	-59.5	179.9	153.9	0	0	114.3
803	L	69.7	Low	63.4	Low	56 Å²	56	91 Å²	91	29%	0.293	50%	0.498	S	S	.	.	S	Bend	trans	-73.1	148.1	177.3	-56.3	171.8	0	0	0	111.2	S757 K761 S801	S757-L803 VanDerWaalsContact O-CD1 3.29Å; S757-L803 WeakPolarHBondContact O-CD1 3.43Å; K761-L803 HydrophobicContact CB-CB 4.31Å; K761-L803 WeakPolarHBondContact CB-O 3Å; S801-L803 PolarHBondContact O-N 3.02Å; S801-L803 VanDerWaalsContact O-N 3.08Å
804	E	64.2	Low	61.4	Low	125 Å²	125	91.8 Å²	91.8	58%	0.584	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-59.7	150.1	168.6	-68.1	-168.7	-160.4	0	0	111.6	C760 K761 N808	C760-E804 CarbonylContact C-O 3.52Å; C760-E804 WeakPolarHBondContact CA-O 3.41Å; C760-E804 WeakPolarHBondContact CB-O 3.04Å; K761-E804 PolarHBondContact N-O 3.49Å; E804-N808 PolarHBondContact OE2-ND2 2.83Å
805	E	61	Low	59.5	Low	103 Å²	103	94.1 Å²	94.1	48%	0.481	51%	0.508	S	S	.	.	B	Isolated β-bridge	trans	-62.1	145.3	177.9	-66.5	-165.4	166.3	0	0	112.3	K761 T807 N808	K761-E805 HydrophobicContact CD-CG 4.45Å; E805-T807 WeakPolarHBondContact CB-OG1 3.47Å; E805-T807 PolarHBondContact O-N 3.39Å; E805-T807 PolarHBondContact OE2-OG1 2.81Å; E805-N808 PolarHBondContact O-N 3.42Å
806	C	56	Low	57.5	Low	59 Å²	59	91.5 Å²	91.5	40%	0.399	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-8.2	174.9	-56.8	0	0	0	0	113.5	C760 K761 Y809	C760-C806 HydrophobicContact CB-CB 3.86Å; C760-C806 WeakPolarHBondContact CB-SG 3.33Å; C760-C806 VanDerWaalsContact SG-CA 3.51Å; C760-C806 WeakPolarHBondContact SG-CB 3.45Å; C760-C806 CovalentContact SG-SG 2.04Å; C760-C806 PolarHBondContact SG-SG 3.34Å; K761-C806 PolarHBondContact O-N 2.95Å; K761-C806 PolarHBondContact O-SG 3.3Å; C806-Y809 PolarHBondContact O-N 2.83Å
807	T	51.9	Low	55.5	Low	109 Å²	109	88.6 Å²	88.6	67%	0.669	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-29.9	170.7	47.5	0	0	0	0	112.8	E805 Y809	E805-T807 WeakPolarHBondContact CB-OG1 3.47Å; E805-T807 PolarHBondContact O-N 3.39Å; E805-T807 PolarHBondContact OE2-OG1 2.81Å; T807-Y809 VanDerWaalsContact C-N 3.32Å
808	N	42.2	Very low	53.9	Low	100 Å²	100	89.6 Å²	89.6	54%	0.535	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-19.8	173.7	-70.2	-0.8	0	0	0	112.5	E804 E805 V810	E804-N808 PolarHBondContact OE2-ND2 2.83Å; E805-N808 PolarHBondContact O-N 3.42Å; N808-V810 PolarHBondContact O-N 2.04Å
809	Y	45.9	Very low	52.4	Low	91 Å²	91	93.3 Å²	93.3	36%	0.357	51%	0.506	S	S	.	.			trans	-78.7	85.9	-177.3	-95.2	-89.7	0	0	0	111.8	T759 C760 C806 T807 Y811 T813	T759-Y809 HydrophobicContact CG2-CD1 4.39Å; T759-Y809 HydrophobicContact CG2-CE1 3.93Å; T759-Y809 HydrophobicContact CG2-CE2 4.48Å; T759-Y809 WeakPolarHBondContact O-CE2 3.14Å; T759-Y809 PolarHBondContact O-OH 2.97Å; C760-Y809 HydrophobicContact CB-CD2 3.59Å; C760-Y809 HydrophobicContact CB-CE2 3.78Å; C760-Y809 HydrophobicContact CB-CG 4.45Å; C806-Y809 PolarHBondContact O-N 2.83Å; T807-Y809 VanDerWaalsContact C-N 3.32Å; Y809-Y811 PolarHBondContact O-N 2.04Å; Y809-T813 HydrophobicContact CD1-CG2 4.02Å; Y809-T813 WeakPolarHBondContact CD1-OG1 3.41Å; Y809-T813 HydrophobicContact CE1-CG2 3.83Å; Y809-T813 VanDerWaalsContact CE1-OG1 3.31Å; Y809-T813 WeakPolarHBondContact CE1-OG1 3.43Å
810	V	36	Very low	51.8	Low	122 Å²	122	95 Å²	95	74%	0.739	51%	0.507	S	S	*	.			trans	-54.2	137.8	165.7	-176.6	0	0	0	0	109.6	N808 G812	N808-V810 PolarHBondContact O-N 2.04Å; V810-G812 PolarHBondContact O-N 3.47Å
811	Y	34.1	Very low	51.9	Low	207 Å²	207	96.3 Å²	96.3	81%	0.812	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.6	111.2	172.6	-91.4	-102.9	0	0	0	110.2	Y809 M848	Y809-Y811 PolarHBondContact O-N 2.04Å; Y811-M848 WeakPolarHBondContact O-CE 3.43Å
812	G	37.5	Very low	52.3	Low	30 Å²	30	96.2 Å²	96.2	31%	0.309	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	172.3	-32.4	-175.3	0	0	0	0	0	116.3	V810 N814	V810-G812 PolarHBondContact O-N 3.47Å; G812-N814 PolarHBondContact O-N 2.8Å
813	T	45	Very low	52.5	Low	77 Å²	77	88.6 Å²	88.6	47%	0.472	47%	0.474	S	S	.	.	S	Bend	trans	-92.5	111.6	-163.4	57.4	0	0	0	0	114.9	Y809 I815	Y809-T813 HydrophobicContact CD1-CG2 4.02Å; Y809-T813 WeakPolarHBondContact CD1-OG1 3.41Å; Y809-T813 HydrophobicContact CE1-CG2 3.83Å; Y809-T813 VanDerWaalsContact CE1-OG1 3.31Å; Y809-T813 WeakPolarHBondContact CE1-OG1 3.43Å; T813-I815 VanDerWaalsContact C-N 3.27Å; T813-I815 PolarHBondContact O-N 2.71Å
814	N	40.7	Very low	52.7	Low	74 Å²	74	95 Å²	95	40%	0.396	50%	0.5	S	S	.	.	S	Bend	trans	58.2	-24.4	154.9	-133.3	8	0	0	0	120.9	G812	G812-N814 PolarHBondContact O-N 2.8Å
815	I	44.7	Very low	53.1	Low	120 Å²	120	94.1 Å²	94.1	62%	0.615	51%	0.505	S	S	*	.	S	Bend	trans	-86.5	-42.5	174	-80.6	176.5	0	0	0	111.6	T813 L817 V818	T813-I815 VanDerWaalsContact C-N 3.27Å; T813-I815 PolarHBondContact O-N 2.71Å; I815-L817 VanDerWaalsContact C-N 3.31Å; I815-L817 PolarHBondContact O-N 3.31Å; I815-V818 PolarHBondContact O-N 2.83Å
816	S	43.6	Very low	53.4	Low	38 Å²	38	89.2 Å²	89.2	27%	0.266	48%	0.482	S	S	.	.	H	α-helix	trans	-64.8	-34.3	-176	-46.1	0	0	0	0	112.8	V818 N819 H820	S816-V818 PolarHBondContact O-N 3.06Å; S816-N819 PolarHBondContact O-N 3.46Å; S816-N819 VanDerWaalsContact O-N 3.12Å; S816-H820 PolarHBondContact O-N 3.5Å
817	L	45.1	Very low	54.7	Low	6 Å²	6	87 Å²	87	3%	0.031	47%	0.47	C	S	.	.	H	α-helix	trans	-71.4	-6.3	178	-79.8	161.1	0	0	0	115.3	I815 F837 F849	I815-L817 VanDerWaalsContact C-N 3.31Å; I815-L817 PolarHBondContact O-N 3.31Å; L817-F837 HydrophobicContact CD1-CB 4.05Å; L817-F837 WeakPolarHBondContact CD1-O 3.27Å; L817-F849 HydrophobicContact CD2-CD1 3.83Å; L817-F849 HydrophobicContact CD2-CE1 3.71Å; L817-F849 HydrophobicContact CG-CE1 3.9Å
818	V	50	Low	56.3	Low	111 Å²	111	89.2 Å²	89.2	67%	0.673	47%	0.466	S	S	*	.	H	α-helix	trans	-82.4	-35.2	168.7	-178.8	0	0	0	0	110.5	I815 S816	I815-V818 PolarHBondContact O-N 2.83Å; S816-V818 PolarHBondContact O-N 3.06Å
819	N	49.6	Very low	58.3	Low	128 Å²	128	89.9 Å²	89.9	68%	0.684	46%	0.461	S	S	*	.	H	α-helix	trans	-97.7	-22	-175.6	-65.5	-27.9	0	0	0	113.3	S816	S816-N819 PolarHBondContact O-N 3.46Å; S816-N819 VanDerWaalsContact O-N 3.12Å
820	H	55.9	Low	60.2	Low	114 Å²	114	87.3 Å²	87.3	53%	0.528	45%	0.454	S	S	.	.	S	Bend	trans	-123.8	116.3	-179.8	-69.9	48.6	0	0	0	109.2	S816 F849	S816-H820 PolarHBondContact O-N 3.5Å; H820-F849 HydrophobicContact CB-CD1 3.75Å; H820-F849 HydrophobicContact CB-CD2 4.49Å; H820-F849 HydrophobicContact CB-CE1 3.48Å; H820-F849 VanDerWaalsContact CB-CE1 3.48Å; H820-F849 HydrophobicContact CB-CE2 4.27Å; H820-F849 HydrophobicContact CB-CG 4.26Å; H820-F849 HydrophobicContact CB-CZ 3.77Å
821	N	71.6	Confident	62.2	Low	129 Å²	129	85.3 Å²	85.3	69%	0.69	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-73.6	157.3	170.4	-78.8	-55	0	0	0	110.4	S823	N821-S823 PolarHBondContact O-N 3.27Å
822	C	79.8	Confident	64	Low	14 Å²	14	77.8 Å²	77.8	10%	0.095	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-56.8	133.2	164.7	-45.6	0	0	0	0	109.7	G827 C839 F849	C822-G827 WeakPolarHBondContact CB-O 3.38Å; C822-C839 WeakPolarHBondContact CA-SG 3.25Å; C822-C839 HydrophobicContact CB-CB 3.88Å; C822-C839 WeakPolarHBondContact CB-SG 3.46Å; C822-C839 WeakPolarHBondContact SG-CB 3.41Å; C822-C839 CovalentContact SG-SG 2.04Å; C822-C839 PolarHBondContact SG-SG 2.86Å; C822-F849 CarbonylContact C-O 3.58Å; C822-F849 VanDerWaalsContact CA-O 3.28Å; C822-F849 WeakPolarHBondContact CA-O 3.35Å
823	S	77.5	Confident	65.9	Low	48 Å²	48	86.2 Å²	86.2	34%	0.336	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-58.3	143.4	178.5	-168.6	0	0	0	0	110.7	N821 G826 G827 F849 C850	N821-S823 PolarHBondContact O-N 3.27Å; S823-G826 CarbonylContact O-C 3.58Å; S823-G826 PolarHBondContact O-N 3.31Å; S823-G827 PolarHBondContact O-N 3.18Å; S823-F849 PolarHBondContact N-O 3.08Å; S823-C850 VanDerWaalsContact CB-O 3.3Å; S823-C850 WeakPolarHBondContact CB-O 3.08Å
824	K	74.7	Confident	67.2	Low	189 Å²	189	90.8 Å²	90.8	82%	0.822	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	132.7	178.8	-69.8	-173.4	177.7	-177.8	0	109.7
825	P	71.6	Confident	68.5	Low	107 Å²	107	89.7 Å²	89.7	70%	0.695	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	cis	-81.7	-4.1	7.1	34.2	-37	0	0	0	115.1	G827	P825-G827 VanDerWaalsContact C-N 3.34Å; P825-G827 PolarHBondContact O-N 3.08Å; P825-G827 VanDerWaalsContact O-N 3.14Å
826	G	68.5	Low	69.5	Low	0 Å²	0	87.9 Å²	87.9	0%	0	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-18.2	-164.1	0	0	0	0	0	118.8	S823 C841 A842 Y845 C850	S823-G826 CarbonylContact O-C 3.58Å; S823-G826 PolarHBondContact O-N 3.31Å; G826-C841 CarbonylContact O-C 3.36Å; G826-C841 VanDerWaalsContact O-CA 3.3Å; G826-C841 WeakPolarHBondContact O-CA 3.25Å; G826-A842 PolarHBondContact O-N 2.76Å; G826-Y845 VanDerWaalsContact CA-CD1 3.4Å; G826-Y845 VanDerWaalsContact CA-CG 3.4Å; G826-Y845 WeakPolarHBondContact O-CB 3.44Å; G826-C850 VanDerWaalsContact O-CB 3.22Å; G826-C850 WeakPolarHBondContact O-CB 3.09Å
827	G	82.6	Confident	70.8	Confident	14 Å²	14	90 Å²	90	14%	0.144	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	145.9	-174.1	0	0	0	0	0	116.3	C822 S823 P825 Q840	C822-G827 WeakPolarHBondContact CB-O 3.38Å; S823-G827 PolarHBondContact O-N 3.18Å; P825-G827 VanDerWaalsContact C-N 3.34Å; P825-G827 PolarHBondContact O-N 3.08Å; P825-G827 VanDerWaalsContact O-N 3.14Å; G827-Q840 WeakPolarHBondContact CA-O 3.46Å
828	R	86.3	Confident	72.3	Confident	154 Å²	154	94.8 Å²	94.8	58%	0.581	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	139.1	172	70.7	-178.2	-168	178.8	4.1	111.1	V830 C839 Q840	R828-V830 HydrophobicContact CG-CG1 4.38Å; R828-C839 WeakPolarHBondContact O-CA 3.5Å; R828-Q840 HydrophobicContact CG-CB 4.04Å; R828-Q840 VanDerWaalsContact CZ-OE1 3.25Å; R828-Q840 PolarHBondContact N-O 2.03Å; R828-Q840 PolarHBondContact O-N 2.98Å
829	R	83.4	Confident	73.9	Confident	114 Å²	114	90.5 Å²	90.5	43%	0.43	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	128.1	175	-174.1	173.2	176	157.7	-1.5	109.7	F837	R829-F837 HydrophobicContact CG-CD1 4.1Å; R829-F837 VanDerWaalsContact NH2-CG 3.33Å; R829-F837 VanDerWaalsContact NH2-CZ 3.32Å
830	V	86.3	Confident	75.7	Confident	37 Å²	37	88.6 Å²	88.6	22%	0.224	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	170.1	175.8	-77.3	0	0	0	0	110	R828 K838 Q840	R828-V830 HydrophobicContact CG-CG1 4.38Å; V830-K838 HydrophobicContact CG2-CD 4.45Å; V830-K838 HydrophobicContact CG2-CG 4.16Å; V830-K838 PolarHBondContact N-O 3.2Å; V830-K838 PolarHBondContact O-N 2.04Å; V830-Q840 HydrophobicContact CG2-CB 3.58Å
831	V	78.4	Confident	77.1	Confident	81 Å²	81	85.3 Å²	85.3	49%	0.491	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	148.2	179.3	-168.1	0	0	0	0	108.6	H836 F837	V831-H836 CarbonylContact C-O 3.57Å; V831-H836 VanDerWaalsContact CA-O 3.27Å; V831-H836 WeakPolarHBondContact CA-O 3.03Å; V831-H836 WeakPolarHBondContact CG1-O 3.43Å; V831-F837 HydrophobicContact CG2-CD1 4.06Å; V831-F837 HydrophobicContact CG2-CE1 4.03Å
832	D	71.7	Confident	77.6	Confident	49 Å²	49	81.4 Å²	81.4	26%	0.262	42%	0.417	S	S	.	.			trans	-88.1	176	169.9	80	-2.9	0	0	0	112.5	K834 G835 H836 K838	D832-K834 PolarHBondContact O-N 2.9Å; D832-K834 VanDerWaalsContact O-N 3.11Å; D832-K834 VanDerWaalsContact OD1-C 3.28Å; D832-K834 WeakPolarHBondContact OD1-CA 2.99Å; D832-K834 WeakPolarHBondContact OD1-CB 3.21Å; D832-K834 PolarHBondContact OD1-N 3.43Å; D832-G835 PolarHBondContact O-N 3.25Å; D832-G835 PolarHBondContact OD1-N 3.06Å; D832-H836 PolarHBondContact N-O 2.87Å; D832-H836 IonicContact OD1-CG 2.77Å; D832-H836 PolarHBondContact OD1-N 3.17Å; D832-H836 IonicContact OD1-ND1 2.72Å; D832-H836 PolarHBondContact OD1-ND1 3.34Å; D832-H836 IonicContact OD2-CE1 3.97Å; D832-H836 IonicContact OD2-CG 3.72Å; D832-H836 IonicContact OD2-ND1 3.16Å; D832-H836 PolarHBondContact OD2-ND1 3.36Å; D832-K838 HydrophobicContact CB-CD 4.41Å
833	E	77.3	Confident	77.3	Confident	206 Å²	206	90.1 Å²	90.1	96%	0.963	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-9.5	179.4	-62.8	174.5	176.3	0	0	113.7
834	K	72.4	Confident	76.7	Confident	174 Å²	174	89.4 Å²	89.4	76%	0.757	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	1.7	-178.7	-61.4	179.2	-179.1	179.9	0	112.5	D832	D832-K834 PolarHBondContact O-N 2.9Å; D832-K834 VanDerWaalsContact O-N 3.11Å; D832-K834 VanDerWaalsContact OD1-C 3.28Å; D832-K834 WeakPolarHBondContact OD1-CA 2.99Å; D832-K834 WeakPolarHBondContact OD1-CB 3.21Å; D832-K834 PolarHBondContact OD1-N 3.43Å
835	G	68.3	Low	76.6	Confident	50 Å²	50	83.3 Å²	83.3	52%	0.515	43%	0.429	S	S	.	.	S	Bend	trans	89	5.1	178.6	0	0	0	0	0	115.5	D832	D832-G835 PolarHBondContact O-N 3.25Å; D832-G835 PolarHBondContact OD1-N 3.06Å
836	H	64	Low	76.5	Confident	82 Å²	82	82.3 Å²	82.3	38%	0.38	42%	0.415	S	S	.	.			trans	-80.3	146.5	176.6	-47.6	111.2	0	0	0	111.7	V831 D832	V831-H836 CarbonylContact C-O 3.57Å; V831-H836 VanDerWaalsContact CA-O 3.27Å; V831-H836 WeakPolarHBondContact CA-O 3.03Å; V831-H836 WeakPolarHBondContact CG1-O 3.43Å; D832-H836 PolarHBondContact N-O 2.87Å; D832-H836 IonicContact OD1-CG 2.77Å; D832-H836 PolarHBondContact OD1-N 3.17Å; D832-H836 IonicContact OD1-ND1 2.72Å; D832-H836 PolarHBondContact OD1-ND1 3.34Å; D832-H836 IonicContact OD2-CE1 3.97Å; D832-H836 IonicContact OD2-CG 3.72Å; D832-H836 IonicContact OD2-ND1 3.16Å; D832-H836 PolarHBondContact OD2-ND1 3.36Å
837	F	71.7	Confident	76.5	Confident	82 Å²	82	83.9 Å²	83.9	36%	0.36	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	143.9	168.4	-63	-70.9	0	0	0	111.5	L817 R829 V831	L817-F837 HydrophobicContact CD1-CB 4.05Å; L817-F837 WeakPolarHBondContact CD1-O 3.27Å; R829-F837 HydrophobicContact CG-CD1 4.1Å; R829-F837 VanDerWaalsContact NH2-CG 3.33Å; R829-F837 VanDerWaalsContact NH2-CZ 3.32Å; V831-F837 HydrophobicContact CG2-CD1 4.06Å; V831-F837 HydrophobicContact CG2-CE1 4.03Å
838	K	77.8	Confident	76	Confident	107 Å²	107	86.2 Å²	86.2	47%	0.465	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	154.2	168.3	41.8	162	-177	-173.4	0	109.6	V830 D832	V830-K838 HydrophobicContact CG2-CD 4.45Å; V830-K838 HydrophobicContact CG2-CG 4.16Å; V830-K838 PolarHBondContact N-O 3.2Å; V830-K838 PolarHBondContact O-N 2.04Å; D832-K838 HydrophobicContact CB-CD 4.41Å
839	C	83.3	Confident	75.6	Confident	21 Å²	21	80.1 Å²	80.1	14%	0.142	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	139.5	166.5	-63.7	0	0	0	0	109.6	C822 R828 M848	C822-C839 WeakPolarHBondContact CA-SG 3.25Å; C822-C839 HydrophobicContact CB-CB 3.88Å; C822-C839 WeakPolarHBondContact CB-SG 3.46Å; C822-C839 WeakPolarHBondContact SG-CB 3.41Å; C822-C839 CovalentContact SG-SG 2.04Å; C822-C839 PolarHBondContact SG-SG 2.86Å; R828-C839 WeakPolarHBondContact O-CA 3.5Å; C839-M848 WeakPolarHBondContact CB-O 3.34Å
840	Q	87.5	Confident	75.5	Confident	88 Å²	88	74.7 Å²	74.7	41%	0.411	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	124	166.8	173.6	176.8	16.5	0	0	107.6	G827 R828 V830	G827-Q840 WeakPolarHBondContact CA-O 3.46Å; R828-Q840 HydrophobicContact CG-CB 4.04Å; R828-Q840 VanDerWaalsContact CZ-OE1 3.25Å; R828-Q840 PolarHBondContact N-O 2.03Å; R828-Q840 PolarHBondContact O-N 2.98Å; V830-Q840 HydrophobicContact CG2-CB 3.58Å
841	C	83.6	Confident	74.9	Confident	45 Å²	45	77.4 Å²	77.4	30%	0.304	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	152.1	-172.8	-50.6	0	0	0	0	112.5	G826 Y845 C850	G826-C841 CarbonylContact O-C 3.36Å; G826-C841 VanDerWaalsContact O-CA 3.3Å; G826-C841 WeakPolarHBondContact O-CA 3.25Å; C841-Y845 WeakPolarHBondContact CB-O 3.42Å; C841-C850 WeakPolarHBondContact CA-SG 3.49Å; C841-C850 HydrophobicContact CB-CB 3.69Å; C841-C850 WeakPolarHBondContact CB-SG 3.19Å; C841-C850 PolarHBondContact N-SG 3.06Å; C841-C850 VanDerWaalsContact N-SG 3.38Å; C841-C850 VanDerWaalsContact SG-CA 3.51Å; C841-C850 WeakPolarHBondContact SG-CB 3.5Å; C841-C850 CovalentContact SG-SG 2.04Å; C841-C850 PolarHBondContact SG-SG 3.01Å
842	A	82.7	Confident	74.3	Confident	47 Å²	47	78.1 Å²	78.1	39%	0.388	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-70.9	162.8	164.6	0	0	0	0	0	109.5	G826 G844 Y845	G826-A842 PolarHBondContact O-N 2.76Å; A842-G844 PolarHBondContact O-N 2.75Å; A842-Y845 HydrophobicContact CB-CD2 4.07Å; A842-Y845 PolarHBondContact O-N 2.89Å
843	E	74.4	Confident	73.7	Confident	198 Å²	198	78.7 Å²	78.7	93%	0.925	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	128.9	-176.8	-165.9	168.6	179	0	0	111.8	Y845	E843-Y845 VanDerWaalsContact C-N 3.31Å; E843-Y845 PolarHBondContact O-N 2.8Å
844	G	64.4	Low	72.5	Confident	32 Å²	32	70.9 Å²	70.9	33%	0.33	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	-22.1	-174.2	0	0	0	0	0	116.2	A842 P854	A842-G844 PolarHBondContact O-N 2.75Å; G844-P854 WeakPolarHBondContact O-CA 3.29Å
845	Y	72	Confident	71.6	Confident	61 Å²	61	66.5 Å²	66.5	24%	0.239	36%	0.358	C	S	.	.			trans	-78.6	141.6	179.3	-74.1	-98.1	0	0	0	112.1	G826 C841 A842 E843 K852 T853 P854	G826-Y845 VanDerWaalsContact CA-CD1 3.4Å; G826-Y845 VanDerWaalsContact CA-CG 3.4Å; G826-Y845 WeakPolarHBondContact O-CB 3.44Å; C841-Y845 WeakPolarHBondContact CB-O 3.42Å; A842-Y845 HydrophobicContact CB-CD2 4.07Å; A842-Y845 PolarHBondContact O-N 2.89Å; E843-Y845 VanDerWaalsContact C-N 3.31Å; E843-Y845 PolarHBondContact O-N 2.8Å; Y845-K852 WeakPolarHBondContact CA-O 3.18Å; Y845-K852 WeakPolarHBondContact CD1-O 3.35Å; Y845-T853 HydrophobicContact CE1-CG2 4.02Å; Y845-P854 HydrophobicContact CD2-CG 4.18Å; Y845-P854 HydrophobicContact CE2-CG 4.17Å
846	E	69.6	Low	71	Confident	87 Å²	87	66.5 Å²	66.5	41%	0.407	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-133.1	173.4	-178.5	-66.6	-161.6	158.6	0	0	112.8	C850 E851 K852 H855	E846-C850 CarbonylContact O-C 3.46Å; E846-C850 WeakPolarHBondContact O-CA 3.4Å; E846-E851 PolarHBondContact O-N 2.95Å; E846-K852 HydrophobicContact CB-CB 4.02Å; E846-K852 HydrophobicContact CB-CD 4.03Å; E846-K852 HydrophobicContact CB-CG 4.5Å; E846-K852 PolarHBondContact N-O 3.14Å; E846-K852 VanDerWaalsContact O-CB 3.32Å; E846-K852 WeakPolarHBondContact O-CB 3.42Å; E846-K852 PolarHBondContact O-N 3.23Å; E846-H855 IonicContact OE1-NE2 2.61Å; E846-H855 IonicContact OE2-CE1 2.97Å
847	G	68.8	Low	71	Confident	33 Å²	33	64.1 Å²	64.1	34%	0.34	34%	0.338	S	S	.	.	S	Bend	trans	97.4	171.5	179.5	0	0	0	0	0	113.5	F849 C850 E851	G847-F849 VanDerWaalsContact C-N 3.27Å; G847-F849 PolarHBondContact O-N 3.17Å; G847-C850 PolarHBondContact O-N 3.34Å; G847-E851 VanDerWaalsContact C-OE2 3.24Å; G847-E851 WeakPolarHBondContact CA-OE1 3.01Å; G847-E851 WeakPolarHBondContact CA-OE2 3.29Å
848	M	71.9	Confident	70.7	Confident	62 Å²	62	65.8 Å²	65.8	31%	0.305	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-30.3	-170.6	-174.1	-166.5	-45.1	0	0	113	Y811 C839 E851	Y811-M848 WeakPolarHBondContact O-CE 3.43Å; C839-M848 WeakPolarHBondContact CB-O 3.34Å; M848-E851 PolarHBondContact N-OE1 3.22Å; M848-E851 PolarHBondContact N-OE2 2.79Å
849	F	78.8	Confident	70.1	Confident	26 Å²	26	64.9 Å²	64.9	11%	0.114	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112	7.2	177.3	-51.6	-77.9	0	0	0	111.7	L817 H820 C822 S823 G847 E851	L817-F849 HydrophobicContact CD2-CD1 3.83Å; L817-F849 HydrophobicContact CD2-CE1 3.71Å; L817-F849 HydrophobicContact CG-CE1 3.9Å; H820-F849 HydrophobicContact CB-CD1 3.75Å; H820-F849 HydrophobicContact CB-CD2 4.49Å; H820-F849 HydrophobicContact CB-CE1 3.48Å; H820-F849 VanDerWaalsContact CB-CE1 3.48Å; H820-F849 HydrophobicContact CB-CE2 4.27Å; H820-F849 HydrophobicContact CB-CG 4.26Å; H820-F849 HydrophobicContact CB-CZ 3.77Å; C822-F849 CarbonylContact C-O 3.58Å; C822-F849 VanDerWaalsContact CA-O 3.28Å; C822-F849 WeakPolarHBondContact CA-O 3.35Å; S823-F849 PolarHBondContact N-O 3.08Å; G847-F849 VanDerWaalsContact C-N 3.27Å; G847-F849 PolarHBondContact O-N 3.17Å; F849-E851 VanDerWaalsContact CA-OE2 3.27Å; F849-E851 WeakPolarHBondContact CA-OE2 3.19Å; F849-E851 WeakPolarHBondContact CB-OE2 3.04Å; F849-E851 PolarHBondContact N-OE2 3.48Å; F849-E851 PolarHBondContact O-N 2.78Å
850	C	80.7	Confident	69.6	Low	0 Å²	0	71.1 Å²	71.1	0%	0	38%	0.382	C	S	.	.	S	Bend	trans	60.7	34	-168	-45.4	0	0	0	0	112.5	S823 G826 C841 E846 G847	S823-C850 VanDerWaalsContact CB-O 3.3Å; S823-C850 WeakPolarHBondContact CB-O 3.08Å; G826-C850 VanDerWaalsContact O-CB 3.22Å; G826-C850 WeakPolarHBondContact O-CB 3.09Å; C841-C850 WeakPolarHBondContact CA-SG 3.49Å; C841-C850 HydrophobicContact CB-CB 3.69Å; C841-C850 WeakPolarHBondContact CB-SG 3.19Å; C841-C850 PolarHBondContact N-SG 3.06Å; C841-C850 VanDerWaalsContact N-SG 3.38Å; C841-C850 VanDerWaalsContact SG-CA 3.51Å; C841-C850 WeakPolarHBondContact SG-CB 3.5Å; C841-C850 CovalentContact SG-SG 2.04Å; C841-C850 PolarHBondContact SG-SG 3.01Å; E846-C850 CarbonylContact O-C 3.46Å; E846-C850 WeakPolarHBondContact O-CA 3.4Å; G847-C850 PolarHBondContact O-N 3.34Å
851	E	73.1	Confident	69.1	Low	94 Å²	94	67.4 Å²	67.4	44%	0.439	37%	0.366	S	S	.	.			trans	-75.5	-26.5	-177.6	69.8	-77.1	-175.8	0	0	113.7	E846 G847 M848 F849	E846-E851 PolarHBondContact O-N 2.95Å; G847-E851 VanDerWaalsContact C-OE2 3.24Å; G847-E851 WeakPolarHBondContact CA-OE1 3.01Å; G847-E851 WeakPolarHBondContact CA-OE2 3.29Å; M848-E851 PolarHBondContact N-OE1 3.22Å; M848-E851 PolarHBondContact N-OE2 2.79Å; F849-E851 VanDerWaalsContact CA-OE2 3.27Å; F849-E851 WeakPolarHBondContact CA-OE2 3.19Å; F849-E851 WeakPolarHBondContact CB-OE2 3.04Å; F849-E851 PolarHBondContact N-OE2 3.48Å; F849-E851 PolarHBondContact O-N 2.78Å
852	K	66	Low	69.1	Low	96 Å²	96	66.1 Å²	66.1	42%	0.417	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-79.5	125.8	173.9	-54.4	-177	179.7	-175.2	0	108.5	Y845 E846	Y845-K852 WeakPolarHBondContact CA-O 3.18Å; Y845-K852 WeakPolarHBondContact CD1-O 3.35Å; E846-K852 HydrophobicContact CB-CB 4.02Å; E846-K852 HydrophobicContact CB-CD 4.03Å; E846-K852 HydrophobicContact CB-CG 4.5Å; E846-K852 PolarHBondContact N-O 3.14Å; E846-K852 VanDerWaalsContact O-CB 3.32Å; E846-K852 WeakPolarHBondContact O-CB 3.42Å; E846-K852 PolarHBondContact O-N 3.23Å
853	T	60.3	Low	69.3	Low	62 Å²	62	68.4 Å²	68.4	38%	0.38	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-63.5	161.6	167.3	33.7	0	0	0	0	111	Y845 H855	Y845-T853 HydrophobicContact CE1-CG2 4.02Å; T853-H855 PolarHBondContact O-N 3.45Å
854	P	51.5	Low	69.9	Low	41 Å²	41	62.8 Å²	62.8	27%	0.266	34%	0.337	S	S	.	.	S	Bend	trans	-46.5	126.7	163.8	-22.5	31.5	0	0	0	109.6	G844 Y845 D856 L858	G844-P854 WeakPolarHBondContact O-CA 3.29Å; Y845-P854 HydrophobicContact CD2-CG 4.18Å; Y845-P854 HydrophobicContact CE2-CG 4.17Å; P854-D856 PolarHBondContact O-N 3.29Å; P854-D856 VanDerWaalsContact O-N 3.12Å; P854-L858 HydrophobicContact CB-CD1 3.89Å
855	H	53	Low	70.8	Confident	82 Å²	82	63.1 Å²	63.1	38%	0.38	34%	0.34	S	S	.	.			trans	-44.8	125	179.5	-58.5	-70.2	0	0	0	108.6	E846 T853 C857 L858	E846-H855 IonicContact OE1-NE2 2.61Å; E846-H855 IonicContact OE2-CE1 2.97Å; T853-H855 PolarHBondContact O-N 3.45Å; H855-C857 PolarHBondContact O-N 2.85Å; H855-L858 HydrophobicContact CB-CD1 4.4Å; H855-L858 HydrophobicContact CB-CG 4.32Å; H855-L858 VanDerWaalsContact O-CB 3.28Å; H855-L858 WeakPolarHBondContact O-CB 3.21Å; H855-L858 WeakPolarHBondContact O-CG 3.08Å; H855-L858 PolarHBondContact O-N 2.75Å
856	D	55.3	Low	71.4	Confident	50 Å²	50	60.9 Å²	60.9	27%	0.267	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-55.3	-28.8	-174.5	-79.8	-40	0	0	0	111.8	P854 L858 S859 P861 Y875	P854-D856 PolarHBondContact O-N 3.29Å; P854-D856 VanDerWaalsContact O-N 3.12Å; D856-L858 PolarHBondContact O-N 3.46Å; D856-S859 WeakPolarHBondContact O-CB 3.05Å; D856-S859 PolarHBondContact O-N 3.47Å; D856-S859 PolarHBondContact O-OG 3.09Å; D856-P861 WeakPolarHBondContact O-CD 3.25Å; D856-Y875 HydrophobicContact CB-CD1 3.54Å; D856-Y875 HydrophobicContact CB-CE1 4.48Å; D856-Y875 HydrophobicContact CB-CG 4.03Å
857	C	65.1	Low	72	Confident	33 Å²	33	61.1 Å²	61.1	22%	0.223	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-55.7	-24.4	171.6	-60.4	0	0	0	0	115.9	H855 S859 K860 C868	H855-C857 PolarHBondContact O-N 2.85Å; C857-S859 PolarHBondContact O-N 3.34Å; C857-K860 WeakPolarHBondContact O-CA 3.1Å; C857-K860 PolarHBondContact O-N 2.85Å; C857-C868 WeakPolarHBondContact CA-SG 3.36Å; C857-C868 HydrophobicContact CB-CB 3.59Å; C857-C868 WeakPolarHBondContact CB-SG 3.39Å; C857-C868 WeakPolarHBondContact SG-CB 3.47Å; C857-C868 CovalentContact SG-SG 2.04Å; C857-C868 PolarHBondContact SG-SG 2.86Å
858	L	63.9	Low	72.5	Confident	116 Å²	116	61.3 Å²	61.3	61%	0.607	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-63.7	-26.7	173	-69.3	168.8	0	0	0	112.1	P854 H855 D856 K860	P854-L858 HydrophobicContact CB-CD1 3.89Å; H855-L858 HydrophobicContact CB-CD1 4.4Å; H855-L858 HydrophobicContact CB-CG 4.32Å; H855-L858 VanDerWaalsContact O-CB 3.28Å; H855-L858 WeakPolarHBondContact O-CB 3.21Å; H855-L858 WeakPolarHBondContact O-CG 3.08Å; H855-L858 PolarHBondContact O-N 2.75Å; D856-L858 PolarHBondContact O-N 3.46Å; L858-K860 PolarHBondContact O-N 3.01Å
859	S	67.1	Low	72.5	Confident	88 Å²	88	60.6 Å²	60.6	62%	0.615	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-73.6	-5	171.9	73.9	0	0	0	0	113.7	D856 C857 P861	D856-S859 WeakPolarHBondContact O-CB 3.05Å; D856-S859 PolarHBondContact O-N 3.47Å; D856-S859 PolarHBondContact O-OG 3.09Å; C857-S859 PolarHBondContact O-N 3.34Å; S859-P861 WeakPolarHBondContact OG-CD 3.39Å
860	K	71.5	Confident	71.5	Confident	153 Å²	153	61.2 Å²	61.2	67%	0.665	35%	0.348	S	S	*	.			trans	49.4	56.6	-170.3	-60.2	-179.7	179.7	176.3	0	112.6	C857 L858 C862	C857-K860 WeakPolarHBondContact O-CA 3.1Å; C857-K860 PolarHBondContact O-N 2.85Å; L858-K860 PolarHBondContact O-N 3.01Å; K860-C862 PolarHBondContact O-N 3.34Å
861	P	77.9	Confident	70.1	Confident	10 Å²	10	66.9 Å²	66.9	7%	0.065	38%	0.378	C	S	.	.			trans	-71.1	-19.2	-173.4	31.5	-34.9	0	0	0	113	D856 S859 M863 Y875 Q887	D856-P861 WeakPolarHBondContact O-CD 3.25Å; S859-P861 WeakPolarHBondContact OG-CD 3.39Å; P861-M863 PolarHBondContact O-N 3.45Å; P861-Y875 HydrophobicContact CB-CD2 3.93Å; P861-Y875 HydrophobicContact CB-CE1 4.24Å; P861-Y875 HydrophobicContact CB-CE2 3.53Å; P861-Y875 HydrophobicContact CB-CG 4.44Å; P861-Y875 HydrophobicContact CG-CD1 4.33Å; P861-Y875 HydrophobicContact CG-CD2 3.6Å; P861-Y875 HydrophobicContact CG-CE1 4.46Å; P861-Y875 HydrophobicContact CG-CE2 3.78Å; P861-Y875 HydrophobicContact CG-CG 3.89Å; P861-Q887 VanDerWaalsContact O-CB 3.24Å; P861-Q887 WeakPolarHBondContact O-CB 3.39Å; P861-Q887 VanDerWaalsContact O-CG 3.28Å; P861-Q887 WeakPolarHBondContact O-CG 3.24Å
862	C	83.7	Confident	68.8	Low	17 Å²	17	63 Å²	63	12%	0.115	36%	0.363	C	S	.	.			trans	-86.8	107.8	-179.3	-47.6	0	0	0	0	111.3	K860 C868 C877	K860-C862 PolarHBondContact O-N 3.34Å; C862-C868 WeakPolarHBondContact SG-CB 3.43Å; C862-C877 WeakPolarHBondContact CA-SG 3.48Å; C862-C877 HydrophobicContact CB-CB 3.74Å; C862-C877 WeakPolarHBondContact CB-SG 3.43Å; C862-C877 WeakPolarHBondContact SG-CA 3.25Å; C862-C877 WeakPolarHBondContact SG-CB 3.19Å; C862-C877 CovalentContact SG-SG 2.03Å; C862-C877 PolarHBondContact SG-SG 2.89Å
863	M	85.4	Confident	67.8	Low	96 Å²	96	64.7 Å²	64.7	47%	0.473	38%	0.376	S	S	.	.			trans	-73.2	173.8	175.3	-55.1	-166	-176.9	0	0	112	P861 G865 G866 Q887 E889	P861-M863 PolarHBondContact O-N 3.45Å; M863-G865 PolarHBondContact O-N 2.94Å; M863-G866 PolarHBondContact O-N 3.03Å; M863-G866 VanDerWaalsContact O-N 3.08Å; M863-Q887 WeakPolarHBondContact CA-O 3.4Å; M863-Q887 VanDerWaalsContact CB-O 3.29Å; M863-Q887 WeakPolarHBondContact CB-O 2.9Å; M863-Q887 HydrophobicContact CG-CB 4.49Å; M863-Q887 PolarHBondContact N-O 3.39Å; M863-E889 HydrophobicContact SD-CB 3.92Å
864	N	88.4	Confident	67.3	Low	80 Å²	80	68.5 Å²	68.5	43%	0.428	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	20.9	175.7	-61.8	-50.6	0	0	0	114.8	F883 C888	N864-F883 HydrophobicContact CB-CB 4.46Å; N864-F883 HydrophobicContact CB-CD1 3.51Å; N864-F883 HydrophobicContact CB-CD2 3.91Å; N864-F883 HydrophobicContact CB-CE1 3.57Å; N864-F883 HydrophobicContact CB-CE2 3.97Å; N864-F883 HydrophobicContact CB-CG 3.68Å; N864-F883 HydrophobicContact CB-CZ 3.81Å; N864-F883 VanDerWaalsContact CG-CD1 3.46Å; N864-F883 VanDerWaalsContact ND2-CD1 3.35Å; N864-F883 WeakPolarHBondContact ND2-CD1 3.24Å; N864-C888 PolarHBondContact ND2-O 3.4Å
865	G	82.1	Confident	67.7	Low	39 Å²	39	68.9 Å²	68.9	40%	0.402	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	24.8	179.4	0	0	0	0	0	114.7	M863 K880	M863-G865 PolarHBondContact O-N 2.94Å; G865-K880 VanDerWaalsContact O-CD 3.25Å; G865-K880 WeakPolarHBondContact O-CD 3.42Å; G865-K880 WeakPolarHBondContact O-CE 3.28Å; G865-K880 PolarHBondContact O-NZ 2.87Å
866	G	84.7	Confident	68.2	Low	13 Å²	13	69.7 Å²	69.7	13%	0.134	39%	0.387	C	S	.	.			trans	-61.2	151.4	165.6	0	0	0	0	0	112	M863 D878	M863-G866 PolarHBondContact O-N 3.03Å; M863-G866 VanDerWaalsContact O-N 3.08Å; G866-D878 CarbonylContact C-O 3.53Å; G866-D878 VanDerWaalsContact CA-O 3.29Å; G866-D878 WeakPolarHBondContact CA-O 3.33Å
867	T	83	Confident	69.3	Low	93 Å²	93	68 Å²	68	57%	0.571	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	141.7	176.5	-52.5	0	0	0	0	109.1	C877 D878	T867-C877 CarbonylContact O-C 3.52Å; T867-C877 WeakPolarHBondContact O-CA 3.43Å; T867-D878 PolarHBondContact N-O 3.14Å; T867-D878 PolarHBondContact O-N 2.83Å
868	C	79.9	Confident	70	Confident	36 Å²	36	70.2 Å²	70.2	24%	0.243	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	128.1	175.5	-171.1	0	0	0	0	110.6	C857 C862 L876	C857-C868 WeakPolarHBondContact CA-SG 3.36Å; C857-C868 HydrophobicContact CB-CB 3.59Å; C857-C868 WeakPolarHBondContact CB-SG 3.39Å; C857-C868 WeakPolarHBondContact SG-CB 3.47Å; C857-C868 CovalentContact SG-SG 2.04Å; C857-C868 PolarHBondContact SG-SG 2.86Å; C862-C868 WeakPolarHBondContact SG-CB 3.43Å; C868-L876 WeakPolarHBondContact CA-O 3.5Å
869	S	70.6	Confident	70.7	Confident	47 Å²	47	66.7 Å²	66.7	33%	0.329	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	153.1	167.3	51.9	0	0	0	0	109.5	Y875 L876 D878	S869-Y875 CarbonylContact O-C 3.46Å; S869-Y875 WeakPolarHBondContact O-CA 3.47Å; S869-L876 PolarHBondContact N-O 3.19Å; S869-L876 PolarHBondContact O-N 2.95Å; S869-D878 PolarHBondContact OG-OD2 3.11Å
870	S	57.4	Low	71.5	Confident	40 Å²	40	68 Å²	68	28%	0.28	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	139.1	-177.5	176.4	0	0	0	0	110.7	G872 Y874	S870-G872 PolarHBondContact OG-N 3.43Å; S870-Y874 VanDerWaalsContact CA-O 3.26Å; S870-Y874 WeakPolarHBondContact CA-O 3.25Å; S870-Y874 VanDerWaalsContact CB-O 3.26Å; S870-Y874 WeakPolarHBondContact CB-O 3.08Å; S870-Y874 PolarHBondContact OG-O 2.91Å
871	D	51.8	Low	71.6	Confident	118 Å²	118	65 Å²	65	63%	0.631	36%	0.364	S	S	*	.			trans	-91.9	-6.1	177	66.3	0.4	0	0	0	113.4	L873 Y874	D871-L873 PolarHBondContact OD1-N 3.47Å; D871-Y874 PolarHBondContact N-O 3.09Å; D871-Y874 PolarHBondContact OD1-N 2.99Å
872	G	46.5	Very low	71.3	Confident	12 Å²	12	65 Å²	65	12%	0.124	37%	0.366	C	S	.	.	S	Bend	trans	98.6	-2.7	-176.7	0	0	0	0	0	115.4	S870	S870-G872 PolarHBondContact OG-N 3.43Å
873	L	45.1	Very low	71.2	Confident	132 Å²	132	67 Å²	67	69%	0.691	37%	0.373	S	S	*	.	S	Bend	trans	-124	-21.1	165.2	-82.4	94.1	0	0	0	113.3	D871	D871-L873 PolarHBondContact OD1-N 3.47Å
874	Y	49.7	Very low	70.7	Confident	143 Å²	143	65.9 Å²	65.9	56%	0.561	37%	0.365	S	S	*	.			trans	-137.1	166.5	179.9	-51.9	-89	0	0	0	110.9	S870 D871	S870-Y874 VanDerWaalsContact CA-O 3.26Å; S870-Y874 WeakPolarHBondContact CA-O 3.25Å; S870-Y874 VanDerWaalsContact CB-O 3.26Å; S870-Y874 WeakPolarHBondContact CB-O 3.08Å; S870-Y874 PolarHBondContact OG-O 2.91Å; D871-Y874 PolarHBondContact N-O 3.09Å; D871-Y874 PolarHBondContact OD1-N 2.99Å
875	Y	59	Low	69.8	Low	49 Å²	49	63.4 Å²	63.4	19%	0.192	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	154.4	162.2	62.1	-82.7	0	0	0	112	D856 P861 S869 F886 Q887	D856-Y875 HydrophobicContact CB-CD1 3.54Å; D856-Y875 HydrophobicContact CB-CE1 4.48Å; D856-Y875 HydrophobicContact CB-CG 4.03Å; P861-Y875 HydrophobicContact CB-CD2 3.93Å; P861-Y875 HydrophobicContact CB-CE1 4.24Å; P861-Y875 HydrophobicContact CB-CE2 3.53Å; P861-Y875 HydrophobicContact CB-CG 4.44Å; P861-Y875 HydrophobicContact CG-CD1 4.33Å; P861-Y875 HydrophobicContact CG-CD2 3.6Å; P861-Y875 HydrophobicContact CG-CE1 4.46Å; P861-Y875 HydrophobicContact CG-CE2 3.78Å; P861-Y875 HydrophobicContact CG-CG 3.89Å; S869-Y875 CarbonylContact O-C 3.46Å; S869-Y875 WeakPolarHBondContact O-CA 3.47Å; Y875-F886 HydrophobicContact CD2-CE1 4.41Å; Y875-F886 HydrophobicContact CE1-CE1 4.19Å; Y875-F886 HydrophobicContact CE2-CD1 4.09Å; Y875-F886 AromaticContact CE2-CE1 3.61Å; Y875-F886 HydrophobicContact CE2-CE1 3.61Å; Y875-F886 HydrophobicContact CE2-CZ 4.2Å; Y875-F886 AromaticContact CZ-CE1 3.5Å; Y875-F886 WeakPolarHBondContact OH-CE1 3.45Å; Y875-Q887 HydrophobicContact CE2-CG 4.28Å; Y875-Q887 PolarHBondContact OH-NE2 3.16Å
876	L	63.6	Low	69.5	Low	99 Å²	99	67.2 Å²	67.2	52%	0.518	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	137.8	169.2	-179.5	68.3	0	0	0	108.2	C868 S869	C868-L876 WeakPolarHBondContact CA-O 3.5Å; S869-L876 PolarHBondContact N-O 3.19Å; S869-L876 PolarHBondContact O-N 2.95Å
877	C	78.6	Confident	69.3	Low	14 Å²	14	69.6 Å²	69.6	10%	0.095	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	107.4	177.6	-70.6	0	0	0	0	110.9	C862 T867 C879 F886	C862-C877 WeakPolarHBondContact CA-SG 3.48Å; C862-C877 HydrophobicContact CB-CB 3.74Å; C862-C877 WeakPolarHBondContact CB-SG 3.43Å; C862-C877 WeakPolarHBondContact SG-CA 3.25Å; C862-C877 WeakPolarHBondContact SG-CB 3.19Å; C862-C877 CovalentContact SG-SG 2.03Å; C862-C877 PolarHBondContact SG-SG 2.89Å; T867-C877 CarbonylContact O-C 3.52Å; T867-C877 WeakPolarHBondContact O-CA 3.43Å; C877-C879 PolarHBondContact O-N 2.9Å; C877-C879 VanDerWaalsContact O-N 3.16Å; C877-F886 WeakPolarHBondContact CB-O 3.46Å; C877-F886 PolarHBondContact SG-O 2.04Å
878	D	79.3	Confident	69.4	Low	79 Å²	79	65.1 Å²	65.1	42%	0.422	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	95	175.1	-61.4	-59.5	0	0	0	109.1	G866 T867 S869	G866-D878 CarbonylContact C-O 3.53Å; G866-D878 VanDerWaalsContact CA-O 3.29Å; G866-D878 WeakPolarHBondContact CA-O 3.33Å; T867-D878 PolarHBondContact N-O 3.14Å; T867-D878 PolarHBondContact O-N 2.83Å; S869-D878 PolarHBondContact OG-OD2 3.11Å
879	C	80.5	Confident	69.7	Low	43 Å²	43	67 Å²	67	29%	0.291	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-69.9	134.4	-173.1	-55.8	0	0	0	0	112.6	C877 F883 C888	C877-C879 PolarHBondContact O-N 2.9Å; C877-C879 VanDerWaalsContact O-N 3.16Å; C879-F883 HydrophobicContact CB-CB 4.33Å; C879-F883 WeakPolarHBondContact CB-O 3.31Å; C879-C888 WeakPolarHBondContact CA-SG 3.18Å; C879-C888 HydrophobicContact CB-CB 3.79Å; C879-C888 WeakPolarHBondContact CB-SG 3.32Å; C879-C888 WeakPolarHBondContact SG-CA 3.43Å; C879-C888 WeakPolarHBondContact SG-CB 3.41Å; C879-C888 CovalentContact SG-SG 2.04Å; C879-C888 PolarHBondContact SG-SG 2.86Å
880	K	82	Confident	70	Confident	115 Å²	115	69 Å²	69	50%	0.5	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-58.6	148.4	168.2	-81.3	177.6	172.5	142.3	0	110.5	G865 G882 F883	G865-K880 VanDerWaalsContact O-CD 3.25Å; G865-K880 WeakPolarHBondContact O-CD 3.42Å; G865-K880 WeakPolarHBondContact O-CE 3.28Å; G865-K880 PolarHBondContact O-NZ 2.87Å; K880-G882 PolarHBondContact O-N 3.07Å; K880-F883 HydrophobicContact CB-CD2 4.45Å; K880-F883 PolarHBondContact O-N 2.98Å
881	P	75.1	Confident	70.8	Confident	90 Å²	90	73.5 Å²	73.5	58%	0.584	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.6	138.2	171.5	-29.1	36	0	0	0	111.5	M913	P881-M913 HydrophobicContact CB-CE 4.22Å; P881-M913 HydrophobicContact CB-SD 3.82Å; P881-M913 WeakPolarHBondContact O-CE 3.22Å
882	G	70.3	Confident	71.5	Confident	9 Å²	9	69.6 Å²	69.6	9%	0.093	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.7	-3.6	-172.9	0	0	0	0	0	115.5	K880 V892 Y894	K880-G882 PolarHBondContact O-N 3.07Å; G882-V892 PolarHBondContact O-N 3.26Å; G882-Y894 WeakPolarHBondContact CA-OH 3.4Å; G882-Y894 PolarHBondContact N-OH 3.21Å
883	F	81.4	Confident	72.5	Confident	60 Å²	60	74 Å²	74	26%	0.263	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	151.9	176.5	-61.1	-81.5	0	0	0	113.3	N864 C879 K880 C888 Q890 Q891	N864-F883 HydrophobicContact CB-CB 4.46Å; N864-F883 HydrophobicContact CB-CD1 3.51Å; N864-F883 HydrophobicContact CB-CD2 3.91Å; N864-F883 HydrophobicContact CB-CE1 3.57Å; N864-F883 HydrophobicContact CB-CE2 3.97Å; N864-F883 HydrophobicContact CB-CG 3.68Å; N864-F883 HydrophobicContact CB-CZ 3.81Å; N864-F883 VanDerWaalsContact CG-CD1 3.46Å; N864-F883 VanDerWaalsContact ND2-CD1 3.35Å; N864-F883 WeakPolarHBondContact ND2-CD1 3.24Å; C879-F883 HydrophobicContact CB-CB 4.33Å; C879-F883 WeakPolarHBondContact CB-O 3.31Å; K880-F883 HydrophobicContact CB-CD2 4.45Å; K880-F883 PolarHBondContact O-N 2.98Å; F883-C888 HydrophobicContact CB-CB 4.36Å; F883-Q890 CarbonylContact C-O 3.58Å; F883-Q890 WeakPolarHBondContact CA-O 3.41Å; F883-Q891 HydrophobicContact CE1-CG 4.41Å
884	K	76.2	Confident	73.6	Confident	72 Å²	72	70.2 Å²	70.2	31%	0.313	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	175.1	179.2	69.9	179.1	-178.4	174.6	0	110.3	C888 E889 Q890 V892	K884-C888 CarbonylContact O-C 3.37Å; K884-C888 VanDerWaalsContact O-C 3.23Å; K884-C888 WeakPolarHBondContact O-CA 3.41Å; K884-E889 PolarHBondContact O-N 3.25Å; K884-Q890 HydrophobicContact CG-CB 3.78Å; K884-Q890 PolarHBondContact N-O 3.23Å; K884-Q890 WeakPolarHBondContact O-CA 3.49Å; K884-Q890 WeakPolarHBondContact O-CB 3.33Å; K884-Q890 PolarHBondContact O-N 3.41Å; K884-Q890 VanDerWaalsContact O-O 3.13Å; K884-V892 HydrophobicContact CB-CG2 3.85Å; K884-V892 HydrophobicContact CD-CG2 4.2Å; K884-V892 HydrophobicContact CG-CG2 4Å
885	G	68.3	Low	74.9	Confident	29 Å²	29	65 Å²	65	30%	0.299	33%	0.328	S	S	.	.	S	Bend	trans	103.3	164.9	-177.2	0	0	0	0	0	111.9	Q887 C888 E889	G885-Q887 PolarHBondContact O-N 2.94Å; G885-C888 PolarHBondContact O-N 3.4Å; G885-C888 VanDerWaalsContact O-N 3.13Å; G885-E889 VanDerWaalsContact C-OE2 3.23Å; G885-E889 WeakPolarHBondContact CA-OE1 3.5Å; G885-E889 WeakPolarHBondContact CA-OE2 3.2Å
886	F	75.7	Confident	75.3	Confident	118 Å²	118	68 Å²	68	52%	0.518	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-24.9	-173.7	-173.1	-107.2	0	0	0	112.8	Y875 C877 E889	Y875-F886 HydrophobicContact CD2-CE1 4.41Å; Y875-F886 HydrophobicContact CE1-CE1 4.19Å; Y875-F886 HydrophobicContact CE2-CD1 4.09Å; Y875-F886 AromaticContact CE2-CE1 3.61Å; Y875-F886 HydrophobicContact CE2-CE1 3.61Å; Y875-F886 HydrophobicContact CE2-CZ 4.2Å; Y875-F886 AromaticContact CZ-CE1 3.5Å; Y875-F886 WeakPolarHBondContact OH-CE1 3.45Å; C877-F886 WeakPolarHBondContact CB-O 3.46Å; C877-F886 PolarHBondContact SG-O 2.04Å; F886-E889 PolarHBondContact N-OE2 2.96Å; F886-E889 VanDerWaalsContact N-OE2 3.17Å
887	Q	82.4	Confident	75.2	Confident	63 Å²	63	69.5 Å²	69.5	29%	0.294	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	17.7	174.8	-70.6	-173	-26	0	0	111.3	P861 M863 Y875 G885 E889	P861-Q887 VanDerWaalsContact O-CB 3.24Å; P861-Q887 WeakPolarHBondContact O-CB 3.39Å; P861-Q887 VanDerWaalsContact O-CG 3.28Å; P861-Q887 WeakPolarHBondContact O-CG 3.24Å; M863-Q887 WeakPolarHBondContact CA-O 3.4Å; M863-Q887 VanDerWaalsContact CB-O 3.29Å; M863-Q887 WeakPolarHBondContact CB-O 2.9Å; M863-Q887 HydrophobicContact CG-CB 4.49Å; M863-Q887 PolarHBondContact N-O 3.39Å; Y875-Q887 HydrophobicContact CE2-CG 4.28Å; Y875-Q887 PolarHBondContact OH-NE2 3.16Å; G885-Q887 PolarHBondContact O-N 2.94Å; Q887-E889 WeakPolarHBondContact CA-OE2 3.39Å; Q887-E889 HydrophobicContact CB-CB 4.4Å; Q887-E889 PolarHBondContact N-OE2 3.24Å; Q887-E889 PolarHBondContact O-N 3.2Å; Q887-E889 VanDerWaalsContact O-N 3.13Å
888	C	84.1	Confident	74.3	Confident	0 Å²	0	76 Å²	76	0%	0	39%	0.386	C	S	.	.	S	Bend	trans	54.8	25.1	-171.3	-51.6	0	0	0	0	114	N864 C879 F883 K884 G885 Q890	N864-C888 PolarHBondContact ND2-O 3.4Å; C879-C888 WeakPolarHBondContact CA-SG 3.18Å; C879-C888 HydrophobicContact CB-CB 3.79Å; C879-C888 WeakPolarHBondContact CB-SG 3.32Å; C879-C888 WeakPolarHBondContact SG-CA 3.43Å; C879-C888 WeakPolarHBondContact SG-CB 3.41Å; C879-C888 CovalentContact SG-SG 2.04Å; C879-C888 PolarHBondContact SG-SG 2.86Å; F883-C888 HydrophobicContact CB-CB 4.36Å; K884-C888 CarbonylContact O-C 3.37Å; K884-C888 VanDerWaalsContact O-C 3.23Å; K884-C888 WeakPolarHBondContact O-CA 3.41Å; G885-C888 PolarHBondContact O-N 3.4Å; G885-C888 VanDerWaalsContact O-N 3.13Å; C888-Q890 VanDerWaalsContact C-N 3.29Å; C888-Q890 PolarHBondContact O-N 3.27Å
889	E	85.4	Confident	74	Confident	75 Å²	75	74.1 Å²	74.1	35%	0.35	38%	0.377	S	S	.	.			trans	-75.2	-15.8	-170.4	74.7	-66.9	163.5	0	0	113.7	M863 K884 G885 F886 Q887	M863-E889 HydrophobicContact SD-CB 3.92Å; K884-E889 PolarHBondContact O-N 3.25Å; G885-E889 VanDerWaalsContact C-OE2 3.23Å; G885-E889 WeakPolarHBondContact CA-OE1 3.5Å; G885-E889 WeakPolarHBondContact CA-OE2 3.2Å; F886-E889 PolarHBondContact N-OE2 2.96Å; F886-E889 VanDerWaalsContact N-OE2 3.17Å; Q887-E889 WeakPolarHBondContact CA-OE2 3.39Å; Q887-E889 HydrophobicContact CB-CB 4.4Å; Q887-E889 PolarHBondContact N-OE2 3.24Å; Q887-E889 PolarHBondContact O-N 3.2Å; Q887-E889 VanDerWaalsContact O-N 3.13Å
890	Q	78.7	Confident	73.8	Confident	88 Å²	88	72.5 Å²	72.5	41%	0.411	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	134.5	-175.5	-52.4	169	32.7	0	0	110.8	F883 K884 C888	F883-Q890 CarbonylContact C-O 3.58Å; F883-Q890 WeakPolarHBondContact CA-O 3.41Å; K884-Q890 HydrophobicContact CG-CB 3.78Å; K884-Q890 PolarHBondContact N-O 3.23Å; K884-Q890 WeakPolarHBondContact O-CA 3.49Å; K884-Q890 WeakPolarHBondContact O-CB 3.33Å; K884-Q890 PolarHBondContact O-N 3.41Å; K884-Q890 VanDerWaalsContact O-O 3.13Å; C888-Q890 VanDerWaalsContact C-N 3.29Å; C888-Q890 PolarHBondContact O-N 3.27Å
891	Q	73.5	Confident	73.4	Confident	135 Å²	135	68.6 Å²	68.6	63%	0.631	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	137.9	169.6	-162.7	175.6	19.5	0	0	110.6	F883 K893	F883-Q891 HydrophobicContact CE1-CG 4.41Å; Q891-K893 PolarHBondContact O-N 3.3Å
892	V	66.2	Low	73.7	Confident	36 Å²	36	69.8 Å²	69.8	22%	0.218	36%	0.361	C	S	.	.			trans	-75.3	104.4	173.9	-179.8	0	0	0	0	109.1	G882 K884 Y894	G882-V892 PolarHBondContact O-N 3.26Å; K884-V892 HydrophobicContact CB-CG2 3.85Å; K884-V892 HydrophobicContact CD-CG2 4.2Å; K884-V892 HydrophobicContact CG-CG2 4Å; V892-Y894 HydrophobicContact CB-CE1 4.4Å; V892-Y894 HydrophobicContact CB-CE2 4.11Å; V892-Y894 HydrophobicContact CG1-CD1 3.64Å; V892-Y894 HydrophobicContact CG1-CD2 3.97Å; V892-Y894 HydrophobicContact CG1-CE1 3.57Å; V892-Y894 HydrophobicContact CG1-CE2 3.86Å; V892-Y894 HydrophobicContact CG1-CG 3.85Å; V892-Y894 VanDerWaalsContact O-CD2 3.3Å; V892-Y894 WeakPolarHBondContact O-CD2 3.43Å; V892-Y894 VanDerWaalsContact O-CE2 3.3Å; V892-Y894 WeakPolarHBondContact O-CE2 3.5Å; V892-Y894 PolarHBondContact O-N 2.84Å
893	K	68.5	Low	74.1	Confident	104 Å²	104	71.4 Å²	71.4	45%	0.452	37%	0.368	S	S	.	.			trans	-88.5	97.3	163.6	-65.2	162	175.7	171.7	0	108	Q891 C895 E896	Q891-K893 PolarHBondContact O-N 3.3Å; K893-C895 PolarHBondContact O-N 3.34Å; K893-E896 HydrophobicContact CB-CB 4.3Å; K893-E896 HydrophobicContact CB-CG 3.9Å; K893-E896 HydrophobicContact CD-CG 3.93Å; K893-E896 WeakPolarHBondContact CD-OE1 3.18Å; K893-E896 VanDerWaalsContact CD-OE2 3.23Å; K893-E896 WeakPolarHBondContact CD-OE2 3.47Å; K893-E896 WeakPolarHBondContact CE-OE1 3.4Å; K893-E896 IonicContact NZ-OE1 3.52Å; K893-E896 PolarHBondContact NZ-OE1 3.4Å; K893-E896 IonicContact NZ-OE2 3.66Å; K893-E896 PolarHBondContact O-N 3.27Å; K893-E896 VanDerWaalsContact O-N 3.12Å
894	Y	67.6	Low	74.2	Confident	54 Å²	54	69.2 Å²	69.2	21%	0.212	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-12.6	-173	-58.6	-95.1	0	0	0	114.5	G882 V892 T899 N908 M913 Y915	G882-Y894 WeakPolarHBondContact CA-OH 3.4Å; G882-Y894 PolarHBondContact N-OH 3.21Å; V892-Y894 HydrophobicContact CB-CE1 4.4Å; V892-Y894 HydrophobicContact CB-CE2 4.11Å; V892-Y894 HydrophobicContact CG1-CD1 3.64Å; V892-Y894 HydrophobicContact CG1-CD2 3.97Å; V892-Y894 HydrophobicContact CG1-CE1 3.57Å; V892-Y894 HydrophobicContact CG1-CE2 3.86Å; V892-Y894 HydrophobicContact CG1-CG 3.85Å; V892-Y894 VanDerWaalsContact O-CD2 3.3Å; V892-Y894 WeakPolarHBondContact O-CD2 3.43Å; V892-Y894 VanDerWaalsContact O-CE2 3.3Å; V892-Y894 WeakPolarHBondContact O-CE2 3.5Å; V892-Y894 PolarHBondContact O-N 2.84Å; Y894-T899 WeakPolarHBondContact O-CB 3.03Å; Y894-T899 PolarHBondContact O-OG1 3.31Å; Y894-N908 WeakPolarHBondContact CB-OD1 3.03Å; Y894-N908 PolarHBondContact N-OD1 3.1Å; Y894-N908 VanDerWaalsContact N-OD1 3.11Å; Y894-M913 WeakPolarHBondContact CE1-O 3.08Å; Y894-M913 VanDerWaalsContact CZ-C 3.45Å; Y894-M913 PolarHBondContact OH-O 2.84Å; Y894-Y915 HydrophobicContact CD1-CD1 4.32Å
895	C	76.1	Confident	74.6	Confident	34 Å²	34	72 Å²	72	23%	0.23	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	10.3	177.8	-64	0	0	0	0	115.5	K893 C906 Q907 N908	K893-C895 PolarHBondContact O-N 3.34Å; C895-C906 WeakPolarHBondContact CA-SG 3.29Å; C895-C906 HydrophobicContact CB-CB 3.6Å; C895-C906 WeakPolarHBondContact CB-SG 3.4Å; C895-C906 WeakPolarHBondContact SG-CB 3.48Å; C895-C906 PolarHBondContact SG-O 3.21Å; C895-C906 CovalentContact SG-SG 2.04Å; C895-C906 PolarHBondContact SG-SG 3.45Å; C895-Q907 VanDerWaalsContact SG-C 3.59Å; C895-N908 PolarHBondContact N-OD1 2.83Å
896	E	67.8	Low	75.3	Confident	112 Å²	112	72.6 Å²	72.6	52%	0.523	38%	0.375	S	S	.	.	S	Bend	trans	-84.3	-9.1	176.5	-88.2	-173.7	165.7	0	0	114.9	K893	K893-E896 HydrophobicContact CB-CB 4.3Å; K893-E896 HydrophobicContact CB-CG 3.9Å; K893-E896 HydrophobicContact CD-CG 3.93Å; K893-E896 WeakPolarHBondContact CD-OE1 3.18Å; K893-E896 VanDerWaalsContact CD-OE2 3.23Å; K893-E896 WeakPolarHBondContact CD-OE2 3.47Å; K893-E896 WeakPolarHBondContact CE-OE1 3.4Å; K893-E896 IonicContact NZ-OE1 3.52Å; K893-E896 PolarHBondContact NZ-OE1 3.4Å; K893-E896 IonicContact NZ-OE2 3.66Å; K893-E896 PolarHBondContact O-N 3.27Å; K893-E896 VanDerWaalsContact O-N 3.12Å
897	N	60.7	Low	75.6	Confident	130 Å²	130	71.5 Å²	71.5	70%	0.695	37%	0.372	S	S	*	.	S	Bend	trans	-111	23.7	-168.7	-89.7	45.4	0	0	0	114.2	T899	N897-T899 PolarHBondContact O-N 3.29Å; N897-T899 VanDerWaalsContact O-N 3.17Å
898	D	61	Low	75.3	Confident	151 Å²	151	72 Å²	72	81%	0.807	38%	0.376	S	S	*	.			trans	48.9	38.8	-170.5	-71.3	-25.4	0	0	0	112.8	C900	D898-C900 CarbonylContact C-O 3.5Å; D898-C900 CarbonylContact O-C 3.07Å; D898-C900 PolarHBondContact O-N 3.34Å
899	T	71.9	Confident	74.7	Confident	38 Å²	38	73.4 Å²	73.4	23%	0.233	39%	0.385	C	S	.	.			trans	-61	-19.9	-175.2	-34.7	0	0	0	0	113.2	Y894 N897 Y915 H927	Y894-T899 WeakPolarHBondContact O-CB 3.03Å; Y894-T899 PolarHBondContact O-OG1 3.31Å; N897-T899 PolarHBondContact O-N 3.29Å; N897-T899 VanDerWaalsContact O-N 3.17Å; T899-Y915 HydrophobicContact CG2-CD1 4.03Å; T899-Y915 HydrophobicContact CG2-CD2 4.1Å; T899-Y915 HydrophobicContact CG2-CE1 3.71Å; T899-Y915 HydrophobicContact CG2-CE2 3.83Å; T899-Y915 HydrophobicContact CG2-CG 4.23Å; T899-H927 PolarHBondContact O-CD2 3.44Å; T899-H927 VanDerWaalsContact O-CD2 3.27Å
900	C	76.9	Confident	73.7	Confident	9 Å²	9	75.3 Å²	75.3	6%	0.061	40%	0.402	C	S	.	.	S	Bend	trans	-101.3	134.6	163.2	-50.9	0	0	0	0	108.2	D898 C906 C917	D898-C900 CarbonylContact C-O 3.5Å; D898-C900 CarbonylContact O-C 3.07Å; D898-C900 PolarHBondContact O-N 3.34Å; C900-C906 HydrophobicContact CB-CB 4.42Å; C900-C906 VanDerWaalsContact SG-CA 3.56Å; C900-C906 WeakPolarHBondContact SG-CB 3.45Å; C900-C917 VanDerWaalsContact CA-SG 3.5Å; C900-C917 HydrophobicContact CB-CB 3.81Å; C900-C917 WeakPolarHBondContact CB-SG 3.42Å; C900-C917 WeakPolarHBondContact SG-CA 3.39Å; C900-C917 WeakPolarHBondContact SG-CB 3.4Å; C900-C917 CovalentContact SG-SG 2.02Å; C900-C917 PolarHBondContact SG-SG 3.44Å
901	S	74.7	Confident	72.7	Confident	33 Å²	33	73 Å²	73	23%	0.231	40%	0.398	C	S	.	.			trans	-45.7	151.9	165.3	-55.4	0	0	0	0	110.2	N903 G904 H927	S901-N903 PolarHBondContact O-N 3.23Å; S901-G904 PolarHBondContact O-N 2.98Å; S901-H927 WeakPolarHBondContact CB-O 3.38Å; S901-H927 PolarHBondContact N-O 3.46Å; S901-H927 PolarHBondContact OG-O 2.97Å
902	P	79.9	Confident	71.9	Confident	116 Å²	116	72.1 Å²	72.1	75%	0.753	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-2.2	-180	24	-35.8	0	0	0	115.3
903	N	80.1	Confident	71.7	Confident	43 Å²	43	75 Å²	75	23%	0.23	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-6.5	171.6	-60.2	-34.4	0	0	0	114.3	S901 R920 Y923 C928	S901-N903 PolarHBondContact O-N 3.23Å; N903-R920 VanDerWaalsContact O-CB 3.24Å; N903-R920 WeakPolarHBondContact O-CB 3.43Å; N903-R920 WeakPolarHBondContact O-CG 2.99Å; N903-R920 PolarHBondContact O-N 2.03Å; N903-Y923 HydrophobicContact CB-CD1 3.96Å; N903-Y923 HydrophobicContact CB-CD2 3.5Å; N903-Y923 VanDerWaalsContact CB-CD2 3.5Å; N903-Y923 HydrophobicContact CB-CE1 4.27Å; N903-Y923 HydrophobicContact CB-CE2 3.81Å; N903-Y923 HydrophobicContact CB-CG 3.55Å; N903-Y923 VanDerWaalsContact CG-CE2 3.43Å; N903-Y923 WeakPolarHBondContact ND2-CD1 3.32Å; N903-Y923 VanDerWaalsContact ND2-CE1 3.25Å; N903-Y923 WeakPolarHBondContact ND2-CE1 3.02Å; N903-Y923 VanDerWaalsContact OD1-CE2 3.28Å; N903-Y923 WeakPolarHBondContact OD1-CE2 3.42Å; N903-Y923 VanDerWaalsContact OD1-CZ 3.24Å; N903-Y923 PolarHBondContact OD1-OH 2.98Å; N903-C928 HydrophobicContact CB-CB 4.25Å
904	G	82.6	Confident	71.6	Confident	14 Å²	14	71.7 Å²	71.7	14%	0.144	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	158.3	-176.4	0	0	0	0	0	113.9	S901 H918	S901-G904 PolarHBondContact O-N 2.98Å; G904-H918 CarbonylContact C-O 3.46Å; G904-H918 VanDerWaalsContact CA-O 3.29Å; G904-H918 WeakPolarHBondContact CA-O 3.13Å
905	E	84.4	Confident	72	Confident	131 Å²	131	70.8 Å²	70.8	61%	0.612	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.8	125.3	178.4	-173.7	169.5	168	0	0	110.2	H918	E905-H918 HydrophobicContact CB-CB 4.39Å; E905-H918 PolarHBondContact N-O 3.15Å; E905-H918 PolarHBondContact O-N 3.03Å
906	C	84.2	Confident	72.2	Confident	41 Å²	41	75.7 Å²	75.7	28%	0.277	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	122.8	-172	-167.9	0	0	0	0	112.4	C895 C900	C895-C906 WeakPolarHBondContact CA-SG 3.29Å; C895-C906 HydrophobicContact CB-CB 3.6Å; C895-C906 WeakPolarHBondContact CB-SG 3.4Å; C895-C906 WeakPolarHBondContact SG-CB 3.48Å; C895-C906 PolarHBondContact SG-O 3.21Å; C895-C906 CovalentContact SG-SG 2.04Å; C895-C906 PolarHBondContact SG-SG 3.45Å; C900-C906 HydrophobicContact CB-CB 4.42Å; C900-C906 VanDerWaalsContact SG-CA 3.56Å; C900-C906 WeakPolarHBondContact SG-CB 3.45Å
907	Q	82	Confident	73	Confident	95 Å²	95	71.2 Å²	71.2	44%	0.444	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	123.3	171.2	-174.4	180	20.5	0	0	110.1	C895 V909 Y915 R916 H918	C895-Q907 VanDerWaalsContact SG-C 3.59Å; Q907-V909 PolarHBondContact O-N 3.46Å; Q907-Y915 CarbonylContact O-C 3.48Å; Q907-Y915 VanDerWaalsContact O-CA 3.31Å; Q907-Y915 WeakPolarHBondContact O-CA 3.03Å; Q907-R916 PolarHBondContact N-O 2.82Å; Q907-R916 PolarHBondContact O-N 2.85Å; Q907-H918 PolarHBondContact OE1-NE2 3.43Å
908	N	74.4	Confident	74.2	Confident	73 Å²	73	69.2 Å²	69.2	39%	0.39	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	128.9	166.2	-64.8	-64.1	0	0	0	109	Y894 C895	Y894-N908 WeakPolarHBondContact CB-OD1 3.03Å; Y894-N908 PolarHBondContact N-OD1 3.1Å; Y894-N908 VanDerWaalsContact N-OD1 3.11Å; C895-N908 PolarHBondContact N-OD1 2.83Å
909	V	73.2	Confident	75.3	Confident	30 Å²	30	64 Å²	64	18%	0.182	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	83	178.8	-175.9	0	0	0	0	108.4	Q907 A911 L912 M913 T914 R916	Q907-V909 PolarHBondContact O-N 3.46Å; V909-A911 VanDerWaalsContact C-N 3.32Å; V909-A911 PolarHBondContact O-N 2.7Å; V909-L912 HydrophobicContact CG1-CB 4.14Å; V909-L912 HydrophobicContact CG1-CD1 4.28Å; V909-L912 HydrophobicContact CG1-CG 4.37Å; V909-L912 PolarHBondContact O-N 2.92Å; V909-L912 VanDerWaalsContact O-N 3.1Å; V909-M913 PolarHBondContact O-N 3.47Å; V909-T914 HydrophobicContact CB-CG2 4Å; V909-T914 HydrophobicContact CG1-CG2 4.47Å; V909-T914 PolarHBondContact N-O 3.11Å; V909-T914 PolarHBondContact O-N 3.14Å; V909-R916 HydrophobicContact CG2-CB 3.68Å
910	T	63.5	Low	75.9	Confident	115 Å²	115	69.5 Å²	69.5	71%	0.706	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-55.4	-42.9	-170.2	-35.8	0	0	0	0	113.1	L912 M913	T910-L912 PolarHBondContact O-N 2.97Å; T910-M913 PolarHBondContact O-N 3.4Å; T910-M913 VanDerWaalsContact O-N 3.17Å
911	A	57.8	Low	75.6	Confident	40 Å²	40	74.6 Å²	74.6	33%	0.331	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-64.3	-18.5	-178.3	0	0	0	0	0	114.4	G217 F219 V909	G217-A911 WeakPolarHBondContact O-CB 3.21Å; F219-A911 WeakPolarHBondContact CE2-O 3.46Å; V909-A911 VanDerWaalsContact C-N 3.32Å; V909-A911 PolarHBondContact O-N 2.7Å
912	L	55.9	Low	75.3	Confident	115 Å²	115	74.8 Å²	74.8	60%	0.602	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-118.7	11.8	178.4	-65.7	176.1	0	0	0	112.5	V909 T910 T914	V909-L912 HydrophobicContact CG1-CB 4.14Å; V909-L912 HydrophobicContact CG1-CD1 4.28Å; V909-L912 HydrophobicContact CG1-CG 4.37Å; V909-L912 PolarHBondContact O-N 2.92Å; V909-L912 VanDerWaalsContact O-N 3.1Å; T910-L912 PolarHBondContact O-N 2.97Å; L912-T914 HydrophobicContact CB-CG2 3.68Å; L912-T914 WeakPolarHBondContact O-CB 3.23Å; L912-T914 PolarHBondContact O-N 3.08Å; L912-T914 VanDerWaalsContact O-N 3.16Å
913	M	63.3	Low	75	Confident	97 Å²	97	73.4 Å²	73.4	48%	0.478	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	45	178	-46.2	-165.5	88	0	0	112.8	P881 Y894 V909 T910	P881-M913 HydrophobicContact CB-CE 4.22Å; P881-M913 HydrophobicContact CB-SD 3.82Å; P881-M913 WeakPolarHBondContact O-CE 3.22Å; Y894-M913 WeakPolarHBondContact CE1-O 3.08Å; Y894-M913 VanDerWaalsContact CZ-C 3.45Å; Y894-M913 PolarHBondContact OH-O 2.84Å; V909-M913 PolarHBondContact O-N 3.47Å; T910-M913 PolarHBondContact O-N 3.4Å; T910-M913 VanDerWaalsContact O-N 3.17Å
914	T	66.5	Low	74.3	Confident	35 Å²	35	73.2 Å²	73.2	22%	0.215	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	-174.9	-169.5	-165.8	0	0	0	0	111.3	V909 L912	V909-T914 HydrophobicContact CB-CG2 4Å; V909-T914 HydrophobicContact CG1-CG2 4.47Å; V909-T914 PolarHBondContact N-O 3.11Å; V909-T914 PolarHBondContact O-N 3.14Å; L912-T914 HydrophobicContact CB-CG2 3.68Å; L912-T914 WeakPolarHBondContact O-CB 3.23Å; L912-T914 PolarHBondContact O-N 3.08Å; L912-T914 VanDerWaalsContact O-N 3.16Å
915	Y	75.5	Confident	73.8	Confident	35 Å²	35	74.2 Å²	74.2	14%	0.137	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	162.9	172.2	60.2	-80.9	0	0	0	111.2	Y894 T899 Q907 R926 H927	Y894-Y915 HydrophobicContact CD1-CD1 4.32Å; T899-Y915 HydrophobicContact CG2-CD1 4.03Å; T899-Y915 HydrophobicContact CG2-CD2 4.1Å; T899-Y915 HydrophobicContact CG2-CE1 3.71Å; T899-Y915 HydrophobicContact CG2-CE2 3.83Å; T899-Y915 HydrophobicContact CG2-CG 4.23Å; Q907-Y915 CarbonylContact O-C 3.48Å; Q907-Y915 VanDerWaalsContact O-CA 3.31Å; Q907-Y915 WeakPolarHBondContact O-CA 3.03Å; Y915-R926 PolarHBondContact OH-NE 2.75Å; Y915-R926 VanDerWaalsContact OH-NE 3.12Å; Y915-H927 AromaticContact CE2-CD2 3.94Å; Y915-H927 PolarHBondContact OH-CD2 2.88Å; Y915-H927 PolarHBondContact OH-NE2 2.86Å
916	R	80	Confident	73.6	Confident	136 Å²	136	75.5 Å²	75.5	51%	0.513	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	131.5	169.3	173	177.5	-70.1	-178.3	-2.1	108.7	Q907 V909	Q907-R916 PolarHBondContact N-O 2.82Å; Q907-R916 PolarHBondContact O-N 2.85Å; V909-R916 HydrophobicContact CG2-CB 3.68Å
917	C	85.6	Confident	73.5	Confident	18 Å²	18	76.5 Å²	76.5	12%	0.122	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	122.2	172.8	-61.1	0	0	0	0	110.5	C900 C919 R926 C928	C900-C917 VanDerWaalsContact CA-SG 3.5Å; C900-C917 HydrophobicContact CB-CB 3.81Å; C900-C917 WeakPolarHBondContact CB-SG 3.42Å; C900-C917 WeakPolarHBondContact SG-CA 3.39Å; C900-C917 WeakPolarHBondContact SG-CB 3.4Å; C900-C917 CovalentContact SG-SG 2.02Å; C900-C917 PolarHBondContact SG-SG 3.44Å; C917-C919 PolarHBondContact O-N 3.37Å; C917-R926 WeakPolarHBondContact CB-O 3.48Å; C917-R926 PolarHBondContact SG-O 2.89Å; C917-C928 VanDerWaalsContact CB-SG 3.53Å
918	H	85.6	Confident	73.6	Confident	88 Å²	88	72 Å²	72	41%	0.407	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	99.7	170.8	-67.5	-74	0	0	0	108.9	G904 E905 Q907 R920	G904-H918 CarbonylContact C-O 3.46Å; G904-H918 VanDerWaalsContact CA-O 3.29Å; G904-H918 WeakPolarHBondContact CA-O 3.13Å; E905-H918 HydrophobicContact CB-CB 4.39Å; E905-H918 PolarHBondContact N-O 3.15Å; E905-H918 PolarHBondContact O-N 3.03Å; Q907-H918 PolarHBondContact OE1-NE2 3.43Å; H918-R920 PolarHBondContact O-N 2.82Å
919	C	84.4	Confident	73.8	Confident	42 Å²	42	72.1 Å²	72.1	28%	0.284	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	127.5	-175	-53.3	0	0	0	0	112	C917 Y923 C928	C917-C919 PolarHBondContact O-N 3.37Å; C919-Y923 WeakPolarHBondContact CB-O 3.17Å; C919-C928 WeakPolarHBondContact CA-SG 3.48Å; C919-C928 HydrophobicContact CB-CB 3.77Å; C919-C928 WeakPolarHBondContact CB-SG 3.43Å; C919-C928 PolarHBondContact N-SG 3.12Å; C919-C928 WeakPolarHBondContact SG-CA 3.03Å; C919-C928 WeakPolarHBondContact SG-CB 3.36Å; C919-C928 CovalentContact SG-SG 2.04Å; C919-C928 PolarHBondContact SG-SG 3.16Å
920	R	83.6	Confident	73.7	Confident	153 Å²	153	76.3 Å²	76.3	58%	0.577	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-65.8	139.5	168	-61.5	174	172.7	164	-2.8	107.9	N903 H918 Y923	N903-R920 VanDerWaalsContact O-CB 3.24Å; N903-R920 WeakPolarHBondContact O-CB 3.43Å; N903-R920 WeakPolarHBondContact O-CG 2.99Å; N903-R920 PolarHBondContact O-N 2.03Å; H918-R920 PolarHBondContact O-N 2.82Å; R920-Y923 WeakPolarHBondContact O-CB 3.32Å; R920-Y923 WeakPolarHBondContact O-CD2 3.18Å; R920-Y923 PolarHBondContact O-N 3.13Å
921	T	70.7	Confident	73.7	Confident	117 Å²	117	73.8 Å²	73.8	72%	0.718	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	136.9	173.6	45.9	0	0	0	0	110
922	P	67.3	Low	73.8	Confident	36 Å²	36	76.4 Å²	76.4	23%	0.234	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	cis	-102.7	39.3	10.4	41.6	-36.1	0	0	0	114.2	H932 Y934	P922-H932 WeakPolarHBondContact O-CA 3.47Å; P922-H932 WeakPolarHBondContact O-CB 3.32Å; P922-H932 PolarHBondContact O-N 3.03Å; P922-Y934 HydrophobicContact CB-CE2 3.95Å
923	Y	73.7	Confident	73.8	Confident	87 Å²	87	77.1 Å²	77.1	34%	0.341	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	158.5	-176.5	-60.5	-84.8	0	0	0	113.8	N903 C919 R920 H930 A931	N903-Y923 HydrophobicContact CB-CD1 3.96Å; N903-Y923 HydrophobicContact CB-CD2 3.5Å; N903-Y923 VanDerWaalsContact CB-CD2 3.5Å; N903-Y923 HydrophobicContact CB-CE1 4.27Å; N903-Y923 HydrophobicContact CB-CE2 3.81Å; N903-Y923 HydrophobicContact CB-CG 3.55Å; N903-Y923 VanDerWaalsContact CG-CE2 3.43Å; N903-Y923 WeakPolarHBondContact ND2-CD1 3.32Å; N903-Y923 VanDerWaalsContact ND2-CE1 3.25Å; N903-Y923 WeakPolarHBondContact ND2-CE1 3.02Å; N903-Y923 VanDerWaalsContact OD1-CE2 3.28Å; N903-Y923 WeakPolarHBondContact OD1-CE2 3.42Å; N903-Y923 VanDerWaalsContact OD1-CZ 3.24Å; N903-Y923 PolarHBondContact OD1-OH 2.98Å; C919-Y923 WeakPolarHBondContact CB-O 3.17Å; R920-Y923 WeakPolarHBondContact O-CB 3.32Å; R920-Y923 WeakPolarHBondContact O-CD2 3.18Å; R920-Y923 PolarHBondContact O-N 3.13Å; Y923-H930 CarbonylContact C-O 3.57Å; Y923-H930 VanDerWaalsContact CA-O 3.29Å; Y923-H930 WeakPolarHBondContact CA-O 3.43Å; Y923-A931 HydrophobicContact CD1-CB 4.11Å; Y923-A931 HydrophobicContact CE1-CB 4.03Å
924	A	66.4	Low	73.8	Confident	39 Å²	39	75.1 Å²	75.1	32%	0.322	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	175.8	-177.6	0	0	0	0	0	111	C928 E929 H930	A924-C928 CarbonylContact O-C 3.36Å; A924-C928 WeakPolarHBondContact O-CA 2.97Å; A924-E929 PolarHBondContact O-N 2.9Å; A924-H930 PolarHBondContact N-O 3.3Å; A924-H930 WeakPolarHBondContact O-CB 3.42Å; A924-H930 PolarHBondContact O-N 3.1Å
925	G	71.9	Confident	73.9	Confident	35 Å²	35	74.7 Å²	74.7	36%	0.361	37%	0.369	S	S	.	.	S	Bend	trans	101.3	173.3	-176.5	0	0	0	0	0	113.1	H927 C928 E929	G925-H927 VanDerWaalsContact C-N 3.27Å; G925-H927 PolarHBondContact O-N 3.39Å; G925-C928 PolarHBondContact O-N 2.87Å; G925-E929 WeakPolarHBondContact CA-OE2 3.1Å
926	R	79.1	Confident	73.5	Confident	159 Å²	159	78.8 Å²	78.8	60%	0.6	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-30.2	-174.7	-178.6	175.5	177.6	162.4	4.2	112.4	Y915 C917 E929	Y915-R926 PolarHBondContact OH-NE 2.75Å; Y915-R926 VanDerWaalsContact OH-NE 3.12Å; C917-R926 WeakPolarHBondContact CB-O 3.48Å; C917-R926 PolarHBondContact SG-O 2.89Å; R926-E929 PolarHBondContact N-OE2 2.04Å
927	H	83.2	Confident	72.6	Confident	61 Å²	61	77.3 Å²	77.3	28%	0.282	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	15.2	-178.8	-41.1	97.5	0	0	0	111.7	T899 S901 Y915 G925 E929	T899-H927 PolarHBondContact O-CD2 3.44Å; T899-H927 VanDerWaalsContact O-CD2 3.27Å; S901-H927 WeakPolarHBondContact CB-O 3.38Å; S901-H927 PolarHBondContact N-O 3.46Å; S901-H927 PolarHBondContact OG-O 2.97Å; Y915-H927 AromaticContact CE2-CD2 3.94Å; Y915-H927 PolarHBondContact OH-CD2 2.88Å; Y915-H927 PolarHBondContact OH-NE2 2.86Å; G925-H927 VanDerWaalsContact C-N 3.27Å; G925-H927 PolarHBondContact O-N 3.39Å; H927-E929 WeakPolarHBondContact CA-OE2 3.48Å; H927-E929 IonicContact CE1-OE1 3.44Å; H927-E929 IonicContact CG-OE1 2.97Å; H927-E929 PolarHBondContact N-OE1 2.88Å; H927-E929 PolarHBondContact N-OE2 3Å; H927-E929 IonicContact ND1-OE1 3.69Å; H927-E929 PolarHBondContact ND1-OE1 2.04Å; H927-E929 PolarHBondContact O-N 2.85Å
928	C	83.4	Confident	71.9	Confident	0 Å²	0	82.1 Å²	82.1	0%	0	43%	0.429	C	S	.	.	S	Bend	trans	55.8	34.4	-172.6	-49.9	0	0	0	0	113.8	N903 C917 C919 A924 G925	N903-C928 HydrophobicContact CB-CB 4.25Å; C917-C928 VanDerWaalsContact CB-SG 3.53Å; C919-C928 WeakPolarHBondContact CA-SG 3.48Å; C919-C928 HydrophobicContact CB-CB 3.77Å; C919-C928 WeakPolarHBondContact CB-SG 3.43Å; C919-C928 PolarHBondContact N-SG 3.12Å; C919-C928 WeakPolarHBondContact SG-CA 3.03Å; C919-C928 WeakPolarHBondContact SG-CB 3.36Å; C919-C928 CovalentContact SG-SG 2.04Å; C919-C928 PolarHBondContact SG-SG 3.16Å; A924-C928 CarbonylContact O-C 3.36Å; A924-C928 WeakPolarHBondContact O-CA 2.97Å; G925-C928 PolarHBondContact O-N 2.87Å
929	E	79.5	Confident	71.6	Confident	77 Å²	77	79 Å²	79	36%	0.36	42%	0.417	S	S	.	.			trans	-81.7	-21.8	-176.3	64.9	-86.9	-113.1	0	0	113.3	A924 G925 R926 H927	A924-E929 PolarHBondContact O-N 2.9Å; G925-E929 WeakPolarHBondContact CA-OE2 3.1Å; R926-E929 PolarHBondContact N-OE2 2.04Å; H927-E929 WeakPolarHBondContact CA-OE2 3.48Å; H927-E929 IonicContact CE1-OE1 3.44Å; H927-E929 IonicContact CG-OE1 2.97Å; H927-E929 PolarHBondContact N-OE1 2.88Å; H927-E929 PolarHBondContact N-OE2 3Å; H927-E929 IonicContact ND1-OE1 3.69Å; H927-E929 PolarHBondContact ND1-OE1 2.04Å; H927-E929 PolarHBondContact O-N 2.85Å
930	H	71.6	Confident	71.7	Confident	118 Å²	118	77.2 Å²	77.2	55%	0.546	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	128.9	179.5	-53.2	-51.6	0	0	0	110.8	Y923 A924	Y923-H930 CarbonylContact C-O 3.57Å; Y923-H930 VanDerWaalsContact CA-O 3.29Å; Y923-H930 WeakPolarHBondContact CA-O 3.43Å; A924-H930 PolarHBondContact N-O 3.3Å; A924-H930 WeakPolarHBondContact O-CB 3.42Å; A924-H930 PolarHBondContact O-N 3.1Å
931	A	63.6	Low	71.7	Confident	62 Å²	62	72.5 Å²	72.5	51%	0.512	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	132.2	161.5	0	0	0	0	0	109.1	Y923 E933	Y923-A931 HydrophobicContact CD1-CB 4.11Å; Y923-A931 HydrophobicContact CE1-CB 4.03Å; A931-E933 PolarHBondContact O-N 3.22Å
932	H	58	Low	72.2	Confident	95 Å²	95	69 Å²	69	44%	0.44	38%	0.383	S	S	.	.			trans	-69.4	104.9	177.5	-168.3	-26.3	0	0	0	109.6	P922 Y934	P922-H932 WeakPolarHBondContact O-CA 3.47Å; P922-H932 WeakPolarHBondContact O-CB 3.32Å; P922-H932 PolarHBondContact O-N 3.03Å; H932-Y934 HydrophobicContact CB-CE2 4.03Å; H932-Y934 AromaticContact CD2-CE1 3.61Å; H932-Y934 AromaticContact CD2-CZ 3.6Å; H932-Y934 PolarHBondContact CD2-OH 3.5Å; H932-Y934 AromaticContact CE1-CD1 3.64Å; H932-Y934 AromaticContact CE1-CE1 3.4Å; H932-Y934 VanDerWaalsContact CE1-CE1 3.4Å; H932-Y934 WeakPolarHBondContact CE1-CE1 3.42Å; H932-Y934 AromaticContact CG-CE1 3.7Å; H932-Y934 AromaticContact CG-CZ 3.55Å; H932-Y934 AromaticContact ND1-CD1 3.73Å; H932-Y934 AromaticContact ND1-CE1 3.57Å; H932-Y934 AromaticContact ND1-CZ 3.86Å; H932-Y934 AromaticContact NE2-CE1 3.42Å; H932-Y934 WeakPolarHBondContact NE2-CE1 3Å; H932-Y934 AromaticContact NE2-CZ 3.94Å; H932-Y934 VanDerWaalsContact O-CD2 3.25Å; H932-Y934 WeakPolarHBondContact O-CD2 3.47Å; H932-Y934 WeakPolarHBondContact O-CE2 3.22Å; H932-Y934 PolarHBondContact O-N 3.46Å; H932-Y934 VanDerWaalsContact O-N 3.08Å
933	E	57.1	Low	73	Confident	130 Å²	130	70.8 Å²	70.8	61%	0.607	39%	0.388	S	S	*	.			trans	-83.7	83.7	-175.8	-169.1	163.5	-133.6	0	0	111.1	A931 C935	A931-E933 PolarHBondContact O-N 3.22Å; E933-C935 PolarHBondContact O-N 2.93Å; E933-C935 VanDerWaalsContact O-N 3.17Å
934	Y	63.3	Low	73.5	Confident	54 Å²	54	67.1 Å²	67.1	21%	0.212	38%	0.377	C	S	.	.			trans	-66.5	-9.8	174	-49.7	-83.6	0	0	0	113.1	P922 H932 K936 S939 N948 I954	P922-Y934 HydrophobicContact CB-CE2 3.95Å; H932-Y934 HydrophobicContact CB-CE2 4.03Å; H932-Y934 AromaticContact CD2-CE1 3.61Å; H932-Y934 AromaticContact CD2-CZ 3.6Å; H932-Y934 PolarHBondContact CD2-OH 3.5Å; H932-Y934 AromaticContact CE1-CD1 3.64Å; H932-Y934 AromaticContact CE1-CE1 3.4Å; H932-Y934 VanDerWaalsContact CE1-CE1 3.4Å; H932-Y934 WeakPolarHBondContact CE1-CE1 3.42Å; H932-Y934 AromaticContact CG-CE1 3.7Å; H932-Y934 AromaticContact CG-CZ 3.55Å; H932-Y934 AromaticContact ND1-CD1 3.73Å; H932-Y934 AromaticContact ND1-CE1 3.57Å; H932-Y934 AromaticContact ND1-CZ 3.86Å; H932-Y934 AromaticContact NE2-CE1 3.42Å; H932-Y934 WeakPolarHBondContact NE2-CE1 3Å; H932-Y934 AromaticContact NE2-CZ 3.94Å; H932-Y934 VanDerWaalsContact O-CD2 3.25Å; H932-Y934 WeakPolarHBondContact O-CD2 3.47Å; H932-Y934 WeakPolarHBondContact O-CE2 3.22Å; H932-Y934 PolarHBondContact O-N 3.46Å; H932-Y934 VanDerWaalsContact O-N 3.08Å; Y934-K936 PolarHBondContact O-N 2.89Å; Y934-S939 PolarHBondContact O-OG 3.48Å; Y934-N948 WeakPolarHBondContact CB-OD1 3.01Å; Y934-N948 HydrophobicContact CD2-CB 4.28Å; Y934-N948 PolarHBondContact N-OD1 3.12Å; Y934-I954 WeakPolarHBondContact O-CG2 3.32Å
935	C	67.8	Low	74.3	Confident	26 Å²	26	66.1 Å²	66.1	18%	0.176	37%	0.368	C	S	.	.			trans	-93.7	69	180	-69.8	0	0	0	0	112.7	E933 C946 N948	E933-C935 PolarHBondContact O-N 2.93Å; E933-C935 VanDerWaalsContact O-N 3.17Å; C935-C946 WeakPolarHBondContact CA-SG 2.98Å; C935-C946 HydrophobicContact CB-CB 3.59Å; C935-C946 WeakPolarHBondContact CB-SG 3.39Å; C935-C946 WeakPolarHBondContact SG-CB 3.37Å; C935-C946 CovalentContact SG-SG 2.04Å; C935-C946 PolarHBondContact SG-SG 2.87Å; C935-N948 PolarHBondContact SG-OD1 2.04Å
936	K	67.6	Low	74.8	Confident	122 Å²	122	66 Å²	66	53%	0.53	36%	0.361	S	S	.	.			trans	-58	155.4	163.1	-64.6	170	-176.1	161.4	0	109.8	D42 Y934 D938 S939	D42-K936 PolarHBondContact O-NZ 2.83Å; D42-K936 IonicContact OD1-NZ 4Å; D42-K936 PolarHBondContact OD1-NZ 3.43Å; Y934-K936 PolarHBondContact O-N 2.89Å; K936-D938 PolarHBondContact O-N 2.73Å; K936-S939 PolarHBondContact N-OG 3.36Å; K936-S939 WeakPolarHBondContact O-CB 3.27Å; K936-S939 PolarHBondContact O-N 3.11Å; K936-S939 PolarHBondContact O-OG 2.85Å
937	A	61.5	Low	74.8	Confident	105 Å²	105	62 Å²	62	87%	0.868	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-30.6	-169.6	0	0	0	0	0	115.3
938	D	69.9	Low	74	Confident	118 Å²	118	62.2 Å²	62.2	63%	0.631	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	13.2	179.4	-91.5	-52	0	0	0	115.2	K936 C940 S941 G942	K936-D938 PolarHBondContact O-N 2.73Å; D938-C940 PolarHBondContact O-N 2.95Å; D938-S941 PolarHBondContact O-N 2.03Å; D938-G942 PolarHBondContact OD1-N 2.97Å; D938-G942 VanDerWaalsContact OD1-N 3.14Å
939	S	80.5	Confident	73.2	Confident	23 Å²	23	65.3 Å²	65.3	16%	0.161	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-14	178.3	-70.4	0	0	0	0	114.4	Y934 K936 C956	Y934-S939 PolarHBondContact O-OG 3.48Å; K936-S939 PolarHBondContact N-OG 3.36Å; K936-S939 WeakPolarHBondContact O-CB 3.27Å; K936-S939 PolarHBondContact O-N 3.11Å; K936-S939 PolarHBondContact O-OG 2.85Å; S939-C956 PolarHBondContact O-SG 2.83Å; S939-C956 VanDerWaalsContact O-SG 3.4Å
940	C	86.3	Confident	72.1	Confident	4 Å²	4	66.7 Å²	66.7	3%	0.027	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	31.7	172.5	-58.3	0	0	0	0	113	D938 G942 H943 G944 C946 C956 F966	D938-C940 PolarHBondContact O-N 2.95Å; C940-G942 PolarHBondContact O-N 2.91Å; C940-G942 VanDerWaalsContact O-N 3.11Å; C940-H943 PolarHBondContact O-N 3.11Å; C940-G944 WeakPolarHBondContact CB-O 3.15Å; C940-C946 VanDerWaalsContact SG-CA 3.5Å; C940-C946 VanDerWaalsContact SG-CB 3.54Å; C940-C956 WeakPolarHBondContact CA-SG 3.28Å; C940-C956 HydrophobicContact CB-CB 3.75Å; C940-C956 WeakPolarHBondContact CB-SG 3.47Å; C940-C956 VanDerWaalsContact SG-CA 3.52Å; C940-C956 WeakPolarHBondContact SG-CB 3.49Å; C940-C956 CovalentContact SG-SG 2.03Å; C940-C956 PolarHBondContact SG-SG 3.17Å; C940-F966 CarbonylContact C-O 3.57Å; C940-F966 VanDerWaalsContact O-O 3.11Å
941	S	83.2	Confident	71.5	Confident	55 Å²	55	65.6 Å²	65.6	39%	0.385	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	34.3	178.9	-54.7	0	0	0	0	114.1	D938 H943 F966	D938-S941 PolarHBondContact O-N 2.03Å; S941-H943 PolarHBondContact O-CE1 3.35Å; S941-H943 PolarHBondContact O-N 3.45Å; S941-H943 VanDerWaalsContact O-N 3.11Å; S941-H943 PolarHBondContact O-ND1 3.41Å; S941-F966 WeakPolarHBondContact CB-O 3.37Å; S941-F966 PolarHBondContact OG-O 2.91Å
942	G	80.5	Confident	71.2	Confident	43 Å²	43	64.7 Å²	64.7	44%	0.443	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.4	-2.5	-172.8	0	0	0	0	0	116.5	D938 C940	D938-G942 PolarHBondContact OD1-N 2.97Å; D938-G942 VanDerWaalsContact OD1-N 3.14Å; C940-G942 PolarHBondContact O-N 2.91Å; C940-G942 VanDerWaalsContact O-N 3.11Å
943	H	85	Confident	71.6	Confident	74 Å²	74	66.7 Å²	66.7	34%	0.343	40%	0.395	S	S	.	.	S	Bend	trans	-114.3	16.2	-167.3	-66.1	106.7	0	0	0	114.6	C940 S941 Y959 F962 C967	C940-H943 PolarHBondContact O-N 3.11Å; S941-H943 PolarHBondContact O-CE1 3.35Å; S941-H943 PolarHBondContact O-N 3.45Å; S941-H943 VanDerWaalsContact O-N 3.11Å; S941-H943 PolarHBondContact O-ND1 3.41Å; H943-Y959 VanDerWaalsContact C-CD2 3.44Å; H943-Y959 WeakPolarHBondContact O-CD2 3.31Å; H943-Y959 PolarHBondContact O-N 2.93Å; H943-F962 HydrophobicContact CB-CB 4.22Å; H943-F962 HydrophobicContact CB-CD1 3.69Å; H943-F962 HydrophobicContact CB-CD2 4.23Å; H943-F962 HydrophobicContact CB-CE1 4.06Å; H943-F962 HydrophobicContact CB-CG 3.78Å; H943-F962 HydrophobicContact CB-CZ 4.5Å; H943-F962 AromaticContact CD2-CD1 3.79Å; H943-F962 AromaticContact CD2-CE1 3.22Å; H943-F962 WeakPolarHBondContact CD2-CE1 3.31Å; H943-F962 AromaticContact CD2-CE2 3.54Å; H943-F962 AromaticContact CD2-CZ 3.08Å; H943-F962 WeakPolarHBondContact CD2-CZ 3.4Å; H943-F962 AromaticContact CE1-CE1 3.99Å; H943-F962 AromaticContact CG-CD1 3.64Å; H943-F962 AromaticContact CG-CE1 3.48Å; H943-F962 VanDerWaalsContact CG-CE1 3.48Å; H943-F962 AromaticContact CG-CZ 3.83Å; H943-F962 AromaticContact ND1-CE1 3.94Å; H943-F962 AromaticContact NE2-CE1 3.56Å; H943-F962 AromaticContact NE2-CZ 3.46Å; H943-F962 WeakPolarHBondContact NE2-CZ 3.34Å; H943-C967 HydrophobicContact CB-CB 3.94Å
944	G	84.3	Confident	72.5	Confident	10 Å²	10	62.7 Å²	62.7	10%	0.103	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	165.1	174.5	0	0	0	0	0	113.5	C940 I957	C940-G944 WeakPolarHBondContact CB-O 3.15Å; G944-I957 CarbonylContact C-O 3.41Å; G944-I957 WeakPolarHBondContact CA-O 3.39Å
945	A	82.8	Confident	73.4	Confident	17 Å²	17	65.5 Å²	65.5	14%	0.14	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	127.1	169.8	0	0	0	0	0	110	C956 I957	A945-C956 WeakPolarHBondContact O-CA 3.32Å; A945-I957 PolarHBondContact N-O 2.89Å; A945-I957 PolarHBondContact O-N 2.93Å
946	C	82.7	Confident	74.2	Confident	32 Å²	32	65.1 Å²	65.1	22%	0.216	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	141.9	174.8	-178.5	0	0	0	0	111.1	C935 C940	C935-C946 WeakPolarHBondContact CA-SG 2.98Å; C935-C946 HydrophobicContact CB-CB 3.59Å; C935-C946 WeakPolarHBondContact CB-SG 3.39Å; C935-C946 WeakPolarHBondContact SG-CB 3.37Å; C935-C946 CovalentContact SG-SG 2.04Å; C935-C946 PolarHBondContact SG-SG 2.87Å; C940-C946 VanDerWaalsContact SG-CA 3.5Å; C940-C946 VanDerWaalsContact SG-CB 3.54Å
947	L	78.5	Confident	75.1	Confident	76 Å²	76	62.5 Å²	62.5	40%	0.398	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	132.2	170.7	-65.1	178.5	0	0	0	110.4	I954 K955 I957	L947-I954 WeakPolarHBondContact O-CA 3.44Å; L947-K955 PolarHBondContact N-O 2.94Å; L947-K955 PolarHBondContact O-N 3.1Å; L947-I957 HydrophobicContact CD1-CD1 3.56Å; L947-I957 HydrophobicContact CD1-CG1 4.12Å; L947-I957 HydrophobicContact CG-CD1 4.36Å
948	N	67.2	Low	76.3	Confident	66 Å²	66	59.3 Å²	59.3	35%	0.353	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	125.3	166.9	-62.7	-26.2	0	0	0	109.3	Y934 C935	Y934-N948 WeakPolarHBondContact CB-OD1 3.01Å; Y934-N948 HydrophobicContact CD2-CB 4.28Å; Y934-N948 PolarHBondContact N-OD1 3.12Å; C935-N948 PolarHBondContact SG-OD1 2.04Å
949	L	66.8	Low	77.1	Confident	65 Å²	65	59.3 Å²	59.3	34%	0.34	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	146.4	166.9	-57	177.2	0	0	0	109.7	T951 G952 K953 K955	L949-T951 PolarHBondContact O-N 3.02Å; L949-G952 PolarHBondContact O-N 3.09Å; L949-G952 VanDerWaalsContact O-N 3.1Å; L949-K953 HydrophobicContact CB-CB 4.45Å; L949-K953 WeakPolarHBondContact CB-O 3.06Å; L949-K953 HydrophobicContact CD1-CB 4.22Å; L949-K953 WeakPolarHBondContact CG-O 3.02Å; L949-K953 PolarHBondContact N-O 2.94Å; L949-K955 HydrophobicContact CD1-CB 4.07Å; L949-K955 HydrophobicContact CD2-CB 4.11Å; L949-K955 HydrophobicContact CD2-CD 4.14Å; L949-K955 HydrophobicContact CG-CB 4.04Å
950	S	56	Low	77	Confident	105 Å²	105	66.1 Å²	66.1	73%	0.734	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	0.8	175.7	52.6	0	0	0	0	115.7
951	T	58.4	Low	76.5	Confident	96 Å²	96	66.4 Å²	66.4	59%	0.589	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	13	177.1	51.9	0	0	0	0	113.3	L949	L949-T951 PolarHBondContact O-N 3.02Å
952	G	58.6	Low	76.6	Confident	42 Å²	42	65.8 Å²	65.8	43%	0.433	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	33.9	-175.7	0	0	0	0	0	112.8	L949	L949-G952 PolarHBondContact O-N 3.09Å; L949-G952 VanDerWaalsContact O-N 3.1Å
953	K	65.9	Low	76.7	Confident	137 Å²	137	66.3 Å²	66.3	60%	0.596	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.1	140.4	-176.2	-66.7	180	-177.1	178.4	0	110.5	L949	L949-K953 HydrophobicContact CB-CB 4.45Å; L949-K953 WeakPolarHBondContact CB-O 3.06Å; L949-K953 HydrophobicContact CD1-CB 4.22Å; L949-K953 WeakPolarHBondContact CG-O 3.02Å; L949-K953 PolarHBondContact N-O 2.94Å
954	I	75.8	Confident	76.6	Confident	46 Å²	46	64.5 Å²	64.5	24%	0.236	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	146.4	172.1	57.4	170.8	0	0	0	112	Y934 L947 F966	Y934-I954 WeakPolarHBondContact O-CG2 3.32Å; L947-I954 WeakPolarHBondContact O-CA 3.44Å; I954-F966 HydrophobicContact CD1-CD1 4.15Å; I954-F966 HydrophobicContact CD1-CE1 3.86Å; I954-F966 HydrophobicContact CG1-CE1 4.27Å
955	K	82.2	Confident	76.5	Confident	113 Å²	113	70.7 Å²	70.7	49%	0.491	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	120.9	172.9	176.5	-178.3	177.4	-177.9	0	109.7	L947 L949	L947-K955 PolarHBondContact N-O 2.94Å; L947-K955 PolarHBondContact O-N 3.1Å; L949-K955 HydrophobicContact CD1-CB 4.07Å; L949-K955 HydrophobicContact CD2-CB 4.11Å; L949-K955 HydrophobicContact CD2-CD 4.14Å; L949-K955 HydrophobicContact CG-CB 4.04Å
956	C	85.3	Confident	76.7	Confident	19 Å²	19	74.4 Å²	74.4	13%	0.128	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	134.8	175.9	-62.9	0	0	0	0	112.5	S939 C940 A945 Q965 C967	S939-C956 PolarHBondContact O-SG 2.83Å; S939-C956 VanDerWaalsContact O-SG 3.4Å; C940-C956 WeakPolarHBondContact CA-SG 3.28Å; C940-C956 HydrophobicContact CB-CB 3.75Å; C940-C956 WeakPolarHBondContact CB-SG 3.47Å; C940-C956 VanDerWaalsContact SG-CA 3.52Å; C940-C956 WeakPolarHBondContact SG-CB 3.49Å; C940-C956 CovalentContact SG-SG 2.03Å; C940-C956 PolarHBondContact SG-SG 3.17Å; A945-C956 WeakPolarHBondContact O-CA 3.32Å; C956-Q965 VanDerWaalsContact CB-O 3.32Å; C956-Q965 WeakPolarHBondContact CB-O 3.44Å; C956-Q965 PolarHBondContact SG-O 3.21Å; C956-C967 VanDerWaalsContact CB-SG 3.5Å
957	I	85.9	Confident	76.9	Confident	67 Å²	67	72.9 Å²	72.9	34%	0.344	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	100.4	165.7	-61	-178.1	0	0	0	107.3	G944 A945 L947	G944-I957 CarbonylContact C-O 3.41Å; G944-I957 WeakPolarHBondContact CA-O 3.39Å; A945-I957 PolarHBondContact N-O 2.89Å; A945-I957 PolarHBondContact O-N 2.93Å; L947-I957 HydrophobicContact CD1-CD1 3.56Å; L947-I957 HydrophobicContact CD1-CG1 4.12Å; L947-I957 HydrophobicContact CG-CD1 4.36Å
958	C	86.6	Confident	77.1	Confident	37 Å²	37	71.7 Å²	71.7	25%	0.25	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	146.9	-175	-51.9	0	0	0	0	112.9	F962 C967	C958-F962 HydrophobicContact CB-CB 4.04Å; C958-F962 WeakPolarHBondContact CB-O 3.44Å; C958-C967 WeakPolarHBondContact CA-SG 3.22Å; C958-C967 HydrophobicContact CB-CB 3.76Å; C958-C967 WeakPolarHBondContact CB-SG 3.01Å; C958-C967 WeakPolarHBondContact SG-CA 3.03Å; C958-C967 WeakPolarHBondContact SG-CB 3.16Å; C958-C967 CovalentContact SG-SG 2.04Å; C958-C967 PolarHBondContact SG-SG 3.27Å
959	Y	86	Confident	77.7	Confident	119 Å²	119	75.1 Å²	75.1	47%	0.467	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-68.3	160	172.2	-57.7	-35.5	0	0	0	111.2	H943 G961 F962	H943-Y959 VanDerWaalsContact C-CD2 3.44Å; H943-Y959 WeakPolarHBondContact O-CD2 3.31Å; H943-Y959 PolarHBondContact O-N 2.93Å; Y959-G961 PolarHBondContact O-N 3.05Å; Y959-G961 VanDerWaalsContact O-N 3.11Å; Y959-F962 PolarHBondContact O-N 2.77Å
960	I	78.2	Confident	78.2	Confident	165 Å²	165	74.6 Å²	74.6	85%	0.846	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	120.4	-179.9	-59.9	174.6	0	0	0	109.1
961	G	77.2	Confident	78.7	Confident	10 Å²	10	72.4 Å²	72.4	10%	0.103	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.2	7.8	-175.7	0	0	0	0	0	115.3	Y959 N970 L971	Y959-G961 PolarHBondContact O-N 3.05Å; Y959-G961 VanDerWaalsContact O-N 3.11Å; G961-N970 CarbonylContact O-C 3.18Å; G961-N970 WeakPolarHBondContact O-CA 3.41Å; G961-N970 PolarHBondContact O-OD1 3.17Å; G961-L971 WeakPolarHBondContact O-CB 3.49Å; G961-L971 PolarHBondContact O-N 3.4Å
962	F	85.4	Confident	78.9	Confident	42 Å²	42	75.5 Å²	75.5	18%	0.184	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	147.9	174.3	-68.5	-92.1	0	0	0	112.4	H943 C958 Y959 C967 F969 N970	H943-F962 HydrophobicContact CB-CB 4.22Å; H943-F962 HydrophobicContact CB-CD1 3.69Å; H943-F962 HydrophobicContact CB-CD2 4.23Å; H943-F962 HydrophobicContact CB-CE1 4.06Å; H943-F962 HydrophobicContact CB-CG 3.78Å; H943-F962 HydrophobicContact CB-CZ 4.5Å; H943-F962 AromaticContact CD2-CD1 3.79Å; H943-F962 AromaticContact CD2-CE1 3.22Å; H943-F962 WeakPolarHBondContact CD2-CE1 3.31Å; H943-F962 AromaticContact CD2-CE2 3.54Å; H943-F962 AromaticContact CD2-CZ 3.08Å; H943-F962 WeakPolarHBondContact CD2-CZ 3.4Å; H943-F962 AromaticContact CE1-CE1 3.99Å; H943-F962 AromaticContact CG-CD1 3.64Å; H943-F962 AromaticContact CG-CE1 3.48Å; H943-F962 VanDerWaalsContact CG-CE1 3.48Å; H943-F962 AromaticContact CG-CZ 3.83Å; H943-F962 AromaticContact ND1-CE1 3.94Å; H943-F962 AromaticContact NE2-CE1 3.56Å; H943-F962 AromaticContact NE2-CZ 3.46Å; H943-F962 WeakPolarHBondContact NE2-CZ 3.34Å; C958-F962 HydrophobicContact CB-CB 4.04Å; C958-F962 WeakPolarHBondContact CB-O 3.44Å; Y959-F962 PolarHBondContact O-N 2.77Å; F962-C967 HydrophobicContact CB-CB 4.39Å; F962-C967 WeakPolarHBondContact CD1-O 3.46Å; F962-F969 CarbonylContact C-O 3.57Å; F962-F969 VanDerWaalsContact CA-O 3.32Å; F962-F969 WeakPolarHBondContact CA-O 3.23Å; F962-N970 HydrophobicContact CD1-CB 4.09Å; F962-N970 HydrophobicContact CE1-CB 3.73Å; F962-N970 HydrophobicContact CZ-CB 4.32Å; F962-N970 WeakPolarHBondContact CZ-ND2 3.49Å
963	V	82.9	Confident	79	Confident	55 Å²	55	78.6 Å²	78.6	33%	0.333	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	170.2	-178.9	-61.7	0	0	0	0	112.3	C967 F969 L971 L974	V963-C967 CarbonylContact O-C 3.53Å; V963-C967 WeakPolarHBondContact O-CA 3.38Å; V963-F969 HydrophobicContact CG2-CB 3.8Å; V963-F969 PolarHBondContact N-O 3.4Å; V963-F969 WeakPolarHBondContact O-CB 3.47Å; V963-F969 PolarHBondContact O-N 2.86Å; V963-F969 VanDerWaalsContact O-N 3.12Å; V963-L971 HydrophobicContact CG1-CD1 4.06Å; V963-L971 HydrophobicContact CG2-CD1 4.28Å; V963-L974 HydrophobicContact CG2-CD1 4.3Å
964	G	81.4	Confident	78.6	Confident	36 Å²	36	76.3 Å²	76.3	37%	0.371	40%	0.395	S	S	.	.	S	Bend	trans	100.4	162.7	-177	0	0	0	0	0	113.2	F966 C967	G964-F966 PolarHBondContact O-N 3.39Å; G964-F966 VanDerWaalsContact O-N 3.15Å; G964-C967 PolarHBondContact O-N 3.18Å
965	Q	83.6	Confident	77.7	Confident	140 Å²	140	77.5 Å²	77.5	65%	0.654	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-33.6	-174.5	-178.8	174.9	-15.2	0	0	113.7	C956	C956-Q965 VanDerWaalsContact CB-O 3.32Å; C956-Q965 WeakPolarHBondContact CB-O 3.44Å; C956-Q965 PolarHBondContact SG-O 3.21Å
966	F	85.7	Confident	76.2	Confident	94 Å²	94	74.6 Å²	74.6	41%	0.412	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	19.3	177.7	-46.8	-69.4	0	0	0	112.3	C940 S941 I954 G964 G968	C940-F966 CarbonylContact C-O 3.57Å; C940-F966 VanDerWaalsContact O-O 3.11Å; S941-F966 WeakPolarHBondContact CB-O 3.37Å; S941-F966 PolarHBondContact OG-O 2.91Å; I954-F966 HydrophobicContact CD1-CD1 4.15Å; I954-F966 HydrophobicContact CD1-CE1 3.86Å; I954-F966 HydrophobicContact CG1-CE1 4.27Å; G964-F966 PolarHBondContact O-N 3.39Å; G964-F966 VanDerWaalsContact O-N 3.15Å; F966-G968 PolarHBondContact O-N 2.62Å; F966-G968 VanDerWaalsContact O-N 3.08Å
967	C	87.1	Confident	74.8	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	41%	0.413	C	S	.	.	S	Bend	trans	60.6	12.9	178.6	-51.7	0	0	0	0	117.6	H943 C956 C958 F962 V963 G964 F969	H943-C967 HydrophobicContact CB-CB 3.94Å; C956-C967 VanDerWaalsContact CB-SG 3.5Å; C958-C967 WeakPolarHBondContact CA-SG 3.22Å; C958-C967 HydrophobicContact CB-CB 3.76Å; C958-C967 WeakPolarHBondContact CB-SG 3.01Å; C958-C967 WeakPolarHBondContact SG-CA 3.03Å; C958-C967 WeakPolarHBondContact SG-CB 3.16Å; C958-C967 CovalentContact SG-SG 2.04Å; C958-C967 PolarHBondContact SG-SG 3.27Å; F962-C967 HydrophobicContact CB-CB 4.39Å; F962-C967 WeakPolarHBondContact CD1-O 3.46Å; V963-C967 CarbonylContact O-C 3.53Å; V963-C967 WeakPolarHBondContact O-CA 3.38Å; G964-C967 PolarHBondContact O-N 3.18Å; C967-F969 VanDerWaalsContact C-N 3.25Å; C967-F969 PolarHBondContact O-N 3.27Å; C967-F969 VanDerWaalsContact O-N 3.16Å
968	G	83.8	Confident	73.4	Confident	51 Å²	51	79 Å²	79	53%	0.526	42%	0.424	S	S	.	.			trans	-67.4	-8.1	-177.9	0	0	0	0	0	117	F966	F966-G968 PolarHBondContact O-N 2.62Å; F966-G968 VanDerWaalsContact O-N 3.08Å
969	F	79.8	Confident	71.6	Confident	139 Å²	139	80.7 Å²	80.7	61%	0.61	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.6	116.2	-179.7	-59.3	-74.5	0	0	0	111.9	F962 V963 C967 L971	F962-F969 CarbonylContact C-O 3.57Å; F962-F969 VanDerWaalsContact CA-O 3.32Å; F962-F969 WeakPolarHBondContact CA-O 3.23Å; V963-F969 HydrophobicContact CG2-CB 3.8Å; V963-F969 PolarHBondContact N-O 3.4Å; V963-F969 WeakPolarHBondContact O-CB 3.47Å; V963-F969 PolarHBondContact O-N 2.86Å; V963-F969 VanDerWaalsContact O-N 3.12Å; C967-F969 VanDerWaalsContact C-N 3.25Å; C967-F969 PolarHBondContact O-N 3.27Å; C967-F969 VanDerWaalsContact O-N 3.16Å; F969-L971 PolarHBondContact O-N 3.08Å
970	N	76.7	Confident	70.2	Confident	54 Å²	54	79.9 Å²	79.9	29%	0.289	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	117	174.9	-172.9	-41.1	0	0	0	111.1	G961 F962 Y972 V973	G961-N970 CarbonylContact O-C 3.18Å; G961-N970 WeakPolarHBondContact O-CA 3.41Å; G961-N970 PolarHBondContact O-OD1 3.17Å; F962-N970 HydrophobicContact CD1-CB 4.09Å; F962-N970 HydrophobicContact CE1-CB 3.73Å; F962-N970 HydrophobicContact CZ-CB 4.32Å; F962-N970 WeakPolarHBondContact CZ-ND2 3.49Å; N970-Y972 VanDerWaalsContact C-N 3.3Å; N970-Y972 PolarHBondContact O-N 2.89Å; N970-Y972 VanDerWaalsContact OD1-CB 3.31Å; N970-Y972 WeakPolarHBondContact OD1-CB 3.11Å; N970-Y972 PolarHBondContact OD1-N 3.44Å; N970-V973 HydrophobicContact CB-CG2 3.99Å; N970-V973 WeakPolarHBondContact O-CB 3.39Å; N970-V973 PolarHBondContact O-N 3.12Å; N970-V973 VanDerWaalsContact O-N 3.12Å
971	L	67.2	Low	69	Low	59 Å²	59	75.7 Å²	75.7	31%	0.309	42%	0.423	S	S	.	.	H	α-helix	trans	-68	-24.1	-177	-163.4	70.3	0	0	0	113.1	G961 V963 F969 V973 L974 I975	G961-L971 WeakPolarHBondContact O-CB 3.49Å; G961-L971 PolarHBondContact O-N 3.4Å; V963-L971 HydrophobicContact CG1-CD1 4.06Å; V963-L971 HydrophobicContact CG2-CD1 4.28Å; F969-L971 PolarHBondContact O-N 3.08Å; L971-V973 VanDerWaalsContact C-N 3.28Å; L971-V973 PolarHBondContact O-N 3.49Å; L971-L974 HydrophobicContact CD1-CB 4.47Å; L971-L974 HydrophobicContact CD1-CD1 4.17Å; L971-L974 PolarHBondContact O-N 2.74Å; L971-I975 HydrophobicContact CD1-CD1 4.48Å; L971-I975 HydrophobicContact CD2-CD1 3.85Å; L971-I975 HydrophobicContact CG-CD1 3.68Å; L971-I975 HydrophobicContact CG-CG1 4.14Å; L971-I975 WeakPolarHBondContact O-CB 3.46Å; L971-I975 WeakPolarHBondContact O-CG1 3.5Å; L971-I975 PolarHBondContact O-N 3.3Å
972	Y	62.3	Low	68.2	Low	160 Å²	160	78.5 Å²	78.5	63%	0.627	44%	0.441	S	S	*	.	H	α-helix	trans	-65.9	-33.3	171.8	-70.3	-87.9	0	0	0	111.7	N970 L974 A976	N970-Y972 VanDerWaalsContact C-N 3.3Å; N970-Y972 PolarHBondContact O-N 2.89Å; N970-Y972 VanDerWaalsContact OD1-CB 3.31Å; N970-Y972 WeakPolarHBondContact OD1-CB 3.11Å; N970-Y972 PolarHBondContact OD1-N 3.44Å; Y972-L974 VanDerWaalsContact C-N 3.3Å; Y972-L974 PolarHBondContact O-N 3.14Å; Y972-A976 WeakPolarHBondContact O-CB 3.4Å; Y972-A976 PolarHBondContact O-N 2.84Å
973	V	60.5	Low	66.7	Low	107 Å²	107	79.2 Å²	79.2	65%	0.648	46%	0.455	S	S	*	.	H	α-helix	trans	-67.9	-33.3	174.7	-175.3	0	0	0	0	110.9	N970 L971 P977	N970-V973 HydrophobicContact CB-CG2 3.99Å; N970-V973 WeakPolarHBondContact O-CB 3.39Å; N970-V973 PolarHBondContact O-N 3.12Å; N970-V973 VanDerWaalsContact O-N 3.12Å; L971-V973 VanDerWaalsContact C-N 3.28Å; L971-V973 PolarHBondContact O-N 3.49Å; V973-P977 VanDerWaalsContact O-CD 3.27Å; V973-P977 WeakPolarHBondContact O-CD 3.4Å
974	L	56.6	Low	65.7	Low	89 Å²	89	83.5 Å²	83.5	47%	0.466	47%	0.469	S	S	.	.	H	α-helix	trans	-79.2	-35.4	176.8	-64.4	170.9	0	0	0	113.2	V963 L971 Y972 P977 I978	V963-L974 HydrophobicContact CG2-CD1 4.3Å; L971-L974 HydrophobicContact CD1-CB 4.47Å; L971-L974 HydrophobicContact CD1-CD1 4.17Å; L971-L974 PolarHBondContact O-N 2.74Å; Y972-L974 VanDerWaalsContact C-N 3.3Å; Y972-L974 PolarHBondContact O-N 3.14Å; L974-P977 WeakPolarHBondContact O-CD 3.43Å; L974-P977 WeakPolarHBondContact O-CG 3.16Å; L974-I978 WeakPolarHBondContact O-CD1 3.33Å
975	I	56.8	Low	64.9	Low	72 Å²	72	86.7 Å²	86.7	37%	0.369	48%	0.477	S	S	.	.	H	α-helix	trans	-84.4	-30	-178.2	-68.1	174	0	0	0	112.3	L971 I978 C979	L971-I975 HydrophobicContact CD1-CD1 4.48Å; L971-I975 HydrophobicContact CD2-CD1 3.85Å; L971-I975 HydrophobicContact CG-CD1 3.68Å; L971-I975 HydrophobicContact CG-CG1 4.14Å; L971-I975 WeakPolarHBondContact O-CB 3.46Å; L971-I975 WeakPolarHBondContact O-CG1 3.5Å; L971-I975 PolarHBondContact O-N 3.3Å; I975-I978 WeakPolarHBondContact O-CA 3.27Å; I975-I978 PolarHBondContact O-N 2.83Å; I975-C979 HydrophobicContact CG2-CB 4.49Å; I975-C979 VanDerWaalsContact CG2-SG 3.54Å; I975-C979 PolarHBondContact O-N 3.18Å
976	A	51.2	Low	64	Low	51 Å²	51	81.5 Å²	81.5	42%	0.421	46%	0.461	S	S	.	.	H	α-helix	trans	-47.8	-51.7	177.4	0	0	0	0	0	114	Y972 I978 L980	Y972-A976 WeakPolarHBondContact O-CB 3.4Å; Y972-A976 PolarHBondContact O-N 2.84Å; A976-I978 VanDerWaalsContact C-N 3.31Å; A976-I978 PolarHBondContact O-N 3.39Å; A976-L980 WeakPolarHBondContact O-CB 3.17Å; A976-L980 VanDerWaalsContact O-CG 3.28Å; A976-L980 WeakPolarHBondContact O-CG 3.49Å; A976-L980 PolarHBondContact O-N 3.14Å; A976-L980 VanDerWaalsContact O-N 3.11Å
977	P	55	Low	63.2	Low	68 Å²	68	80.9 Å²	80.9	44%	0.442	47%	0.465	S	S	.	.	H	α-helix	trans	-65.8	-31.2	175.6	25.9	-34.7	0	0	0	113.1	V973 L974 C981	V973-P977 VanDerWaalsContact O-CD 3.27Å; V973-P977 WeakPolarHBondContact O-CD 3.4Å; L974-P977 WeakPolarHBondContact O-CD 3.43Å; L974-P977 WeakPolarHBondContact O-CG 3.16Å; P977-C981 VanDerWaalsContact O-CB 3.31Å; P977-C981 WeakPolarHBondContact O-CB 3.28Å; P977-C981 PolarHBondContact O-N 2.88Å; P977-C981 PolarHBondContact O-SG 3.24Å; P977-C981 VanDerWaalsContact O-SG 3.35Å
978	I	58.1	Low	62.1	Low	111 Å²	111	86.4 Å²	86.4	57%	0.569	49%	0.487	S	S	*	.	H	α-helix	trans	-72.9	-43.9	-178.3	-57.8	174.6	0	0	0	111.1	L974 I975 A976 C981 S982	L974-I978 WeakPolarHBondContact O-CD1 3.33Å; I975-I978 WeakPolarHBondContact O-CA 3.27Å; I975-I978 PolarHBondContact O-N 2.83Å; A976-I978 VanDerWaalsContact C-N 3.31Å; A976-I978 PolarHBondContact O-N 3.39Å; I978-C981 PolarHBondContact O-N 2.89Å; I978-S982 PolarHBondContact O-N 3.47Å; I978-S982 PolarHBondContact O-OG 3.48Å
979	C	48.3	Very low	61.3	Low	73 Å²	73	88.5 Å²	88.5	49%	0.493	49%	0.485	S	S	.	.	H	α-helix	trans	-68.6	-33.4	175.2	-78.9	0	0	0	0	112.6	I975 S982 A983	I975-C979 HydrophobicContact CG2-CB 4.49Å; I975-C979 VanDerWaalsContact CG2-SG 3.54Å; I975-C979 PolarHBondContact O-N 3.18Å; C979-S982 PolarHBondContact O-OG 2.93Å; C979-A983 WeakPolarHBondContact O-CB 3.43Å; C979-A983 PolarHBondContact O-N 3.23Å; C979-A983 VanDerWaalsContact O-N 3.08Å
980	L	56.2	Low	60.3	Low	102 Å²	102	87.7 Å²	87.7	53%	0.534	49%	0.487	S	S	.	.	H	α-helix	trans	-64.6	-47.9	169.1	-72.2	169.3	0	0	0	110.7	A976 S982 A983 F984	A976-L980 WeakPolarHBondContact O-CB 3.17Å; A976-L980 VanDerWaalsContact O-CG 3.28Å; A976-L980 WeakPolarHBondContact O-CG 3.49Å; A976-L980 PolarHBondContact O-N 3.14Å; A976-L980 VanDerWaalsContact O-N 3.11Å; L980-S982 PolarHBondContact O-N 3.48Å; L980-A983 PolarHBondContact O-N 2.85Å; L980-F984 HydrophobicContact CB-CD2 4.41Å; L980-F984 HydrophobicContact CB-CE2 4.38Å; L980-F984 WeakPolarHBondContact O-CD2 3.28Å; L980-F984 PolarHBondContact O-N 3.5Å
981	C	54.2	Low	59.5	Low	76 Å²	76	90.2 Å²	90.2	51%	0.514	50%	0.5	S	S	.	.	H	α-helix	trans	-59.7	-39.7	176.7	-81.6	0	0	0	0	113.4	P977 I978 F984 L985	P977-C981 VanDerWaalsContact O-CB 3.31Å; P977-C981 WeakPolarHBondContact O-CB 3.28Å; P977-C981 PolarHBondContact O-N 2.88Å; P977-C981 PolarHBondContact O-SG 3.24Å; P977-C981 VanDerWaalsContact O-SG 3.35Å; I978-C981 PolarHBondContact O-N 2.89Å; C981-F984 PolarHBondContact O-N 3.28Å; C981-L985 WeakPolarHBondContact O-CB 3.43Å; C981-L985 PolarHBondContact O-N 2.88Å
982	S	58.6	Low	59	Low	70 Å²	70	94.5 Å²	94.5	49%	0.49	51%	0.512	S	S	.	.	H	α-helix	trans	-71.2	-35.6	177.4	67.7	0	0	0	0	112.5	I978 C979 L980 L985 G986	I978-S982 PolarHBondContact O-N 3.47Å; I978-S982 PolarHBondContact O-OG 3.48Å; C979-S982 PolarHBondContact O-OG 2.93Å; L980-S982 PolarHBondContact O-N 3.48Å; S982-L985 PolarHBondContact O-N 2.93Å; S982-G986 PolarHBondContact O-N 3.28Å
983	A	55.8	Low	58.7	Low	57 Å²	57	94.7 Å²	94.7	47%	0.471	52%	0.516	S	S	.	.	H	α-helix	trans	-64.1	-46.6	170.4	0	0	0	0	0	111.9	C979 L980 L985 G986 V987	C979-A983 WeakPolarHBondContact O-CB 3.43Å; C979-A983 PolarHBondContact O-N 3.23Å; C979-A983 VanDerWaalsContact O-N 3.08Å; L980-A983 PolarHBondContact O-N 2.85Å; A983-L985 PolarHBondContact O-N 2.87Å; A983-G986 PolarHBondContact O-N 2.88Å; A983-V987 WeakPolarHBondContact O-CG2 3.36Å; A983-V987 PolarHBondContact O-N 3.37Å
984	F	60.3	Low	58.2	Low	145 Å²	145	94.1 Å²	94.1	64%	0.636	52%	0.516	S	S	*	.	H	α-helix	trans	-63.4	-39.3	175.8	-77.7	-61.1	0	0	0	112.4	L980 C981 Y988	L980-F984 HydrophobicContact CB-CD2 4.41Å; L980-F984 HydrophobicContact CB-CE2 4.38Å; L980-F984 WeakPolarHBondContact O-CD2 3.28Å; L980-F984 PolarHBondContact O-N 3.5Å; C981-F984 PolarHBondContact O-N 3.28Å; F984-Y988 WeakPolarHBondContact O-CB 3.46Å; F984-Y988 PolarHBondContact O-N 3.42Å
985	L	65.7	Low	57.8	Low	102 Å²	102	100.9 Å²	100.9	53%	0.534	54%	0.536	S	S	.	.	H	α-helix	trans	-63.9	-42.2	172.2	-88.6	162.2	0	0	0	112.1	C981 S982 A983 Y988 L989	C981-L985 WeakPolarHBondContact O-CB 3.43Å; C981-L985 PolarHBondContact O-N 2.88Å; S982-L985 PolarHBondContact O-N 2.93Å; A983-L985 PolarHBondContact O-N 2.87Å; L985-Y988 PolarHBondContact O-N 3.11Å; L985-L989 VanDerWaalsContact O-CB 3.31Å; L985-L989 WeakPolarHBondContact O-CB 3.23Å; L985-L989 VanDerWaalsContact O-CG 3.23Å; L985-L989 WeakPolarHBondContact O-CG 3.34Å; L985-L989 PolarHBondContact O-N 2.93Å
986	G	63.3	Low	57.3	Low	32 Å²	32	106.4 Å²	106.4	33%	0.33	56%	0.557	S	S	.	*	H	α-helix	trans	-58.5	-50.9	174.6	0	0	0	0	0	112	S982 A983 L989 L990	S982-G986 PolarHBondContact O-N 3.28Å; A983-G986 PolarHBondContact O-N 2.88Å; G986-L989 PolarHBondContact O-N 3.35Å; G986-L990 WeakPolarHBondContact O-CB 3.38Å; G986-L990 VanDerWaalsContact O-CG 3.31Å; G986-L990 WeakPolarHBondContact O-CG 3.31Å; G986-L990 PolarHBondContact O-N 3.04Å
987	V	69.1	Low	56.8	Low	80 Å²	80	107.1 Å²	107.1	49%	0.485	57%	0.57	S	S	.	*	H	α-helix	trans	-61.7	-44.8	175.9	172.7	0	0	0	0	111.3	A983 L989 L990 L991	A983-V987 WeakPolarHBondContact O-CG2 3.36Å; A983-V987 PolarHBondContact O-N 3.37Å; V987-L989 VanDerWaalsContact C-N 3.35Å; V987-L989 PolarHBondContact O-N 3.18Å; V987-L990 PolarHBondContact O-N 2.86Å; V987-L991 HydrophobicContact CG1-CD1 3.82Å; V987-L991 HydrophobicContact CG1-CG 4.34Å; V987-L991 WeakPolarHBondContact O-CB 3.44Å; V987-L991 VanDerWaalsContact O-CG 3.28Å; V987-L991 WeakPolarHBondContact O-CG 3.45Å; V987-L991 PolarHBondContact O-N 3.4Å
988	Y	65.6	Low	55.8	Low	116 Å²	116	113.4 Å²	113.4	46%	0.455	59%	0.59	S	S	.	*	H	α-helix	trans	-61.8	-39.9	178	-175.2	-98.9	0	0	0	112.6	F984 L985 R992	F984-Y988 WeakPolarHBondContact O-CB 3.46Å; F984-Y988 PolarHBondContact O-N 3.42Å; L985-Y988 PolarHBondContact O-N 3.11Å; Y988-R992 HydrophobicContact CE1-CG 4.23Å; Y988-R992 VanDerWaalsContact CE1-NE 3.32Å; Y988-R992 WeakPolarHBondContact O-CB 3.48Å; Y988-R992 PolarHBondContact O-N 3.26Å; Y988-R992 VanDerWaalsContact OH-CZ 3.23Å; Y988-R992 PolarHBondContact OH-NE 3.36Å; Y988-R992 PolarHBondContact OH-NH2 3.45Å
989	L	66.5	Low	54.6	Low	96 Å²	96	119.2 Å²	119.2	50%	0.503	61%	0.605	S	S	.	*	H	α-helix	trans	-71.9	-36.2	176.5	-72	171.5	0	0	0	112.4	L985 G986 V987 R992 K993	L985-L989 VanDerWaalsContact O-CB 3.31Å; L985-L989 WeakPolarHBondContact O-CB 3.23Å; L985-L989 VanDerWaalsContact O-CG 3.23Å; L985-L989 WeakPolarHBondContact O-CG 3.34Å; L985-L989 PolarHBondContact O-N 2.93Å; G986-L989 PolarHBondContact O-N 3.35Å; V987-L989 VanDerWaalsContact C-N 3.35Å; V987-L989 PolarHBondContact O-N 3.18Å; L989-R992 PolarHBondContact O-N 3.02Å; L989-K993 WeakPolarHBondContact O-CB 3.31Å; L989-K993 WeakPolarHBondContact O-CG 3.38Å; L989-K993 PolarHBondContact O-N 3.49Å
990	L	59.5	Low	53.9	Low	121 Å²	121	125 Å²	125	63%	0.634	62%	0.621	S	S	*	*	H	α-helix	trans	-65.1	-44.6	172.1	-72.8	169.2	0	0	0	111.5	G986 V987 R992 K993 S994	G986-L990 WeakPolarHBondContact O-CB 3.38Å; G986-L990 VanDerWaalsContact O-CG 3.31Å; G986-L990 WeakPolarHBondContact O-CG 3.31Å; G986-L990 PolarHBondContact O-N 3.04Å; V987-L990 PolarHBondContact O-N 2.86Å; L990-R992 PolarHBondContact O-N 3.24Å; L990-K993 PolarHBondContact O-N 3.44Å; L990-S994 WeakPolarHBondContact O-CB 3.44Å; L990-S994 PolarHBondContact O-N 2.85Å
991	L	59.1	Low	52.7	Low	108 Å²	108	126.2 Å²	126.2	57%	0.565	63%	0.633	S	S	*	*	H	α-helix	trans	-64.1	-38	174.5	-68.7	171.6	0	0	0	112.1	V987 R995	V987-L991 HydrophobicContact CG1-CD1 3.82Å; V987-L991 HydrophobicContact CG1-CG 4.34Å; V987-L991 WeakPolarHBondContact O-CB 3.44Å; V987-L991 VanDerWaalsContact O-CG 3.28Å; V987-L991 WeakPolarHBondContact O-CG 3.45Å; V987-L991 PolarHBondContact O-N 3.4Å; L991-R995 PolarHBondContact O-N 3.31Å; L991-R995 VanDerWaalsContact O-N 3.16Å
992	R	57.2	Low	51.6	Low	148 Å²	148	128.5 Å²	128.5	56%	0.558	65%	0.645	S	S	*	*	H	α-helix	trans	-67.5	-37.3	172	-88.3	-172.1	165.7	-169.7	-3	113.1	Y988 L989 L990 R995 K996	Y988-R992 HydrophobicContact CE1-CG 4.23Å; Y988-R992 VanDerWaalsContact CE1-NE 3.32Å; Y988-R992 WeakPolarHBondContact O-CB 3.48Å; Y988-R992 PolarHBondContact O-N 3.26Å; Y988-R992 VanDerWaalsContact OH-CZ 3.23Å; Y988-R992 PolarHBondContact OH-NE 3.36Å; Y988-R992 PolarHBondContact OH-NH2 3.45Å; L989-R992 PolarHBondContact O-N 3.02Å; L990-R992 PolarHBondContact O-N 3.24Å; R992-R995 PolarHBondContact O-N 3.25Å; R992-K996 PolarHBondContact O-N 2.85Å
993	K	55.7	Low	50.4	Low	164 Å²	164	131.2 Å²	131.2	71%	0.713	66%	0.659	S	S	*	*	H	α-helix	trans	-67	-43.4	174.4	-80.7	-176.2	175.2	-178	0	111.3	L989 L990 R995 K996 G997	L989-K993 WeakPolarHBondContact O-CB 3.31Å; L989-K993 WeakPolarHBondContact O-CG 3.38Å; L989-K993 PolarHBondContact O-N 3.49Å; L990-K993 PolarHBondContact O-N 3.44Å; K993-R995 VanDerWaalsContact C-N 3.29Å; K993-R995 PolarHBondContact O-N 2.89Å; K993-K996 PolarHBondContact O-N 3.15Å; K993-G997 PolarHBondContact O-N 3.16Å
994	S	49.5	Very low	49.3	Very low	95 Å²	95	134.3 Å²	134.3	66%	0.664	67%	0.672	S	S	*	*	H	α-helix	trans	-53.3	-44.8	173.1	-178.9	0	0	0	0	111.9	L990 K996	L990-S994 WeakPolarHBondContact O-CB 3.44Å; L990-S994 PolarHBondContact O-N 2.85Å; S994-K996 VanDerWaalsContact C-N 3.29Å; S994-K996 PolarHBondContact O-N 3.46Å
995	R	48.3	Very low	47.9	Very low	232 Å²	232	131.9 Å²	131.9	88%	0.875	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	-8.2	177.2	-72.7	-173	175.5	-172.1	-0.5	115.8	L991 R992 K993	L991-R995 PolarHBondContact O-N 3.31Å; L991-R995 VanDerWaalsContact O-N 3.16Å; R992-R995 PolarHBondContact O-N 3.25Å; K993-R995 VanDerWaalsContact C-N 3.29Å; K993-R995 PolarHBondContact O-N 2.89Å
996	K	47.4	Very low	46.5	Very low	188 Å²	188	137.9 Å²	137.9	82%	0.817	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	-3.4	177.5	-74.6	-166.7	172.8	-169.3	0	114.9	R992 K993 S994 K998	R992-K996 PolarHBondContact O-N 2.85Å; K993-K996 PolarHBondContact O-N 3.15Å; S994-K996 VanDerWaalsContact C-N 3.29Å; S994-K996 PolarHBondContact O-N 3.46Å; K996-K998 VanDerWaalsContact C-N 3.29Å; K996-K998 PolarHBondContact O-N 3.3Å
997	G	38.8	Very low	45.1	Very low	66 Å²	66	143 Å²	143	68%	0.68	71%	0.706	S	S	*	*			trans	-74.5	3.4	-176.1	0	0	0	0	0	117.5	K993	K993-G997 PolarHBondContact O-N 3.16Å
998	K	35.7	Very low	43.4	Very low	199 Å²	199	143.3 Å²	143.3	87%	0.865	71%	0.711	S	S	*	*			trans	-113	73.5	-174.9	-74.4	-170.1	175.2	-176.5	0	113.8	K996	K996-K998 VanDerWaalsContact C-N 3.29Å; K996-K998 PolarHBondContact O-N 3.3Å
999	R	31.7	Very low	41.8	Very low	234 Å²	234	142 Å²	142	88%	0.883	72%	0.719	S	S	*	*	S	Bend	trans	-175.3	122.2	144.3	-104.6	158.7	-175	-169.6	1.1	114
1000	K	33.5	Very low	40.3	Very low	194 Å²	194	146.2 Å²	146.2	84%	0.843	74%	0.736	S	S	*	*			trans	67.5	103.6	149.8	-64.3	-168.4	173.6	-170.2	0	120.6
1001	T	31.2	Very low	39.1	Very low	128 Å²	128	145.5 Å²	145.5	79%	0.785	74%	0.741	S	S	*	*			trans	-40.5	163.4	131.1	42.5	0	0	0	0	113.5
1002	T	31.1	Very low	38	Very low	123 Å²	123	148.3 Å²	148.3	76%	0.755	76%	0.755	S	S	*	*			cis	-150.1	178.2	16.5	-8.2	0	0	0	0	107.3
1003	T	33.2	Very low	36.9	Very low	127 Å²	127	147.9 Å²	147.9	78%	0.779	76%	0.764	S	S	*	*			cis	-164.9	179.4	45.2	-39.4	0	0	0	0	110.8
1004	T	32.4	Very low	36	Very low	122 Å²	122	149.1 Å²	149.1	75%	0.748	77%	0.77	S	S	*	*			trans	-81.4	-178	-175.5	57.9	0	0	0	0	114.6
1005	S	31.9	Very low	35.4	Very low	94 Å²	94	152.6 Å²	152.6	66%	0.657	78%	0.775	S	S	*	*			cis	-173.2	163.9	20.1	1.7	0	0	0	0	114.4
1006	R	34.9	Very low	34.9	Very low	229 Å²	229	147 Å²	147	86%	0.864	76%	0.762	S	S	*	*			trans	72.1	153.6	148.6	-77.6	-179.8	166.1	178.2	-4.3	119.4
1007	M	35.1	Very low	34.4	Very low	140 Å²	140	141.3 Å²	141.3	69%	0.69	75%	0.751	S	S	*	*			cis	-160.9	157.1	-7.2	-128.9	161.7	75	0	0	114.8
1008	S	32.6	Very low	34.3	Very low	85 Å²	85	145.6 Å²	145.6	59%	0.594	75%	0.751	S	S	*	*			trans	16.8	159.6	142.3	59.6	0	0	0	0	124.1
1009	S	31.9	Very low	34.1	Very low	89 Å²	89	146.3 Å²	146.3	62%	0.622	75%	0.748	S	S	*	*			cis	179.2	-174.4	-22.5	52.3	0	0	0	0	110.1
1010	H	36.6	Very low	34.3	Very low	184 Å²	184	143.3 Å²	143.3	85%	0.852	74%	0.742	S	S	*	*			trans	105.1	169.6	167.9	-59	-70.5	0	0	0	119.1
1011	S	32.7	Very low	34.2	Very low	106 Å²	106	138.7 Å²	138.7	74%	0.741	73%	0.733	S	S	*	*			trans	-172.2	156.7	-155	173.7	0	0	0	0	111.1
1012	L	36	Very low	34.2	Very low	167 Å²	167	138.1 Å²	138.1	87%	0.874	74%	0.735	S	S	*	*			trans	-165.5	167.9	162.5	-107.3	163.5	0	0	0	113.7
1013	N	33.9	Very low	34.2	Very low	140 Å²	140	135.7 Å²	135.7	75%	0.749	73%	0.734	S	S	*	*			trans	-119.3	169.7	-165.8	-63.7	-47.9	0	0	0	114.8
1014	K	36.7	Very low	34.3	Very low	190 Å²	190	140 Å²	140	83%	0.826	74%	0.742	S	S	*	*				164.4	145.5	120.3	-87.6	-174.9	178.1	179.8	0	116.7
1015	H	38.3	Very low	34.2	Very low	167 Å²	167	139.7 Å²	139.7	77%	0.773	75%	0.745	S	S	*	*			trans	19.7	160.9	141.6	-64.7	-76.5	0	0	0	123.5
1016	D	36.7	Very low	34.4	Very low	114 Å²	114	140.5 Å²	140.5	61%	0.61	75%	0.748	S	S	*	*			cis	-151.7	-168.6	-1.1	-145.7	50.7	0	0	0	106.7	K1018	D1016-K1018 IonicContact OD2-NZ 2.73Å; D1016-K1018 PolarHBondContact OD2-NZ 3.05Å
1017	A	37.3	Very low	34.3	Very low	70 Å²	70	137.2 Å²	137.2	58%	0.579	75%	0.747	S	S	*	*			cis	-162.6	148.5	2.9	0	0	0	0	0	114.7
1018	K	35.9	Very low	34.4	Very low	155 Å²	155	135.7 Å²	135.7	67%	0.674	75%	0.747	S	S	*	*				56.1	125.2	128.3	-65.2	168.9	-170.7	107.9	0	125.5	D1016	D1016-K1018 IonicContact OD2-NZ 2.73Å; D1016-K1018 PolarHBondContact OD2-NZ 3.05Å
1019	R	32.4	Very low	34.4	Very low	214 Å²	214	137.1 Å²	137.1	81%	0.808	75%	0.752	S	S	*	*			trans	79.7	152.8	131.8	-73.6	175.4	172.2	178.6	-3.6	118.8
1020	K	34.9	Very low	34.3	Very low	172 Å²	172	138.9 Å²	138.9	75%	0.748	76%	0.759	S	S	*	*			cis	-155.5	150.9	11	-130.6	177.9	179.6	-174.6	0	113.9
1021	S	32.9	Very low	34.2	Very low	96 Å²	96	139.9 Å²	139.9	67%	0.671	76%	0.761	S	S	*	*			trans	-19.2	164.7	150.8	61.1	0	0	0	0	120.8
1022	S	31	Very low	34.1	Very low	117 Å²	117	144.4 Å²	144.4	82%	0.818	77%	0.767	S	S	*	*			cis	170.5	157	-8.8	54.2	0	0	0	0	111.5
1023	G	31.6	Very low	34.3	Very low	72 Å²	72	141.8 Å²	141.8	74%	0.742	76%	0.76	S	S	*	*			trans	149.6	118.9	146	0	0	0	0	0	122.6
1024	K	35.1	Very low	34.4	Very low	217 Å²	217	141 Å²	141	94%	0.943	76%	0.763	S	S	*	*			trans	67.1	141.7	142.1	-61.7	-174.2	177.6	-177.4	0	123.7
1025	S	29.2	Very low	34.1	Very low	115 Å²	115	136.6 Å²	136.6	80%	0.804	76%	0.756	S	S	*	*			trans	-109.9	-169.9	165.4	-37.1	0	0	0	0	109.5
1026	P	37.6	Very low	33.7	Very low	111 Å²	111	136.2 Å²	136.2	72%	0.721	76%	0.755	S	S	*	*			cis	-136.7	-173.7	-3.7	43	-23.7	0	0	0	116.3
1027	L	31.3	Very low	33.3	Very low	160 Å²	160	136.9 Å²	136.9	84%	0.838	76%	0.758	S	S	*	*			trans	11.2	162.3	146.4	-66	168.5	0	0	0	122.4
1028	P	38	Very low	32.9	Very low	109 Å²	109	144.8 Å²	144.8	71%	0.708	77%	0.774	S	S	*	*			cis	-141.2	-157.2	-20.3	32.1	-7.4	0	0	0	115.2
1029	V	31.6	Very low	32.8	Very low	114 Å²	114	146 Å²	146	69%	0.691	78%	0.783	S	S	*	*			trans	108.3	107.2	150.8	-170.5	0	0	0	0	121.3
1030	T	29.7	Very low	32.7	Very low	126 Å²	126	144 Å²	144	77%	0.773	79%	0.787	S	S	*	*			trans	64.5	152.1	157.9	66.3	0	0	0	0	119.2
1031	K	36.1	Very low	32.7	Very low	205 Å²	205	141.7 Å²	141.7	89%	0.891	79%	0.789	S	S	*	*			cis	-136.4	-172.1	24.7	-71.4	178	176.8	176.1	0	113.6
1032	K	31.1	Very low	32.6	Very low	201 Å²	201	141.7 Å²	141.7	87%	0.874	80%	0.796	S	S	*	*			trans	-79.7	164.2	-175.5	-100.2	-171.8	173.6	-174.9	0	114.9
1033	P	39.2	Very low	32.6	Very low	112 Å²	112	144.5 Å²	144.5	73%	0.727	80%	0.8	S	S	*	*			trans	-88.9	-179.8	-175.2	39.7	-38.9	0	0	0	113.8
1034	P	36.7	Very low	32.9	Very low	125 Å²	125	146.8 Å²	146.8	81%	0.812	80%	0.802	S	S	*	*				-135.9	-179.3	103.3	40.8	-31.2	0	0	0	115.8
1035	S	29.1	Very low	33	Very low	97 Å²	97	145.4 Å²	145.4	68%	0.678	80%	0.799	S	S	*	*			trans	-52.3	150.3	178.3	50.3	0	0	0	0	117.9
1036	H	30.8	Very low	33.5	Very low	159 Å²	159	144.9 Å²	144.9	74%	0.736	78%	0.784	S	S	*	*				168.8	163.9	105.5	-121	-91.7	0	0	0	112.2
1037	D	28	Very low	33.8	Very low	127 Å²	127	144.2 Å²	144.2	68%	0.679	78%	0.778	S	S	*	*			trans	64.9	126.8	160.3	-51.4	-29.2	0	0	0	121.8
1038	Y	29.4	Very low	34.1	Very low	236 Å²	236	145.9 Å²	145.9	93%	0.925	78%	0.778	S	S	*	*			trans	-139.8	104.3	162.4	-89.7	-78	0	0	0	109.7
1039	E	32.8	Very low	34.1	Very low	181 Å²	181	143.7 Å²	143.7	85%	0.846	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-75.8	162.8	167.6	-64.1	-178.2	110.1	0	0	111.5	P1041	E1039-P1041 WeakPolarHBondContact O-CD 3.49Å
1040	L	30.4	Very low	34.7	Very low	171 Å²	171	143 Å²	143	90%	0.895	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-73	128.1	178.1	-77.1	77.2	0	0	0	111.5
1041	P	35	Very low	35.5	Very low	124 Å²	124	144.1 Å²	144.1	81%	0.805	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-76.3	143.6	164.6	31.6	-32.9	0	0	0	111.2	E1039	E1039-P1041 WeakPolarHBondContact O-CD 3.49Å
1042	A	31.2	Very low	35.6	Very low	97 Å²	97	141.9 Å²	141.9	80%	0.802	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-78.6	160.5	-173.4	0	0	0	0	0	114.9
1043	L	31.6	Very low	36.2	Very low	175 Å²	175	141.5 Å²	141.5	92%	0.916	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-71.6	133.4	175.9	-71.4	161.1	0	0	0	112.6
1044	P	37.2	Very low	36.5	Very low	120 Å²	120	145.2 Å²	145.2	78%	0.779	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-89.8	152	161.2	32.7	-27.9	0	0	0	112.1
1045	E	37.1	Very low	36.5	Very low	189 Å²	189	146.2 Å²	146.2	88%	0.883	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-76.4	141.9	-174.2	-59.5	-177.6	109.8	0	0	114.5	T1047	E1045-T1047 PolarHBondContact O-N 3.01Å
1046	E	40.3	Very low	36.9	Very low	104 Å²	104	148.8 Å²	148.8	49%	0.486	75%	0.754	S	S	.	*	P	Polyproline II helix	trans	-61.8	118	167.1	-82.5	-162.9	156.7	0	0	110.6	K1054	E1046-K1054 IonicContact OE1-NZ 2.94Å; E1046-K1054 PolarHBondContact OE1-NZ 2.73Å; E1046-K1054 IonicContact OE2-NZ 3.71Å
1047	T	43.7	Very low	37.2	Very low	96 Å²	96	148.2 Å²	148.2	59%	0.589	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-74.3	153.7	177.5	69.2	0	0	0	0	112.5	E1045 A1049 E1050	E1045-T1047 PolarHBondContact O-N 3.01Å; T1047-A1049 PolarHBondContact O-N 3.24Å; T1047-E1050 PolarHBondContact O-N 3.29Å; T1047-E1050 VanDerWaalsContact O-N 3.14Å
1048	K	37.6	Very low	37.8	Very low	195 Å²	195	149.5 Å²	149.5	85%	0.848	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.2	-20.1	-179.9	-98.5	178.6	175.2	173.5	0	115.4
1049	A	38.4	Very low	38.3	Very low	64 Å²	64	144.1 Å²	144.1	53%	0.529	75%	0.749	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.8	-29.9	-179.8	0	0	0	0	0	113.9	T1047 L1052	T1047-A1049 PolarHBondContact O-N 3.24Å; A1049-L1052 PolarHBondContact O-N 3Å
1050	E	44.1	Very low	38.7	Very low	99 Å²	99	141.6 Å²	141.6	46%	0.463	74%	0.742	S	S	.	*	G	3₁₀ helix	trans	-79.4	-28	179.9	-73.2	-175.6	103.2	0	0	112.7	T1047 L1052 K1053 K1054	T1047-E1050 PolarHBondContact O-N 3.29Å; T1047-E1050 VanDerWaalsContact O-N 3.14Å; E1050-L1052 PolarHBondContact O-N 3.32Å; E1050-K1053 PolarHBondContact O-N 3.35Å; E1050-K1053 VanDerWaalsContact O-N 3.14Å; E1050-K1054 PolarHBondContact O-N 3.2Å
1051	K	45.6	Very low	39.3	Very low	149 Å²	149	139.5 Å²	139.5	65%	0.648	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-72	2.4	169.9	-72	-178.7	177.4	171.8	0	114.2
1052	L	39.1	Very low	39.6	Very low	159 Å²	159	140.7 Å²	140.7	83%	0.832	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-114.9	4.8	170.6	-123.5	81.3	0	0	0	113.3	A1049 E1050	A1049-L1052 PolarHBondContact O-N 3Å; E1050-L1052 PolarHBondContact O-N 3.32Å
1053	K	44	Very low	40.3	Very low	193 Å²	193	144.3 Å²	144.3	84%	0.839	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.6	-22.4	178.6	-86.4	-175.9	172.8	179.4	0	114	E1050	E1050-K1053 PolarHBondContact O-N 3.35Å; E1050-K1053 VanDerWaalsContact O-N 3.14Å
1054	K	44.9	Very low	41.1	Very low	189 Å²	189	141.5 Å²	141.5	82%	0.822	70%	0.702	S	S	*	*			trans	-77.8	0	162.4	-64.9	170.4	-173.5	167.5	0	108.9	E1046 E1050	E1046-K1054 IonicContact OE1-NZ 2.94Å; E1046-K1054 PolarHBondContact OE1-NZ 2.73Å; E1046-K1054 IonicContact OE2-NZ 3.71Å; E1050-K1054 PolarHBondContact O-N 3.2Å

Retrieved 1,054 of 1,054 residues in 542.9 ms (Link to these results)

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